COc1ccccc1[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500015	FE	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500015	FE	On-Demand	Anodyne	DRD2	18	43
COc1ccccc1[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500015	FE	On-Demand	Anodyne	ADRA1D	44	37
COc1ccccc1[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500015	FE	On-Demand	Anodyne	ADRA1B	43	37
COc1ccccc1[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500017	FE	On-Demand	Anodyne	HTR1A	15	40
COc1ccccc1[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500017	FE	On-Demand	Anodyne	DRD2	18	43
COc1ccccc1[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500017	FE	On-Demand	Anodyne	ADRA1D	44	37
COc1ccccc1[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853500017	FE	On-Demand	Anodyne	ADRA1B	43	37
CC(C)[C@H]1CCN(CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000853500160	EE	On-Demand	Anodyne	GPR119	34	40
CC(C)[C@H]1CCN(CN(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1=O	ZINC000853500161	EE	On-Demand	Anodyne	GPR119	34	40
C[C@@H]1CCCN(C(=O)NCc2nc(Cc3ccccc3)no2)[C@@H]1CCO	ZINC000853500179	FE	On-Demand	Anodyne	PREP	28	41
C[C@@H]1CCCN(C(=O)NCc2nc(Cc3ccccc3)no2)[C@H]1CCO	ZINC000853500182	FE	On-Demand	Anodyne	PREP	28	41
O=c1c2ccc(F)cc2nnn1CN1CCN(c2nc3ccccc3o2)CC1	ZINC000853500329	GD	On-Demand	Anodyne	HTR7	20	44
O=C(NCc1nc(Cc2ccccc2)no1)N1CCCC[C@@H]1CC1CCC1	ZINC000853500403	FH	On-Demand	Anodyne	CPT1A	57	36
O=C(NCc1nc(Cc2ccccc2)no1)N1CCCC[C@H]1CC1CCC1	ZINC000853500404	FH	On-Demand	Anodyne	CPT1A	57	36
O=C(NCc1nc(Cc2ccccc2)no1)NCC1CCC(O)CC1	ZINC000853500432	EE	On-Demand	Anodyne	VCP	51	37
CN(C[C@@H]1CCN(Cc2ccccc2)C1)CN1Cc2cc(F)c(F)cc2C1=O	ZINC000853500548	GG	On-Demand	Anodyne	DRD4	27	43
CN(C[C@@H]1CCN(Cc2ccccc2)C1)CN1Cc2cc(F)c(F)cc2C1=O	ZINC000853500548	GG	On-Demand	Anodyne	ACHE	39	48
CN(C[C@@H]1CCN(Cc2ccccc2)C1)CN1Cc2cc(F)c(F)cc2C1=O	ZINC000853500548	GG	On-Demand	Anodyne	SIGMAR1	44	38
CCO[C@@H]1C[C@@H](NC(=O)NCc2nc(Cc3ccccc3)no2)C1	ZINC000853500564	EE	On-Demand	Anodyne	TIMP3	53	31
CCN1CC[C@H](N(CC)C(=O)NCc2nc(Cc3ccccc3)no2)C1	ZINC000853500664	FE	On-Demand	Anodyne	CCR5	48	52
CCN1CC[C@@H](N(CC)C(=O)NCc2nc(Cc3ccccc3)no2)C1	ZINC000853500665	FE	On-Demand	Anodyne	CCR5	48	52
CC(C)[C@H]1CCN(CN(C)C[C@@H]2CCN(Cc3ccccc3)C2)C1=O	ZINC000853500691	EF	On-Demand	Anodyne	ACHE	42	45
CC(C)[C@H]1CCN(CN(C)C[C@@H]2CCN(Cc3ccccc3)C2)C1=O	ZINC000853500691	EF	On-Demand	Anodyne	SIGMAR1	51	41
CC(C)[C@H]1CCN(CN(C)C[C@H]2CCN(Cc3ccccc3)C2)C1=O	ZINC000853500693	EF	On-Demand	Anodyne	ACHE	42	45
CC(C)[C@H]1CCN(CN(C)C[C@H]2CCN(Cc3ccccc3)C2)C1=O	ZINC000853500693	EF	On-Demand	Anodyne	SIGMAR1	51	41
CC(C)c1ccc(CN(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c(=O)c1	ZINC000853500705	GG	On-Demand	Anodyne	GPR119	31	42
CC(C)c1ccc(CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(O)c(=O)c1	ZINC000853500707	GG	On-Demand	Anodyne	GPR119	31	42
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC(c2ccon2)CC1	ZINC000853500751	FF	On-Demand	Anodyne	SMO	38	41
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853500887	GE	On-Demand	Anodyne	L3MBTL3	49	38
O=C(NCc1nc(Cc2ccccc2)no1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853500889	GE	On-Demand	Anodyne	L3MBTL3	49	38
Cc1ccc(CNC(=O)C2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)cc1	ZINC000853500891	FF	On-Demand	Anodyne	EPHX2	24	42
Cc1ccc(CNC(=O)C2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)cc1	ZINC000853500898	FF	On-Demand	Anodyne	EPHX2	24	42
COC(=O)CCC1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853500909	EG	On-Demand	Anodyne	CACNA1I	46	34
CN(C[C@@H]1CCN(Cc2ccccc2)C1)Cn1ncc(Cl)c1C1CC1	ZINC000853500972	FH	On-Demand	Anodyne	DRD4	26	41
O=C(NC[C@H]1CCCN(Cn2ncc(Cl)c2C2CC2)C1)c1ccccc1	ZINC000853501087	FH	On-Demand	Anodyne	CCR3	21	42
O=C(NC[C@H]1CCCN(Cn2ncc(Cl)c2C2CC2)C1)c1ccccc1	ZINC000853501087	FH	On-Demand	Anodyne	CACNA1I	56	36
O=C(NCc1nc(Cc2ccccc2)no1)NCc1cccnc1N1CCCC1	ZINC000853501129	GF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1nc(Cc2ccccc2)no1)NCc1cccnc1N1CCCC1	ZINC000853501129	GF	On-Demand	Anodyne	SCN10A	19	43
O=C(NCc1nc(Cc2ccccc2)no1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853501152	GF	On-Demand	Anodyne	CCR3	46	38
O=C(NCc1nc(Cc2ccccc2)no1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853501154	GF	On-Demand	Anodyne	CCR3	46	38
CC(C)[C@H]1CCN(CN2CC[C@H](OCCCc3ccccc3)C2)C1=O	ZINC000853501461	EG	On-Demand	Anodyne	SIGMAR1	27	54
CC(C)[C@H]1CCN(CN2CC[C@@H](OCCCc3ccccc3)C2)C1=O	ZINC000853501462	EG	On-Demand	Anodyne	SIGMAR1	27	54
Cc1ccc(CNC(=O)C2CCN(Cn3nc(C)oc3=O)CC2)cc1	ZINC000853501546	ED	On-Demand	Anodyne	EPHX2	23	42
Cc1ccc(CNC(=O)C2CCN(Cn3ncc(Cl)c3C3CC3)CC2)cc1	ZINC000853501589	GH	On-Demand	Anodyne	EPHX2	21	46
O=C(NCCCC1CCC1)NCc1nc(Cc2ccccc2)no1	ZINC000853501596	EG	On-Demand	Anodyne	BMP1	57	42
O=C(NC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)c1ccccc1	ZINC000853501783	GE	On-Demand	Anodyne	SLC6A1	45	35
O=C(NC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)c1ccccc1	ZINC000853501783	GE	On-Demand	Anodyne	CCR3	84	36
O=C(NC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)c1ccccc1	ZINC000853501783	GE	On-Demand	Anodyne	Q8MHZ5_SHEEP	63	35
O=C(CCc1ccccc1)N1CCCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853502259	GH	On-Demand	Anodyne	PREP	41	39
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502439	GG	On-Demand	Anodyne	DRD4	19	41
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502439	GG	On-Demand	Anodyne	KCNH2	15	42
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502439	GG	On-Demand	Anodyne	CTSV	21	42
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502439	GG	On-Demand	Anodyne	MCHR1	25	43
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502439	GG	On-Demand	Anodyne	BIRC2	42	38
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502441	GG	On-Demand	Anodyne	DRD4	19	41
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502441	GG	On-Demand	Anodyne	KCNH2	15	42
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502441	GG	On-Demand	Anodyne	CTSV	21	42
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502441	GG	On-Demand	Anodyne	MCHR1	25	43
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)c3cc4ccccc4o3)C2)C1=O	ZINC000853502441	GG	On-Demand	Anodyne	BIRC2	42	38
O=C1c2cc(F)c(F)cc2CN1CN1CCC2(CC1)OCc1ccccc12	ZINC000853502508	FG	On-Demand	Anodyne	SIGMAR1	22	51
O=C1c2cc(F)c(F)cc2CN1CN1CCC2(CC1)OCc1ccccc12	ZINC000853502508	FG	On-Demand	Anodyne	MCHR1	22	45
CC(C)[C@H]1CCN(CN2CCN(C3CCCCC3)CC2)C1=O	ZINC000853502510	DE	On-Demand	Anodyne	EBP	17	46
CC(C)(C)OC(=O)C[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853502641	GE	On-Demand	Anodyne	CCR3	68	33
CC(C)(C)OC(=O)C[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853502642	GE	On-Demand	Anodyne	CCR3	68	33
CCOC(=O)CNC(=O)C1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853502755	GC	On-Demand	Anodyne	CACNA1G	38	40
O=[N+]([O-])c1cn(CN2CCC(CCCN3CCCC3)CC2)nc1-c1ccccn1	ZINC000853502856	GG	On-Demand	Bother	NPY1R	43	35
COC(=O)CCCCNC(=O)N[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853502883	FE	On-Demand	Anodyne	EPHX2	25	49
COC(=O)CCCCNC(=O)N[C@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853502884	FE	On-Demand	Anodyne	EPHX2	25	49
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)N1CCC[C@H](CC#N)C1	ZINC000853502893	FG	On-Demand	Mild	PREP	15	43
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)N1CCC[C@@H](CC#N)C1	ZINC000853502894	FG	On-Demand	Mild	PREP	15	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N1CCC[C@H](CC#N)C1	ZINC000853502895	FG	On-Demand	Mild	PREP	15	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N1CCC[C@@H](CC#N)C1	ZINC000853502896	FG	On-Demand	Mild	PREP	15	43
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	HTR1A	16	41
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	DRD2	15	47
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	DRD4	43	34
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	LTA4H	33	46
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	HRH3	29	53
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	SIGMAR1	19	41
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	EBP	44	38
COc1cccc(OCCN2CCN(CN3CC[C@@H](C(C)C)C3=O)CC2)c1	ZINC000853502938	GE	On-Demand	Anodyne	CHRNA10	25	42
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	HTR1A	16	41
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	DRD2	15	47
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	DRD4	43	34
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	LTA4H	33	46
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	HRH3	29	53
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	SIGMAR1	19	41
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	EBP	44	38
COc1cccc(OCCN2CCN(CN3CC[C@H](C(C)C)C3=O)CC2)c1	ZINC000853502939	GE	On-Demand	Anodyne	CHRNA10	25	42
C=C(Br)CNC(=O)NCC[C@@H](C)N(C)C	ZINC000853503090	CD	On-Demand	Mild	CHRNA4	19	43
C=C(Br)CNC(=O)NCC[C@H](C)N(C)C	ZINC000853503091	CD	On-Demand	Mild	CHRNA4	19	43
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]1C[C@H](O)C1	ZINC000853503100	CD	On-Demand	Anodyne	NOS2	93	36
O=C(NCc1ccc(-n2ccnc2)cc1)NC1CC(CO)C1	ZINC000853503110	DD	On-Demand	Anodyne	NOS2	79	35
C=C(Br)CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853503112	EF	On-Demand	Mild	EPHX2	26	51
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)N1CCC(c2ccon2)CC1	ZINC000853503119	GG	On-Demand	Anodyne	SMO	26	43
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N1CCC(c2ccon2)CC1	ZINC000853503120	GG	On-Demand	Anodyne	SMO	26	43
CC(C)[C@H]1CCN(CN2CCC3(CC2)OCc2ccccc23)C1=O	ZINC000853503126	EF	On-Demand	Anodyne	SIGMAR1	33	54
C=C(Br)CNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853503194	ED	On-Demand	Mild	L3MBTL3	47	38
O=c1c2ccc(F)cc2nnn1CN1CCC2(CC1)OCc1ccccc12	ZINC000853503199	FE	On-Demand	Anodyne	SIGMAR1	18	52
COc1cccc(C=C2CCN(Cn3nc(C)oc3=O)CC2)c1	ZINC000853503200	DE	On-Demand	Anodyne	DRD4	40	32
C=C(Br)CNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853503249	ED	On-Demand	Mild	L3MBTL3	47	38
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](Cn2ccnn2)C1	ZINC000853503312	EC	On-Demand	Anodyne	Q8MHZ5_SHEEP	59	37
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](Cn2ccnn2)C1	ZINC000853503314	EC	On-Demand	Anodyne	Q8MHZ5_SHEEP	59	37
CON(C)CCNC(=O)N[C@@H](C)CC(C)(C)c1ccccc1	ZINC000853503331	DF	On-Demand	Anodyne	AMY2	53	32
CON(C)CCNC(=O)N[C@H](C)CC(C)(C)c1ccccc1	ZINC000853503333	DF	On-Demand	Anodyne	AMY2	53	32
C=C(Br)CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853503398	FD	On-Demand	Mild	SIGMAR1	21	43
C=C(Br)CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853503398	FD	On-Demand	Mild	CCR3	22	42
C=C(Br)CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853503400	FD	On-Demand	Mild	SIGMAR1	21	43
C=C(Br)CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853503400	FD	On-Demand	Mild	CCR3	22	42
C=C(Br)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853503409	EE	On-Demand	Mild	MME	44	38
C=C(Br)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853503409	EE	On-Demand	Mild	NPY5R	20	44
C=C(Br)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853503410	EE	On-Demand	Mild	MME	44	38
C=C(Br)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853503410	EE	On-Demand	Mild	NPY5R	20	44
COc1cccc(OCCN2CCN(Cn3ncc(Cl)c3C3CC3)CC2)c1	ZINC000853503415	GG	On-Demand	Anodyne	DRD4	43	34
COc1cccc(OCCN2CCN(Cn3ncc(Cl)c3C3CC3)CC2)c1	ZINC000853503415	GG	On-Demand	Anodyne	LTA4H	17	41
COc1cccc(OCCN2CCN(Cn3ncc(Cl)c3C3CC3)CC2)c1	ZINC000853503415	GG	On-Demand	Anodyne	CHRNA10	22	40
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(O)(CO)CC1	ZINC000853503460	EC	On-Demand	Anodyne	NOS2	92	39
COCc1n[nH]c(CNC(=O)NCc2ccc(-n3ccnc3)cc2)n1	ZINC000853503472	ED	On-Demand	Anodyne	NOS2	69	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCn2c(O)nnc2C1	ZINC000853503509	EC	On-Demand	Anodyne	NOS2	61	36
CC(C)(CO)[C@H](NC(=O)NCc1ccc(-n2ccnc2)cc1)C1CC1	ZINC000853503519	EE	On-Demand	Anodyne	NOS2	80	37
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853503521	ED	On-Demand	Anodyne	NOS2	89	37
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]1C[C@H](O)C12CCC2	ZINC000853503523	ED	On-Demand	Anodyne	NOS2	89	37
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853503525	ED	On-Demand	Anodyne	NOS2	89	37
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853503527	ED	On-Demand	Anodyne	NOS2	89	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC2(COC2)C1	ZINC000853503530	DD	On-Demand	Anodyne	NOS2	96	38
CC(C)[C@H]1CCN(CN(C)c2cc(Cl)ccc2C#N)C1=O	ZINC000853503536	DG	On-Demand	Mild	NOS2	18	46
CC(C)[C@H]1CCN(CN(C)c2cc(Cl)ccc2C#N)C1=O	ZINC000853503536	DG	On-Demand	Mild	NOS3	21	46
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853503599	ED	On-Demand	Anodyne	NOS2	84	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853503603	FD	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853503603	FD	On-Demand	Anodyne	L3MBTL3	43	32
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853503603	FD	On-Demand	Anodyne	NAMPT	27	43
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853503605	FD	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853503605	FD	On-Demand	Anodyne	L3MBTL3	43	32
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853503605	FD	On-Demand	Anodyne	NAMPT	27	43
COC(=O)CCCCNC(=O)NNc1cc(F)ccc1C	ZINC000853503608	CE	On-Demand	Reactive	LEF	40	32
COc1cccc(OCCN2CCN(Cn3nc(C)oc3=O)CC2)c1	ZINC000853503650	EC	On-Demand	Anodyne	HTR1A	18	45
COc1cccc(OCCN2CCN(Cn3nc(C)oc3=O)CC2)c1	ZINC000853503650	EC	On-Demand	Anodyne	DRD4	44	35
COc1cccc(OCCN2CCN(Cn3nc(C)oc3=O)CC2)c1	ZINC000853503650	EC	On-Demand	Anodyne	LTA4H	29	44
COc1cccc(OCCN2CCN(Cn3nc(C)oc3=O)CC2)c1	ZINC000853503650	EC	On-Demand	Anodyne	HRH3	19	48
COc1cccc(OCCN2CCN(Cn3nc(C)oc3=O)CC2)c1	ZINC000853503650	EC	On-Demand	Anodyne	SIGMAR1	17	42
C=C(Br)CNC(=O)NC[C@H](O)COc1ccc(CCOC)cc1	ZINC000853503705	GD	On-Demand	Mild	ADRB2	40	58
C=C(Br)CNC(=O)NC[C@H](O)COc1ccc(CCOC)cc1	ZINC000853503705	GD	On-Demand	Mild	ADRB1	72	58
C=C(Br)CNC(=O)NC[C@H](O)COc1ccc(CCOC)cc1	ZINC000853503705	GD	On-Demand	Mild	ADRB3	44	42
C=C(Br)CNC(=O)NC[C@@H](O)COc1ccc(CCOC)cc1	ZINC000853503706	GD	On-Demand	Mild	ADRB2	40	58
C=C(Br)CNC(=O)NC[C@@H](O)COc1ccc(CCOC)cc1	ZINC000853503706	GD	On-Demand	Mild	ADRB1	72	58
C=C(Br)CNC(=O)NC[C@@H](O)COc1ccc(CCOC)cc1	ZINC000853503706	GD	On-Demand	Mild	ADRB3	44	42
COC(=O)C[C@H]1CCCN1Cn1nnc2cc(F)ccc2c1=O	ZINC000853503713	DC	On-Demand	Anodyne	ACKR3	45	32
COC(=O)C[C@@H]1CCCN1Cn1nnc2cc(F)ccc2c1=O	ZINC000853503714	DC	On-Demand	Anodyne	ACKR3	45	32
CS(=O)(=O)C1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853503824	EC	On-Demand	Anodyne	NOS2	102	40
CS(=O)(=O)C1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853503824	EC	On-Demand	Anodyne	NAMPT	41	41
CN1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)CCC1=O	ZINC000853503853	ED	On-Demand	Anodyne	NOS2	84	37
CN1CCN(c2ncccc2CNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853503859	GE	On-Demand	Reactive	DRD1	49	38
CN1CCN(c2ncccc2CNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853503859	GE	On-Demand	Reactive	P2RX7	43	40
CN1CCN(c2ncccc2CNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853503859	GE	On-Demand	Reactive	SCN2A	17	41
CN1CCN(c2ncccc2CNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853503859	GE	On-Demand	Reactive	ABCC1	59	35
CN1CCN(c2ncccc2CNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853503859	GE	On-Demand	Reactive	SCN10A	27	41
C=C(Br)CNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1	ZINC000853503869	FE	On-Demand	Mild	CPT1A	54	35
C=C(Br)CNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1	ZINC000853503871	FE	On-Demand	Mild	CPT1A	54	35
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H](c1ccncc1)C1(CO)CCC1	ZINC000853503873	GF	On-Demand	Anodyne	NOS2	77	35
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H](c1ccncc1)C1(CO)CCC1	ZINC000853503875	GF	On-Demand	Anodyne	NOS2	77	35
CC(C)[C@H]1CCN(CN2CCC(Oc3ccccc3Cl)CC2)C1=O	ZINC000853503893	FH	On-Demand	Anodyne	SCD1	29	43
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853503901	FE	On-Demand	Anodyne	CPT1A	52	36
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853503901	FE	On-Demand	Anodyne	NOS2	81	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853503904	FE	On-Demand	Anodyne	CPT1A	52	36
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853503904	FE	On-Demand	Anodyne	NOS2	81	41
CN(C)CCC[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)CCO1	ZINC000853503912	FE	On-Demand	Anodyne	NOS2	103	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853503916	GG	On-Demand	Anodyne	NOS2	60	35
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853503917	GG	On-Demand	Anodyne	NOS2	60	35
O=C(NCc1ccc(-n2ccnc2)cc1)N(CCOCCO)C1CCC1	ZINC000853503947	FD	On-Demand	Anodyne	NOS2	76	37
C=C(Br)CNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853503969	DG	On-Demand	Mild	IMDH_CRYPV	62	41
CC(C)[C@H]1CCN(CN2CCN(Cc3cccc(F)c3)CC2)C1=O	ZINC000853504031	EE	On-Demand	Anodyne	DRD4	18	42
CC(C)[C@H]1CCN(CN2CCN(Cc3cccc(F)c3)CC2)C1=O	ZINC000853504031	EE	On-Demand	Anodyne	SIGMAR1	28	48
CC(C)[C@H]1CCN(CN2CCN(Cc3cccc(F)c3)CC2)C1=O	ZINC000853504031	EE	On-Demand	Anodyne	CACNA1G	20	40
C=C(Br)CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853504044	DD	On-Demand	Mild	CPT1A	72	36
C=C(Br)CNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853504045	DD	On-Demand	Mild	CPT1A	72	36
O=c1c2ccc(F)cc2nnn1CN1CCC(Oc2ccccc2Cl)CC1	ZINC000853504113	GG	On-Demand	Anodyne	SCD1	44	40
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@@H](CO)CC1CC1	ZINC000853504235	EE	On-Demand	Anodyne	NOS2	70	35
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@H](CO)CC1CC1	ZINC000853504236	EE	On-Demand	Anodyne	NOS2	70	35
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853504281	GG	On-Demand	Anodyne	NOS2	95	41
COC(=O)CCCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853504296	FF	On-Demand	Reactive	CSNK1D	44	48
CN(CC(=O)N1CCCC1)C(=O)NC[C@@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000853504313	GE	On-Demand	Anodyne	PREP	21	45
CN(CC(=O)N1CCCC1)C(=O)NC[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000853504314	GE	On-Demand	Anodyne	PREP	21	45
COC(=O)CCCCNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853504318	DD	On-Demand	Anodyne	EPHX2	29	50
COC(=O)CCCCNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853504320	DD	On-Demand	Anodyne	EPHX2	29	50
COC(=O)CCCCNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853504322	DD	On-Demand	Anodyne	EPHX2	29	50
COC(=O)CCCCNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853504324	DD	On-Demand	Anodyne	EPHX2	29	50
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]([C@H]1CCCO1)C1(CO)CCC1	ZINC000853504325	GE	On-Demand	Anodyne	NOS2	89	36
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]([C@@H]1CCCO1)C1(CO)CCC1	ZINC000853504327	GE	On-Demand	Anodyne	NOS2	89	36
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]([C@@H]1CCCO1)C1(CO)CCC1	ZINC000853504328	GE	On-Demand	Anodyne	NOS2	89	36
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]([C@H]1CCCO1)C1(CO)CCC1	ZINC000853504330	GE	On-Demand	Anodyne	NOS2	89	36
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853504349	ED	On-Demand	Anodyne	NOS2	44	34
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853504351	ED	On-Demand	Anodyne	NOS2	44	34
COC(=O)CCCCNC(=O)NCCN(C)OC	ZINC000853504384	CC	On-Demand	Anodyne	EPHX2	17	52
CCOC(=O)CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853504388	FD	On-Demand	Anodyne	CCR3	83	33
CCOC(=O)CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853504388	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	35
CCOC(=O)CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853504390	FD	On-Demand	Anodyne	CCR3	83	33
CCOC(=O)CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853504390	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	35
CCn1c(O)nnc1C1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)CC1	ZINC000853504391	GE	On-Demand	Anodyne	NOS2	76	37
COc1ccccc1NC(=O)CN1CCN(Cn2nc(C)oc2=O)CC1	ZINC000853504405	FC	On-Demand	Anodyne	DRD4	23	46
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H](Cn2ccnn2)C1	ZINC000853504406	FD	On-Demand	Anodyne	NOS2	87	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853504408	FD	On-Demand	Anodyne	NOS2	87	37
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853504422	GE	On-Demand	Anodyne	NOS2	84	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853504425	GE	On-Demand	Anodyne	NOS2	84	36
O=C(NCc1ccc(-n2ccnc2)cc1)NCC1CCC(O)CC1	ZINC000853504427	EE	On-Demand	Anodyne	NOS2	93	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853504456	EE	On-Demand	Anodyne	NOS2	96	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@](O)(C2CC2)C1	ZINC000853504457	EE	On-Demand	Anodyne	NOS2	96	38
C[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)[C@@H]1CCO	ZINC000853504460	EF	On-Demand	Anodyne	NOS2	95	40
C[C@@H]1CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)[C@H]1CCO	ZINC000853504462	EF	On-Demand	Anodyne	NOS2	95	40
COC(=O)c1ccc2c(c1)CCN2CN1Cc2cc(F)c(F)cc2C1=O	ZINC000853504475	FF	On-Demand	Anodyne	SRD5A1	18	44
CCc1nc2ccccc2n1C1CCN(Cn2nc(C)oc2=O)CC1	ZINC000853504554	EE	On-Demand	Anodyne	FPR2	24	43
C=C(Br)CNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853504561	EF	On-Demand	Mild	MTNR1A	34	40
C=C(Br)CNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853504561	EF	On-Demand	Mild	MTNR1B	35	40
C=C(Br)CNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853504563	EF	On-Demand	Mild	MTNR1A	34	40
C=C(Br)CNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853504563	EF	On-Demand	Mild	MTNR1B	35	40
C=C(Br)CNC(=O)NC1(c2cccc(OC)c2)CCC1	ZINC000853504583	EG	On-Demand	Mild	DRD4	40	31
C#CCCN(CCOC)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504599	EE	On-Demand	Mild	NOS2	53	37
COc1ccccc1NC(=O)CN1CCN(CN2CC[C@@H](C(C)C)C2=O)CC1	ZINC000853504607	GD	On-Demand	Anodyne	DRD4	23	43
COc1ccccc1NC(=O)CN1CCN(CN2CC[C@H](C(C)C)C2=O)CC1	ZINC000853504609	GD	On-Demand	Anodyne	DRD4	23	43
C[C@@H](CCNC(=O)NCc1ccc(-n2ccnc2)cc1)N(C)C	ZINC000853504684	DE	On-Demand	Anodyne	NOS2	87	35
O=C(NCc1ccc(-n2ccnc2)cc1)N(CCN1CCOCC1)CC1CC1	ZINC000853504688	GE	On-Demand	Anodyne	CASR	46	40
O=C(NCc1ccc(-n2ccnc2)cc1)N(CCN1CCOCC1)CC1CC1	ZINC000853504688	GE	On-Demand	Anodyne	NOS2	92	36
O=C(NCc1ccc(-n2ccnc2)cc1)N(CCN1CCOCC1)CC1CC1	ZINC000853504688	GE	On-Demand	Anodyne	NAMPT	15	40
N#C[C@@H]1CCCC[C@H]1NC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504702	DF	On-Demand	Mild	NOS2	46	38
N#C[C@H]1CCCC[C@H]1NC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504703	DF	On-Demand	Mild	NOS2	46	38
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504704	DF	On-Demand	Mild	NOS2	46	38
N#C[C@H]1CCCC[C@@H]1NC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504705	DF	On-Demand	Mild	NOS2	46	38
COC(=O)c1ccc2c(c1)CCN2Cn1nc(C)oc1=O	ZINC000853504709	CC	On-Demand	Anodyne	SRD5A1	21	48
Cc1ccc(CC2CN(C(=O)NCc3ccc(-n4ccnc4)cc3)C2)cc1	ZINC000853504714	FH	On-Demand	Anodyne	NOS2	91	37
CC[C@H](C)N(CC)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504721	DG	On-Demand	Anodyne	NOS2	80	35
CC[C@H](C)N(CC)C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504721	DG	On-Demand	Anodyne	CYP2C19	16	40
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2	ZINC000853504730	GE	On-Demand	Anodyne	NOS2	90	36
COc1cccc(C2(NC(=O)NCc3ccc(-n4ccnc4)cc3)CCC2)c1	ZINC000853504753	GH	On-Demand	Anodyne	NOS2	66	41
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853504803	GF	On-Demand	Anodyne	CPT1A	41	33
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853504804	GF	On-Demand	Anodyne	CPT1A	41	33
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853504805	GF	On-Demand	Anodyne	CPT1A	41	33
CC(C)(C)OC(=O)N1CCCC[C@H]1CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853504806	GF	On-Demand	Anodyne	CPT1A	41	33
Cc1nn(C)cc1[C@@H]1OCC[C@H]1NC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853504919	GE	On-Demand	Anodyne	NOS2	89	36
O=C1CCCN1C[C@@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853504947	FE	On-Demand	Anodyne	NOS2	95	37
O=C1CCCN1C[C@H]1CCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853504949	FE	On-Demand	Anodyne	NOS2	95	37
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@@H](C)C1O	ZINC000853504955	EE	On-Demand	Anodyne	NOS2	99	40
C#CCCN(CCOC)C(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853504966	GC	On-Demand	Mild	CACNA1D	56	39
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853504988	GE	On-Demand	Anodyne	NOS2	94	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853504988	GE	On-Demand	Anodyne	L3MBTL3	74	43
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853504988	GE	On-Demand	Anodyne	NAMPT	36	44
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853504990	GE	On-Demand	Anodyne	NOS2	94	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853504990	GE	On-Demand	Anodyne	L3MBTL3	74	43
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853504990	GE	On-Demand	Anodyne	NAMPT	36	44
COCC1(NC(=O)NCc2ccc(-n3ccnc3)cc2)CCCC1	ZINC000853505001	EF	On-Demand	Anodyne	NOS2	95	43
CN1C[C@H](CNC(=O)NCc2ccc(-n3ccnc3)cc2)CC1=O	ZINC000853505011	ED	On-Demand	Anodyne	NOS2	76	35
CN1C[C@@H](CNC(=O)NCc2ccc(-n3ccnc3)cc2)CC1=O	ZINC000853505014	ED	On-Demand	Anodyne	NOS2	76	35
O=C1c2cc(F)c(F)cc2CN1CN1CCN(c2ccc(F)cn2)CC1	ZINC000853505037	FE	On-Demand	Anodyne	SLC27A1	40	39
CC(C)(C)N1C[C@H](CNC(=O)NCc2ccc(-n3ccnc3)cc2)CC1=O	ZINC000853505039	FE	On-Demand	Anodyne	NOS2	59	33
CC(C)(C)N1C[C@@H](CNC(=O)NCc2ccc(-n3ccnc3)cc2)CC1=O	ZINC000853505040	FE	On-Demand	Anodyne	NOS2	59	33
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853505133	GG	On-Demand	Anodyne	HCRTR1	16	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853505134	GG	On-Demand	Anodyne	HCRTR1	16	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853505135	GG	On-Demand	Anodyne	HCRTR1	16	40
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853505136	GG	On-Demand	Anodyne	HCRTR1	16	40
C=C(Br)CNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853505170	GF	On-Demand	Mild	HTR1A	21	42
COCCN(CCF)C(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853505193	GC	On-Demand	Bother	CACNA1C	40	35
COCCN(CCF)C(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853505193	GC	On-Demand	Bother	CACNA1D	64	34
CC(C)[C@H]1CCN(CN2CCN(c3ccc(F)cn3)CC2)C1=O	ZINC000853505202	DD	On-Demand	Anodyne	SLC27A1	42	42
O=C(NCc1ccc(-n2ccnc2)cc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853505243	DF	On-Demand	Anodyne	NOS2	95	39
CON(C)CCNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853505244	GB	On-Demand	Bother	CACNA1C	41	34
CON(C)CCNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853505244	GB	On-Demand	Bother	CACNA1D	65	34
C[C@H]1CC[C@@H](NC(=O)NCc2ccc(-n3ccnc3)cc2)CS1(=O)=O	ZINC000853505257	FD	On-Demand	Anodyne	NOS2	63	35
C[C@@H]1CC[C@H](NC(=O)NCc2ccc(-n3ccnc3)cc2)CS1(=O)=O	ZINC000853505259	FD	On-Demand	Anodyne	NOS2	63	35
C[C@H]1CC[C@H](NC(=O)NCc2ccc(-n3ccnc3)cc2)CS1(=O)=O	ZINC000853505262	FD	On-Demand	Anodyne	NOS2	63	35
CC[C@@H](O)CNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853505264	CD	On-Demand	Anodyne	NOS2	62	34
CC[C@@H](O)CNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853505264	CD	On-Demand	Anodyne	CYP2C19	15	40
CC(C)[C@H]1CCN(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853505296	GH	On-Demand	Anodyne	SIGMAR1	30	57
CC(C)[C@H]1CCN(CN2CCN(CCc3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853505296	GH	On-Demand	Anodyne	KCNJ1	50	36
C=CCN(C(=O)NCc1ccc(-n2ccnc2)cc1)[C@@H](C)COC	ZINC000853505307	EF	On-Demand	Mild	NOS2	60	35
C=CCN(C(=O)NCc1ccc(-n2ccnc2)cc1)[C@H](C)COC	ZINC000853505308	EF	On-Demand	Mild	NOS2	60	35
CON(C)CCNC(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853505327	DD	On-Demand	Anodyne	NOS2	70	36
O=C(NCc1ccc(-n2ccnc2)cc1)NCC(O)(C1CC1)C1CC1	ZINC000853505329	EE	On-Demand	Anodyne	NOS2	94	36
C[C@@H]1CN(CCNC(=O)NCc2ccc(-n3ccnc3)cc2)[C@H](C)CO1	ZINC000853505334	FD	On-Demand	Anodyne	NOS2	88	33
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853505358	DD	On-Demand	Anodyne	NOS2	98	42
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@@]1(C)CO	ZINC000853505360	EE	On-Demand	Anodyne	NOS2	94	38
C[C@@H]1CN(C(=O)NCc2ccc(-n3ccnc3)cc2)C[C@]1(C)CO	ZINC000853505362	EE	On-Demand	Anodyne	NOS2	94	38
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853505374	EE	On-Demand	Anodyne	CCR5	18	50
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853505374	EE	On-Demand	Anodyne	NOS2	99	37
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853505375	EE	On-Demand	Anodyne	CCR5	18	50
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853505375	EE	On-Demand	Anodyne	NOS2	99	37
O=C(NCc1ccc(-n2ccnc2)cc1)NCC1(O)CCC(F)(F)CC1	ZINC000853505379	FF	On-Demand	Anodyne	NOS2	55	33
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(-n2ccnc2)cc1	ZINC000853505389	DE	On-Demand	Anodyne	NOS2	95	36
CC[C@@](C)(NC(=O)NCc1ccc(-n2ccnc2)cc1)C1CC1	ZINC000853505447	DG	On-Demand	Anodyne	NOS2	94	37
CO[C@]1(CO)CCCN(C(=O)NCc2ccc(-n3ccnc3)cc2)C1	ZINC000853505455	ED	On-Demand	Anodyne	NOS2	86	41
CC(C)[C@H]1CCN(CN2CCC3(CC2)CCN(Cc2ccccc2)C3)C1=O	ZINC000853505465	FG	On-Demand	Anodyne	SIGMAR1	56	39
C#CCCN(CCOC)C(=O)NC[C@@H](c1cccc(F)c1)N1CCOCC1	ZINC000853505466	GD	On-Demand	Mild	CASR	42	37
C#CCCN(CCOC)C(=O)NC[C@H](c1cccc(F)c1)N1CCOCC1	ZINC000853505467	GD	On-Demand	Mild	CASR	42	37
COC(=O)c1ccc2c(c1)CCN2CN1CC[C@@H](C(C)C)C1=O	ZINC000853505487	DE	On-Demand	Anodyne	SRD5A1	18	46
COC(=O)c1ccc2c(c1)CCN2CN1CC[C@H](C(C)C)C1=O	ZINC000853505489	DE	On-Demand	Anodyne	SRD5A1	18	46
O=C(NCc1ccc(-n2ccnc2)cc1)N(CCC1CC1)CC1CC1	ZINC000853505506	EH	On-Demand	Anodyne	NOS2	89	35
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853505510	ED	On-Demand	Anodyne	NOS2	91	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853505510	ED	On-Demand	Anodyne	NAMPT	35	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853505511	ED	On-Demand	Anodyne	NOS2	91	37
O=C(NCc1ccc(-n2ccnc2)cc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853505511	ED	On-Demand	Anodyne	NAMPT	35	41
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(CO)(CO)C1	ZINC000853505521	EC	On-Demand	Anodyne	NOS2	88	38
O=C(NCc1ccc(-n2ccnc2)cc1)N1CCC(n2cnnc2O)CC1	ZINC000853505528	FD	On-Demand	Anodyne	NOS2	83	36
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](C[C@@H]2CCOC2)C1	ZINC000853505535	EE	On-Demand	Anodyne	CCR3	40	32
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](C[C@@H]2CCOC2)C1	ZINC000853505536	EE	On-Demand	Anodyne	CCR3	40	32
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](C[C@H]2CCOC2)C1	ZINC000853505537	EE	On-Demand	Anodyne	CCR3	40	32
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](C[C@H]2CCOC2)C1	ZINC000853505538	EE	On-Demand	Anodyne	CCR3	40	32
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853505539	GH	On-Demand	Anodyne	CACNA1I	50	34
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853505540	GH	On-Demand	Anodyne	CACNA1I	50	34
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853505541	GH	On-Demand	Anodyne	CACNA1I	50	34
O=C(NC[C@@H]1CCN(c2ccc(Cl)cc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853505542	GH	On-Demand	Anodyne	CACNA1I	50	34
CCC[C@H]1CN(Cn2nc(C)oc2=O)CCN1Cc1ccccc1	ZINC000853505555	EE	On-Demand	Anodyne	SIGMAR1	15	46
CCC[C@@H]1CN(Cn2nc(C)oc2=O)CCN1Cc1ccccc1	ZINC000853505556	EE	On-Demand	Anodyne	SIGMAR1	15	46
O=C1c2cc(F)c(F)cc2CN1CN1CCO[C@@H](Cc2ccccc2)C1	ZINC000853505557	FF	On-Demand	Anodyne	LUCI_PHOPY	43	39
O=C1c2cc(F)c(F)cc2CN1CN1CCO[C@H](Cc2ccccc2)C1	ZINC000853505558	FF	On-Demand	Anodyne	LUCI_PHOPY	43	39
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@@H](c1cccs1)C1(CO)CCC1	ZINC000853505594	GH	On-Demand	Anodyne	NOS2	54	35
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H](c1cccs1)C1(CO)CCC1	ZINC000853505595	GH	On-Demand	Anodyne	NOS2	54	35
O=C(NCc1ccc(-n2ccnc2)cc1)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853505596	FD	On-Demand	Anodyne	NOS2	85	33
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@]1(OCCO)CCOC1	ZINC000853505616	FC	On-Demand	Anodyne	NOS2	61	36
O=C(NCc1ccc(-n2ccnc2)cc1)NC[C@@]1(OCCO)CCOC1	ZINC000853505617	FC	On-Demand	Anodyne	NOS2	61	36
CC(C)[C@H]1CCN(CN2CCC(Cc3cccnc3)CC2)C1=O	ZINC000853505629	DF	On-Demand	Anodyne	CHRNA7	44	34
O=C1[C@@H](C2CCCCC2)CCN1CN1CCN(c2ccc(F)cn2)CC1	ZINC000853505698	FF	On-Demand	Anodyne	SLC27A1	42	41
O=C1[C@H](C2CCCCC2)CCN1CN1CCN(c2ccc(F)cn2)CC1	ZINC000853505699	FF	On-Demand	Anodyne	SLC27A1	42	41
CC[C@@H]1CN(Cn2nc(C)oc2=O)CCN1Cc1ccccc1	ZINC000853505736	DD	On-Demand	Anodyne	SIGMAR1	23	48
CON(C)CCNC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000853505749	ED	On-Demand	Anodyne	CACNA1I	55	34
CON(C)CCNC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000853505751	ED	On-Demand	Anodyne	CACNA1I	55	34
CC(C)c1ccc(CN2CCC3(CC2)OCCc2ccsc23)c(O)c(=O)c1	ZINC000853505757	GI	On-Demand	Anodyne	OPRL1	50	39
COC(=O)CN(CCc1ccccc1)CN1CC[C@@H](C(C)C)C1=O	ZINC000853505806	EE	On-Demand	Anodyne	ACE	49	36
COC(=O)CN(CCc1ccccc1)CN1CC[C@@H](C(C)C)C1=O	ZINC000853505806	EE	On-Demand	Anodyne	SLC18A2	20	42
COC(=O)CN(CCc1ccccc1)CN1CC[C@H](C(C)C)C1=O	ZINC000853505807	EE	On-Demand	Anodyne	ACE	49	36
COC(=O)CN(CCc1ccccc1)CN1CC[C@H](C(C)C)C1=O	ZINC000853505807	EE	On-Demand	Anodyne	SLC18A2	20	42
CC(C)[C@H]1CCN(CN2CC[C@@H](Oc3ccc(C(F)(F)F)cn3)C2)C1=O	ZINC000853505828	FG	On-Demand	Anodyne	LIPG	20	47
CC(C)[C@H]1CCN(CN2CC[C@H](Oc3ccc(C(F)(F)F)cn3)C2)C1=O	ZINC000853505829	FG	On-Demand	Anodyne	LIPG	20	47
O=C1c2cc(F)c(F)cc2CN1CN1CC[C@H](COc2ccccc2)C1	ZINC000853505869	FG	On-Demand	Anodyne	SIGMAR1	19	45
O=C1c2cc(F)c(F)cc2CN1CN1CC[C@@H](COc2ccccc2)C1	ZINC000853505871	FG	On-Demand	Anodyne	SIGMAR1	19	45
O=C1[C@H](C2CCCCC2)CCN1CN1CCC2(CC1)OCCc1ccsc12	ZINC000853505917	GH	On-Demand	Anodyne	OPRL1	42	32
O=C1[C@@H](C2CCCCC2)CCN1CN1CCC2(CC1)OCCc1ccsc12	ZINC000853505918	GH	On-Demand	Anodyne	OPRL1	42	32
CC(C)[C@H]1CCN(CN2CCO[C@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000853505981	FH	On-Demand	Anodyne	RBP4	44	36
CC(C)[C@H]1CCN(CN2CCO[C@@H](c3ccccc3C(F)(F)F)C2)C1=O	ZINC000853505984	FH	On-Demand	Anodyne	RBP4	44	36
CCc1nc2ccccc2n1C1CCN(CN2CC[C@H](C(C)C)C2=O)CC1	ZINC000853506005	FH	On-Demand	Anodyne	FPR2	25	45
CCc1nc2ccccc2n1C1CCN(CN2CC[C@@H](C(C)C)C2=O)CC1	ZINC000853506006	FH	On-Demand	Anodyne	FPR2	25	45
CC(C)c1ccc(CN2CC[C@@](O)(c3ccc(F)cc3)C2)c(O)c(=O)c1	ZINC000853506017	FG	On-Demand	Anodyne	GRIN2B	17	42
CC(C)c1ccc(CN2CC[C@](O)(c3ccc(F)cc3)C2)c(O)c(=O)c1	ZINC000853506018	FG	On-Demand	Anodyne	GRIN2B	17	42
O=C1[C@H](C2CCCCC2)CCN1CN1CCC(c2cccnc2)CC1	ZINC000853506063	EH	On-Demand	Anodyne	CCR5	17	42
O=C1[C@@H](C2CCCCC2)CCN1CN1CCC(c2cccnc2)CC1	ZINC000853506065	EH	On-Demand	Anodyne	CCR5	17	42
CC(C)[C@H]1CCN(CN2CC[C@H](COc3ccccc3)C2)C1=O	ZINC000853506152	DF	On-Demand	Anodyne	SIGMAR1	23	49
COC(=O)c1ccc2c(c1)CN(Cn1nc(C)oc1=O)CC2	ZINC000853506153	DC	On-Demand	Anodyne	NOD2	40	35
CC(C)[C@H]1CCN(CN2CC[C@@H](COc3ccccc3)C2)C1=O	ZINC000853506154	DF	On-Demand	Anodyne	SIGMAR1	23	49
O=C(NC1CC1)N[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853506164	EC	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NC1CC1)N[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853506164	EC	On-Demand	Anodyne	CCR3	34	49
O=C(NC1CC1)N[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853506164	EC	On-Demand	Anodyne	MCHR1	15	41
O=C(NC1CC1)N[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853506168	EC	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NC1CC1)N[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853506168	EC	On-Demand	Anodyne	CCR3	34	49
O=C(NC1CC1)N[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853506168	EC	On-Demand	Anodyne	MCHR1	15	41
O=C(NC1CC1)N[C@@H]1CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853506251	FD	On-Demand	Anodyne	CCR3	19	42
O=C(NC1CC1)N[C@H]1CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853506253	FD	On-Demand	Anodyne	CCR3	19	42
O=[N+]([O-])c1cn(CN2CCN(c3ccc(F)cn3)CC2)nc1-c1ccccn1	ZINC000853506307	GE	On-Demand	Bother	DRD4	19	40
CC(C)[C@H]1CCN(CN2CCC3(CC2)OCCc2ccsc23)C1=O	ZINC000853506369	EG	On-Demand	Anodyne	OPRL1	48	38
O=c1c2ccc(F)cc2nnn1CN1CCC2(CC1)OCCc1ccsc12	ZINC000853506423	GF	On-Demand	Anodyne	OPRL1	45	35
O=c1c2ccc(F)cc2nnn1CN1CC[C@@H](Cc2ccncc2)C1	ZINC000853506437	ED	On-Demand	Anodyne	CCR3	75	35
O=c1c2ccc(F)cc2nnn1CN1CC[C@H](Cc2ccncc2)C1	ZINC000853506438	ED	On-Demand	Anodyne	CCR3	75	35
CC(C)[C@H]1CCN(CN2CCC[C@@]3(C2)OCc2ccccc23)C1=O	ZINC000853506473	EF	On-Demand	Anodyne	SIGMAR1	16	43
CC(C)[C@H]1CCN(CN2CCC[C@]3(C2)OCc2ccccc23)C1=O	ZINC000853506475	EF	On-Demand	Anodyne	SIGMAR1	16	43
CCOc1cc(NC2CCN(Cn3nc(C)oc3=O)CC2)ncn1	ZINC000853506755	EC	On-Demand	Anodyne	SSTR5	43	35
COC(=O)c1cn([C@@H]2CCCN(Cn3nnc4cc(F)ccc4c3=O)C2)nn1	ZINC000853506760	GC	On-Demand	Anodyne	CCR3	59	32
COC(=O)c1cn([C@H]2CCCN(Cn3nnc4cc(F)ccc4c3=O)C2)nn1	ZINC000853506761	GC	On-Demand	Anodyne	CCR3	59	32
CC(C)[C@H]1CCN(CN2CC[C@@]3(C2)OCc2ccccc23)C1=O	ZINC000853506895	DF	On-Demand	Anodyne	SIGMAR1	26	49
CC(C)[C@H]1CCN(CN2CC[C@]3(C2)OCc2ccccc23)C1=O	ZINC000853506898	DF	On-Demand	Anodyne	SIGMAR1	26	49
CON(C)CCNC(=O)NCc1ccc(Br)cc1Cl	ZINC000853506985	FE	On-Demand	Anodyne	P2RX7	42	36
O=c1c2ccc(F)cc2nnn1CN1CC[C@H](COc2ccccc2)C1	ZINC000853507192	FE	On-Demand	Anodyne	SIGMAR1	16	44
O=c1c2ccc(F)cc2nnn1CN1CC[C@H](COc2ccccc2)C1	ZINC000853507192	FE	On-Demand	Anodyne	CHRNA10	41	32
O=c1c2ccc(F)cc2nnn1CN1CC[C@@H](COc2ccccc2)C1	ZINC000853507193	FE	On-Demand	Anodyne	SIGMAR1	16	44
O=c1c2ccc(F)cc2nnn1CN1CC[C@@H](COc2ccccc2)C1	ZINC000853507193	FE	On-Demand	Anodyne	CHRNA10	41	32
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000853507214	FF	On-Demand	Mild	CACNA1I	53	33
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1	ZINC000853507215	FF	On-Demand	Mild	CACNA1I	53	33
O=C1c2cc(F)c(F)cc2CN1CN1CCC2(CC1)OCCc1ccsc12	ZINC000853507224	GH	On-Demand	Anodyne	OPRL1	47	37
O=C1c2cc(F)c(F)cc2CN1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000853507354	FG	On-Demand	Anodyne	MCHR1	20	44
O=C1c2cc(F)c(F)cc2CN1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000853507355	FG	On-Demand	Anodyne	MCHR1	20	44
CCOc1cc(NC2CCN(Cn3nnc4cc(F)ccc4c3=O)CC2)ncn1	ZINC000853507455	GD	On-Demand	Anodyne	SSTR5	44	35
O=c1c2ccc(F)cc2nnn1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000853507475	FE	On-Demand	Anodyne	SIGMAR1	15	48
O=c1c2ccc(F)cc2nnn1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000853507478	FE	On-Demand	Anodyne	SIGMAR1	15	48
O=C1[C@@H](C2CCCCC2)CCN1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000853507534	FH	On-Demand	Anodyne	SIGMAR1	23	50
O=C1[C@@H](C2CCCCC2)CCN1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000853507535	FH	On-Demand	Anodyne	SIGMAR1	23	50
O=C1[C@H](C2CCCCC2)CCN1CN1CC[C@]2(C1)OCc1ccccc12	ZINC000853507536	FH	On-Demand	Anodyne	SIGMAR1	23	50
O=C1[C@H](C2CCCCC2)CCN1CN1CC[C@@]2(C1)OCc1ccccc12	ZINC000853507537	FH	On-Demand	Anodyne	SIGMAR1	23	50
Fc1ccc([C@@H]2CN(Cn3ncc(Cl)c3C3CC3)CCO2)c(F)c1	ZINC000853507544	FH	On-Demand	Anodyne	PRCP	45	34
Fc1ccc([C@H]2CN(Cn3ncc(Cl)c3C3CC3)CCO2)c(F)c1	ZINC000853507545	FH	On-Demand	Anodyne	PRCP	45	34
CCCN(CN1Cc2cc(F)c(F)cc2C1=O)[C@H]1CCCc2cccnc21	ZINC000853507736	FI	On-Demand	Anodyne	CXCR4	83	45
CCCN(CN1Cc2cc(F)c(F)cc2C1=O)[C@@H]1CCCc2cccnc21	ZINC000853507737	FI	On-Demand	Anodyne	CXCR4	83	45
CCCN(CN1CC[C@H](C(C)C)C1=O)[C@H]1CCCc2cccnc21	ZINC000853507762	EH	On-Demand	Anodyne	CXCR4	85	45
CCCN(CN1CC[C@H](C(C)C)C1=O)[C@@H]1CCCc2cccnc21	ZINC000853507763	EH	On-Demand	Anodyne	CXCR4	85	45
CCCN(CN1CC[C@@H](C(C)C)C1=O)[C@H]1CCCc2cccnc21	ZINC000853507764	EH	On-Demand	Anodyne	CXCR4	85	45
CCCN(CN1CC[C@@H](C(C)C)C1=O)[C@@H]1CCCc2cccnc21	ZINC000853507765	EH	On-Demand	Anodyne	CXCR4	85	45
CCN(Cc1c[nH]c2ccccc12)CN1CC[C@@H](C(C)C)C1=O	ZINC000853507853	DG	On-Demand	Anodyne	EDNRA	17	41
CCN(Cc1c[nH]c2ccccc12)CN1CC[C@@H](C(C)C)C1=O	ZINC000853507853	DG	On-Demand	Anodyne	TACR1	18	41
CCN(Cc1c[nH]c2ccccc12)CN1CC[C@H](C(C)C)C1=O	ZINC000853507854	DG	On-Demand	Anodyne	EDNRA	17	41
CCN(Cc1c[nH]c2ccccc12)CN1CC[C@H](C(C)C)C1=O	ZINC000853507854	DG	On-Demand	Anodyne	TACR1	18	41
CCN(Cc1c[nH]c2ccccc12)CN1Cc2cc(F)c(F)cc2C1=O	ZINC000853507891	FH	On-Demand	Anodyne	MPO	19	43
CC(C)[C@H]1CCN(CN2CCC(C(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000853508156	EG	On-Demand	Anodyne	HTR2A	23	53
CC(C)[C@H]1CCN(CN2CCC(C(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000853508156	EG	On-Demand	Anodyne	SLC18A3	39	46
CC(C)[C@H]1CCN(CN2CCC(C(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000853508156	EG	On-Demand	Anodyne	WNT3A	60	40
CC(C)[C@H]1CCN(CN2CCC(C(=O)c3ccc(F)cc3)CC2)C1=O	ZINC000853508156	EG	On-Demand	Anodyne	TNKS2	18	40
O=C(c1ccc(F)cc1)C1CCN(CN2Cc3cc(F)c(F)cc3C2=O)CC1	ZINC000853508192	GH	On-Demand	Anodyne	HTR2A	19	50
O=C(c1ccc(F)cc1)C1CCN(CN2Cc3cc(F)c(F)cc3C2=O)CC1	ZINC000853508192	GH	On-Demand	Anodyne	SLC18A3	38	44
O=C(c1ccc(F)cc1)C1CCN(CN2Cc3cc(F)c(F)cc3C2=O)CC1	ZINC000853508192	GH	On-Demand	Anodyne	WNT3A	51	37
O=S1(=O)N=C(Cl)c2ccc(NCC3CCN(CC(F)(F)F)CC3)cc21	ZINC000853508256	GG	On-Demand	Anodyne	CACNA1I	42	33
O=C(c1ccc(F)cc1)C1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853508345	GF	On-Demand	Anodyne	HTR2A	15	48
O=C(c1ccc(F)cc1)C1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853508345	GF	On-Demand	Anodyne	SLC18A3	24	42
O=C(c1ccc(F)cc1)C1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853508345	GF	On-Demand	Anodyne	WNT3A	61	42
O=C(c1ccc(F)cc1)C1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853508345	GF	On-Demand	Anodyne	TNKS2	18	42
CC(C)(C)OC(=O)N1Cc2ccc(CNc3cnccn3)cc2C1	ZINC000853508354	EG	On-Demand	Anodyne	GPR119	27	41
O=C(c1ccc(F)cc1)C1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853508516	FI	On-Demand	Anodyne	SLC18A3	29	46
O=C(c1ccc(F)cc1)C1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853508516	FI	On-Demand	Anodyne	WNT3A	59	39
C#CCCCOc1cccnc1N1CCN(c2ncnc3sc(C)cc23)CC1	ZINC000853508625	GH	On-Demand	Mild	PDGFRB	46	36
Fc1cccnc1OC1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853508709	FG	On-Demand	Anodyne	SCN5A	55	41
Cn1nnc2c(NCc3ccc4c(c3)CN(C(=O)OC(C)(C)C)C4)ncnc21	ZINC000853508910	GF	On-Demand	Anodyne	PDE6A	40	31
O=C1[C@@H](C2CCCCC2)CCN1CN1CCC(Oc2ncccc2F)CC1	ZINC000853508932	GG	On-Demand	Anodyne	SCN5A	42	39
O=C1[C@H](C2CCCCC2)CCN1CN1CCC(Oc2ncccc2F)CC1	ZINC000853508933	GG	On-Demand	Anodyne	SCN5A	42	39
Cc1cc(F)ccc1CN(C)CN1CC[C@@H](C(C)C)C1=O	ZINC000853509014	CG	On-Demand	Anodyne	P2RX7	17	41
Cc1cc(F)ccc1CN(C)CN1CC[C@H](C(C)C)C1=O	ZINC000853509015	CG	On-Demand	Anodyne	P2RX7	17	41
CC(C)[C@H]1CCN(CN(C)Cc2cc(Cl)ccc2F)C1=O	ZINC000853509161	DG	On-Demand	Anodyne	NOS3	17	42
CC(=O)c1ccnc(N[C@@H]2CC[C@@H](C)C2)c1	ZINC000853509288	BF	On-Demand	Anodyne	PRKD1	50	38
CC(=O)c1ccnc(N[C@@H]2CC[C@@H](C)C2)c1	ZINC000853509288	BF	On-Demand	Anodyne	TYK2	44	40
CC(=O)c1ccnc(N[C@H]2CC[C@H](C)C2)c1	ZINC000853509289	BF	On-Demand	Anodyne	PRKD1	50	38
CC(=O)c1ccnc(N[C@H]2CC[C@H](C)C2)c1	ZINC000853509289	BF	On-Demand	Anodyne	TYK2	44	40
CC(=O)c1ccnc(N[C@@H]2CC[C@H](C)C2)c1	ZINC000853509290	BF	On-Demand	Anodyne	PRKD1	50	38
CC(=O)c1ccnc(N[C@@H]2CC[C@H](C)C2)c1	ZINC000853509290	BF	On-Demand	Anodyne	TYK2	44	40
CC(=O)c1ccnc(N[C@H]2CC[C@@H](C)C2)c1	ZINC000853509291	BF	On-Demand	Anodyne	PRKD1	50	38
CC(=O)c1ccnc(N[C@H]2CC[C@@H](C)C2)c1	ZINC000853509291	BF	On-Demand	Anodyne	TYK2	44	40
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	ACHE	25	41
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	HTR4	52	41
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	GRIN2B	42	39
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	CTSB	49	39
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	CTSK	34	40
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	PREP	16	40
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	CAPNS1	62	35
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	CAPN1	73	43
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	CAPN2	124	43
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	TGM2	30	45
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	NPR	70	39
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	CACNA1I	60	36
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)OCc3ccccc3)CC2)C1=O	ZINC000853509347	GG	On-Demand	Anodyne	F13A1	22	45
CC(C)(C)OC(=O)N1Cc2ccc(CNc3cc(C#N)cnn3)cc2C1	ZINC000853509394	FG	On-Demand	Mild	GPR119	20	43
CC(C)[C@H]1CCN(CN2CCC(Oc3ncccc3F)CC2)C1=O	ZINC000853509534	EF	On-Demand	Anodyne	SCN5A	42	37
COCCO[C@@H]1CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1	ZINC000853509637	DF	On-Demand	Bother	LIPG	47	48
COCCO[C@H]1CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1	ZINC000853509638	DF	On-Demand	Bother	LIPG	47	48
COCCO[C@@H]1CCN(c2cc(F)ncn2)C1	ZINC000853509656	BC	On-Demand	Anodyne	DCK	42	38
COCCO[C@@H]1CCN(c2cc(F)ncn2)C1	ZINC000853509656	BC	On-Demand	Anodyne	PDE3B	44	35
COCCO[C@@H]1CCN(c2cc(F)ncn2)C1	ZINC000853509656	BC	On-Demand	Anodyne	LIPG	36	44
COCCO[C@H]1CCN(c2cc(F)ncn2)C1	ZINC000853509657	BC	On-Demand	Anodyne	DCK	42	38
COCCO[C@H]1CCN(c2cc(F)ncn2)C1	ZINC000853509657	BC	On-Demand	Anodyne	PDE3B	44	35
COCCO[C@H]1CCN(c2cc(F)ncn2)C1	ZINC000853509657	BC	On-Demand	Anodyne	LIPG	36	44
O=C1NCC2(CCN(c3nc4ccccc4n4cccc34)CC2)O1	ZINC000853509674	DF	On-Demand	Anodyne	HTR3A	35	44
NS(=O)(=O)c1ccc2nc(N3CCC4(CC3)CNC(=O)O4)[nH]c2c1	ZINC000853509758	FC	On-Demand	Anodyne	NPY5R	17	44
CC(C)[C@H]1CCN(CN2CCC(CNC(=O)C(F)(F)F)CC2)C1=O	ZINC000853509819	ED	On-Demand	Anodyne	CACNA1I	61	37
CC(C)[C@H]1CCN(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)C1=O	ZINC000853509870	EF	On-Demand	Anodyne	ACHE	24	41
CC(C)[C@H]1CCN(CN2C[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2)C1=O	ZINC000853509870	EF	On-Demand	Anodyne	SIGMAR1	53	39
COCCO[C@@H]1CCN(c2ccc(C(C)=O)cc2I)C1	ZINC000853509888	GF	On-Demand	Anodyne	LIPG	53	52
COCCO[C@H]1CCN(c2ccc(C(C)=O)cc2I)C1	ZINC000853509890	GF	On-Demand	Anodyne	LIPG	53	52
COc1cnccc1N1CCN(Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)CC1	ZINC000853509893	GE	On-Demand	Bother	HTR1A	50	39
COc1cnccc1N1CCN(Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)CC1	ZINC000853509893	GE	On-Demand	Bother	DRD2	29	40
COc1cnccc1N1CCN(Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)CC1	ZINC000853509893	GE	On-Demand	Bother	DRD4	25	40
COc1cnccc1N1CCN(Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)CC1	ZINC000853509893	GE	On-Demand	Bother	DRD3	31	40
COC(COCCNc1ncnc2ccc(C(C)C)cc12)OC	ZINC000853509909	DF	On-Demand	Anodyne	CLK4	50	34
O=C(NCC1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1)C(F)(F)F	ZINC000853509927	GD	On-Demand	Anodyne	CACNA1I	53	35
COCCO[C@@H]1CCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853510112	FH	On-Demand	Anodyne	LIPG	42	46
COCCO[C@H]1CCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853510113	FH	On-Demand	Anodyne	LIPG	42	46
O=C1c2cc(F)c(F)cc2CN1CN1CCC(CNC(=O)C(F)(F)F)CC1	ZINC000853510168	GE	On-Demand	Anodyne	CACNA1I	59	36
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](CN2CCOCC2)C1	ZINC000853510282	FC	On-Demand	Anodyne	CCR3	43	36
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](CN2CCOCC2)C1	ZINC000853510282	FC	On-Demand	Anodyne	Q8MHZ5_SHEEP	72	40
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](CN2CCOCC2)C1	ZINC000853510284	FC	On-Demand	Anodyne	CCR3	43	36
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](CN2CCOCC2)C1	ZINC000853510284	FC	On-Demand	Anodyne	Q8MHZ5_SHEEP	72	40
O=c1c2ccc(F)cc2nnn1CN1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000853510372	GF	On-Demand	Anodyne	SCD	23	41
COCCO[C@@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853510422	DD	On-Demand	Anodyne	PDE3B	46	36
COCCO[C@@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853510422	DD	On-Demand	Anodyne	LIPG	30	40
COCCO[C@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853510424	DD	On-Demand	Anodyne	PDE3B	46	36
COCCO[C@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853510424	DD	On-Demand	Anodyne	LIPG	30	40
CC(C)c1ccc(CN2CCC(CNC(=O)C(F)(F)F)CC2)c(O)c(=O)c1	ZINC000853510518	GF	On-Demand	Anodyne	CACNA1I	66	36
COC(=O)c1nccc(N2CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C2)n1	ZINC000853510638	FE	On-Demand	Anodyne	SORD	66	36
COC(=O)c1nccc(N2CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C2)n1	ZINC000853510638	FE	On-Demand	Anodyne	GPR119	17	40
CCCc1ccc(N2CCC3(CC2)CNC(=O)O3)nn1	ZINC000853510742	CD	On-Demand	Anodyne	SCD	45	32
Cc1ccc(N2CCC3(CC2)CNC(=O)O3)nn1	ZINC000853510778	BC	On-Demand	Anodyne	SCD	47	34
NC(=O)CN1C[C@@H](F)C[C@H]1CNc1cc(-c2ccccc2)nc2ccnn12	ZINC000853510786	FD	On-Demand	Anodyne	VCP	42	34
COCCO[C@H]1CCN(c2ccc(C(=O)C3CC3)cc2S(N)(=O)=O)C1	ZINC000853510796	FD	On-Demand	Anodyne	LIPG	47	50
COCCO[C@@H]1CCN(c2ccc(C(=O)C3CC3)cc2S(N)(=O)=O)C1	ZINC000853510798	FD	On-Demand	Anodyne	LIPG	47	50
COCCO[C@@H]1CCN(c2cnc(F)cn2)C1	ZINC000853510814	BC	On-Demand	Anodyne	LIPG	34	42
COCCO[C@H]1CCN(c2cnc(F)cn2)C1	ZINC000853510815	BC	On-Demand	Anodyne	LIPG	34	42
COCCO[C@@H]1CCN(c2cc(OC)c(C)cc2[N+](=O)[O-])C1	ZINC000853510821	DE	On-Demand	Bother	LIPG	32	43
COCCO[C@H]1CCN(c2cc(OC)c(C)cc2[N+](=O)[O-])C1	ZINC000853510822	DE	On-Demand	Bother	LIPG	32	43
COc1cnccc1N1CCN(Cn2nc(C)oc2=O)CC1	ZINC000853510833	DC	On-Demand	Anodyne	HTR1A	62	40
COc1cnccc1N1CCN(Cn2nc(C)oc2=O)CC1	ZINC000853510833	DC	On-Demand	Anodyne	DRD4	24	40
COc1cnccc1N1CCN(Cn2nc(C)oc2=O)CC1	ZINC000853510833	DC	On-Demand	Anodyne	ADRA1D	46	38
COc1cnccc1N1CCN(Cn2nc(C)oc2=O)CC1	ZINC000853510833	DC	On-Demand	Anodyne	ADRA1A	45	40
COc1cnccc1N1CCN(Cn2nc(C)oc2=O)CC1	ZINC000853510833	DC	On-Demand	Anodyne	HTR7	33	40
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	ACE	34	42
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CTRA_BOVIN	60	32
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CTSB	39	40
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	TRY1_BOVIN	47	32
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CTSG	41	32
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CTSK	32	40
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CTSL	39	40
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	PREP	27	42
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CAPNS1	56	32
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CELA2A	49	32
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CTSS	23	40
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CAPN1	55	43
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	CAPN2	89	43
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	TGM2	27	41
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	NPR	67	36
CC(C)[C@H]1CCN(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510900	GG	On-Demand	Anodyne	TMPRSS11D	49	37
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	ACE	34	42
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CTRA_BOVIN	60	32
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CTSB	39	40
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	TRY1_BOVIN	47	32
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CTSG	41	32
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CTSK	32	40
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CTSL	39	40
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	PREP	27	42
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CAPNS1	56	32
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CELA2A	49	32
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CTSS	23	40
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CAPN1	55	43
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	CAPN2	89	43
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	TGM2	27	41
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	NPR	67	36
CC(C)[C@H]1CCN(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1=O	ZINC000853510903	GG	On-Demand	Anodyne	TMPRSS11D	49	37
O=C1NCC2(CCN(c3nc(NCc4ccccc4)c4ccccc4n3)CC2)O1	ZINC000853511023	GG	On-Demand	Anodyne	HRH4	19	46
CC(C)[C@H]1CCN(CN2CCC(N3CCc4ccccc43)CC2)C1=O	ZINC000853511184	EF	On-Demand	Anodyne	OPRL1	15	41
COC(=O)c1nccc(N2CCC(C)(NC(=O)OC(C)(C)C)CC2)n1	ZINC000853511221	FE	On-Demand	Anodyne	SORD	44	37
COc1cnccc1N1CCN(CN2Cc3cc(F)c(F)cc3C2=O)CC1	ZINC000853511285	FE	On-Demand	Anodyne	HTR1A	36	45
COc1cnccc1N1CCN(CN2Cc3cc(F)c(F)cc3C2=O)CC1	ZINC000853511285	FE	On-Demand	Anodyne	DRD2	24	43
COc1cnccc1N1CCN(CN2Cc3cc(F)c(F)cc3C2=O)CC1	ZINC000853511285	FE	On-Demand	Anodyne	DRD3	23	43
COc1cnccc1N1CCN(CN2Cc3cc(F)c(F)cc3C2=O)CC1	ZINC000853511285	FE	On-Demand	Anodyne	HTR7	25	43
C#CCCCOc1cccnc1N1CC[C@H](OCCOC)C1	ZINC000853511299	DE	On-Demand	Mild	PDE3B	43	35
C#CCCCOc1cccnc1N1CC[C@@H](OCCOC)C1	ZINC000853511300	DE	On-Demand	Mild	PDE3B	43	35
COc1cnccc1N1CCN(CN2CC[C@@H](C(C)C)C2=O)CC1	ZINC000853511364	ED	On-Demand	Anodyne	HTR1A	66	42
COc1cnccc1N1CCN(CN2CC[C@@H](C(C)C)C2=O)CC1	ZINC000853511364	ED	On-Demand	Anodyne	ADRA1D	43	37
COc1cnccc1N1CCN(CN2CC[C@@H](C(C)C)C2=O)CC1	ZINC000853511364	ED	On-Demand	Anodyne	ADRA1A	42	37
COc1cnccc1N1CCN(CN2CC[C@H](C(C)C)C2=O)CC1	ZINC000853511365	ED	On-Demand	Anodyne	HTR1A	66	42
COc1cnccc1N1CCN(CN2CC[C@H](C(C)C)C2=O)CC1	ZINC000853511365	ED	On-Demand	Anodyne	ADRA1D	43	37
COc1cnccc1N1CCN(CN2CC[C@H](C(C)C)C2=O)CC1	ZINC000853511365	ED	On-Demand	Anodyne	ADRA1A	42	37
CC(C)[C@H]1CN(c2ncnc3c2nnn3C)CCN1C(=O)OC(C)(C)C	ZINC000853511509	FD	On-Demand	Anodyne	GPR119	15	40
O=C(NCC1CCN(Cn2ncc(Cl)c2C2CC2)CC1)C(F)(F)F	ZINC000853511518	FF	On-Demand	Anodyne	CACNA1I	66	37
COc1cnccc1N1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853511649	FD	On-Demand	Anodyne	HTR1A	59	41
COc1cnccc1N1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853511649	FD	On-Demand	Anodyne	ADRA1A	41	37
COc1cnccc1N1CCN(Cn2nnc3cc(F)ccc3c2=O)CC1	ZINC000853511649	FD	On-Demand	Anodyne	HTR7	40	43
O=C1[C@H](C2CCCCC2)CCN1CN1CCC(CNC(=O)C(F)(F)F)CC1	ZINC000853511684	GF	On-Demand	Anodyne	CACNA1I	47	33
O=C1[C@@H](C2CCCCC2)CCN1CN1CCC(CNC(=O)C(F)(F)F)CC1	ZINC000853511686	GF	On-Demand	Anodyne	CACNA1I	47	33
COCCO[C@@H]1CCN(c2ccc3c(c2)S(=O)(=O)N=C3Cl)C1	ZINC000853511689	ED	On-Demand	Anodyne	LIPG	24	41
COCCO[C@H]1CCN(c2ccc3c(c2)S(=O)(=O)N=C3Cl)C1	ZINC000853511691	ED	On-Demand	Anodyne	LIPG	24	41
COc1cc(N2CCN(Cn3nnc4cc(F)ccc4c3=O)CC2)ccc1F	ZINC000853511827	GD	On-Demand	Anodyne	HTR7	23	40
COCCO[C@@H]1CCN(c2cc(Br)cnc2C#N)C1	ZINC000853511859	ED	On-Demand	Mild	LIPG	37	42
COCCO[C@H]1CCN(c2cc(Br)cnc2C#N)C1	ZINC000853511866	ED	On-Demand	Mild	LIPG	37	42
CC(C)[C@H]1CN(c2cc(F)ncn2)CCN1C(=O)OC(C)(C)C	ZINC000853511927	DF	On-Demand	Anodyne	GPR119	28	41
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)C1=O	ZINC000853511956	EE	On-Demand	Anodyne	FASN	18	40
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)C1=O	ZINC000853511957	EE	On-Demand	Anodyne	FASN	18	40
O=c1c2ccc(F)cc2nnn1CN1CCCN(c2ccc(F)c(F)c2)CC1	ZINC000853511994	GE	On-Demand	Anodyne	HTR7	18	40
CCOC(=O)c1nccc(N2CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C2)n1	ZINC000853512098	GF	On-Demand	Anodyne	SORD	65	35
Cn1nnc2c(N3CCC(C)(NC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853512145	ED	On-Demand	Anodyne	SIRT3	21	40
Cn1nnc2c(N3CCC(C)(NC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853512145	ED	On-Demand	Anodyne	SIRT2	21	40
C#Cc1cccnc1N1C[C@@H]2CCC[C@H](C1)N2C(=O)OC(C)(C)C	ZINC000853512239	EG	On-Demand	Mild	GPR119	25	46
CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(c1cc(CO)c(F)cn1)C2	ZINC000853512245	FF	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(c1cc(O)nc3cccnc13)C2	ZINC000853512248	FG	On-Demand	Anodyne	GPR119	16	40
COC(=O)c1nccc(N2C[C@@H]3CCC[C@H](C2)N3C(=O)OC(C)(C)C)n1	ZINC000853512496	FE	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(c1ccnc(O)c1[N+](=O)[O-])C2	ZINC000853512590	FF	On-Demand	Bother	GPR119	23	41
CC(C)[C@H]1CCN(CN(C)CCc2ccccc2[N+](=O)[O-])C1=O	ZINC000853512661	DF	On-Demand	Bother	COLA	106	35
O=C1c2cc(F)c(F)cc2CN1CN1CCCN(c2ccccc2F)CC1	ZINC000853512685	GG	On-Demand	Anodyne	HTR1A	15	43
CC(C)[C@H]1CCN(CN2CCCN(c3ccccc3F)CC2)C1=O	ZINC000853512696	EF	On-Demand	Anodyne	HTR1A	32	42
CC(C)[C@H]1CCN(CN2CCCN(c3ccccc3F)CC2)C1=O	ZINC000853512696	EF	On-Demand	Anodyne	ADRA1D	24	42
CC(C)[C@H]1CCN(CN2CCCN(c3ccccc3F)CC2)C1=O	ZINC000853512696	EF	On-Demand	Anodyne	ADRA1A	21	42
CC(C)[C@H]1CCN(CN2CCCN(c3ccccc3F)CC2)C1=O	ZINC000853512696	EF	On-Demand	Anodyne	ADRA1B	18	42
CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(c1nc3ncccc3cc1C#N)C2	ZINC000853512805	GG	On-Demand	Mild	GPR119	22	49
CC(C)c1ccc2ncnc(NC[C@H]3CC(C(N)=O)=NO3)c2c1	ZINC000853512810	DD	On-Demand	Anodyne	CLK4	41	36
CC(C)c1ccc2ncnc(NC[C@@H]3CC(C(N)=O)=NO3)c2c1	ZINC000853512811	DD	On-Demand	Anodyne	CLK4	41	36
CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(c1cnc(N3CCCC3=O)cn1)C2	ZINC000853512859	GF	On-Demand	Anodyne	GPR119	19	41
CCOC(=O)c1nccc(N2C[C@@H]3CCC[C@H](C2)N3C(=O)OC(C)(C)C)n1	ZINC000853512904	GF	On-Demand	Anodyne	GPR119	27	41
O=c1c2ccc(F)cc2nnn1CN1CCCN(c2ccccc2F)CC1	ZINC000853512921	FE	On-Demand	Anodyne	HTR1A	21	45
O=c1c2ccc(F)cc2nnn1CN1CCCN(c2ccccc2F)CC1	ZINC000853512921	FE	On-Demand	Anodyne	HTR7	19	47
CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(c1cnc(F)cn1)C2	ZINC000853512956	DF	On-Demand	Anodyne	GPR119	30	44
Cn1ncc(C#N)c1N1C[C@@H]2CCC[C@H](C1)N2C(=O)OC(C)(C)C	ZINC000853512985	EE	On-Demand	Mild	GPR119	21	51
CC(C)[C@H]1CCN(CN(C)Cc2nc(-c3cccs3)no2)C1=O	ZINC000853512991	EF	On-Demand	Anodyne	ETHR	32	44
CC(C)(C)OC(=O)N1[C@H]2CCC[C@H]1CN(c1cc(C#N)cnn1)C2	ZINC000853513017	EE	On-Demand	Mild	GPR119	20	45
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513051	GG	On-Demand	Anodyne	ACE	48	36
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513051	GG	On-Demand	Anodyne	FKBP1A	41	39
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513051	GG	On-Demand	Anodyne	SIGMAR1	26	45
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513051	GG	On-Demand	Anodyne	PREP	49	44
CC(C)[C@H]1CCN(CN2CCC[C@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513051	GG	On-Demand	Anodyne	BIRC2	74	50
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513052	GG	On-Demand	Anodyne	ACE	48	36
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513052	GG	On-Demand	Anodyne	FKBP1A	41	39
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513052	GG	On-Demand	Anodyne	SIGMAR1	26	45
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513052	GG	On-Demand	Anodyne	PREP	49	44
CC(C)[C@H]1CCN(CN2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)C1=O	ZINC000853513052	GG	On-Demand	Anodyne	BIRC2	74	50
CC(=O)c1ccnc(N2C[C@@H]3CCC[C@H](C2)N3C(=O)OC(C)(C)C)c1	ZINC000853513114	EG	On-Demand	Anodyne	GPR119	26	46
COC(=O)Cc1ccnc(N2C[C@@H]3CCC[C@H](C2)N3C(=O)OC(C)(C)C)c1	ZINC000853513125	GF	On-Demand	Anodyne	GPR119	35	43
CC(C)[C@H]1CCN(CN2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1=O	ZINC000853513204	FG	On-Demand	Anodyne	SIGMAR1	55	39
CC(C)[C@H]1CCN(CN2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1=O	ZINC000853513205	FG	On-Demand	Anodyne	SIGMAR1	55	39
CCOC(=O)c1nccc(N2C[C@H]3C[C@]3(CO)C2)n1	ZINC000853513271	CC	On-Demand	Anodyne	SORD	29	40
CCOC(=O)c1nccc(N2C[C@H]3C[C@@]3(CO)C2)n1	ZINC000853513272	CC	On-Demand	Anodyne	SORD	29	40
CCOC(=O)c1nccc(N2C[C@@H]3C[C@]3(CO)C2)n1	ZINC000853513273	CC	On-Demand	Anodyne	SORD	29	40
CCOC(=O)c1nccc(N2C[C@@H]3C[C@@]3(CO)C2)n1	ZINC000853513274	CC	On-Demand	Anodyne	SORD	29	40
CC(C)[C@H]1CCN(CN2CCC3(CCN(Cc4ccccc4)CC3)C2)C1=O	ZINC000853513285	FG	On-Demand	Anodyne	CHRM2	15	44
CC(C)[C@H]1CCN(CN2CCC3(CCN(Cc4ccccc4)CC3)C2)C1=O	ZINC000853513285	FG	On-Demand	Anodyne	ACHE	26	41
CC(C)[C@H]1CCN(CN2CCC3(CCN(Cc4ccccc4)CC3)C2)C1=O	ZINC000853513285	FG	On-Demand	Anodyne	CHRM3	15	44
CC(C)[C@H]1CCN(CN2CCC3(CCN(Cc4ccccc4)CC3)C2)C1=O	ZINC000853513285	FG	On-Demand	Anodyne	SIGMAR1	68	42
CC(C)[C@H]1CCN(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1=O	ZINC000853513379	GE	On-Demand	Anodyne	DRD4	32	40
CC(C)[C@H]1CCN(CN2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)C1=O	ZINC000853513379	GE	On-Demand	Anodyne	SIGMAR1	42	38
CC(C)[C@H]1CCN(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1=O	ZINC000853513380	GE	On-Demand	Anodyne	DRD4	32	40
CC(C)[C@H]1CCN(CN2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)C1=O	ZINC000853513380	GE	On-Demand	Anodyne	SIGMAR1	42	38
CN(C[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)S(C)(=O)=O	ZINC000853513406	GC	On-Demand	Anodyne	CCR3	46	31
CN(C[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)S(C)(=O)=O	ZINC000853513406	GC	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	35
CN(C[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)S(C)(=O)=O	ZINC000853513407	GC	On-Demand	Anodyne	CCR3	46	31
CN(C[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)S(C)(=O)=O	ZINC000853513407	GC	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	35
COC(=O)[C@@]1(c2ccccc2)CCN(Cn2nc(C)oc2=O)C1	ZINC000853513479	DC	On-Demand	Anodyne	ADRA1A	31	47
COC(=O)[C@@]1(c2ccccc2)CCN(Cn2nc(C)oc2=O)C1	ZINC000853513479	DC	On-Demand	Anodyne	ADRA1B	19	47
OC[C@@]12C[C@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513581	GH	On-Demand	Anodyne	HRH4	20	47
OC[C@@]12C[C@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513581	GH	On-Demand	Anodyne	CCR4	17	42
OC[C@]12C[C@@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513582	GH	On-Demand	Anodyne	HRH4	20	47
OC[C@]12C[C@@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513582	GH	On-Demand	Anodyne	CCR4	17	42
OC[C@@]12C[C@@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513583	GH	On-Demand	Anodyne	HRH4	20	47
OC[C@@]12C[C@@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513583	GH	On-Demand	Anodyne	CCR4	17	42
OC[C@]12C[C@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513584	GH	On-Demand	Anodyne	HRH4	20	47
OC[C@]12C[C@H]1CN(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853513584	GH	On-Demand	Anodyne	CCR4	17	42
CC(C)[C@H]1CCN(CN(C)CCOc2ccc(S(N)(=O)=O)cc2)C1=O	ZINC000853513628	FD	On-Demand	Anodyne	CA7	24	42
O=[N+]([O-])c1cc(N2C[C@H]3C[C@@]3(CO)C2)ccc1C(F)(F)F	ZINC000853513638	DE	On-Demand	Bother	SERPINE1	18	40
O=[N+]([O-])c1cc(N2C[C@H]3C[C@]3(CO)C2)ccc1C(F)(F)F	ZINC000853513639	DE	On-Demand	Bother	SERPINE1	18	40
O=[N+]([O-])c1cc(N2C[C@@H]3C[C@]3(CO)C2)ccc1C(F)(F)F	ZINC000853513640	DE	On-Demand	Bother	SERPINE1	18	40
O=[N+]([O-])c1cc(N2C[C@@H]3C[C@@]3(CO)C2)ccc1C(F)(F)F	ZINC000853513641	DE	On-Demand	Bother	SERPINE1	18	40
COC(=O)c1nccc(N2CC(=O)N(C)C[C@H]2C)n1	ZINC000853513764	CB	On-Demand	Anodyne	SORD	23	43
COC(=O)c1nccc(N2CC(=O)N(C)C[C@@H]2C)n1	ZINC000853513765	CB	On-Demand	Anodyne	SORD	23	43
COC(=O)[C@@]1(c2ccccc2)CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853513813	GD	On-Demand	Anodyne	ADRA1A	23	45
COC(=O)[C@@]1(c2ccccc2)CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853513813	GD	On-Demand	Anodyne	ADRA1B	15	45
CN(CCOc1ccc(S(N)(=O)=O)cc1)Cn1ncc(Cl)c1C1CC1	ZINC000853513829	GE	On-Demand	Anodyne	CA7	23	40
Fc1ncnc(NCCN2CCCOCC2)c1Br	ZINC000853513840	DD	On-Demand	Anodyne	EGFR	17	42
Fc1ncnc(NCCN2CCCOCC2)c1Br	ZINC000853513840	DD	On-Demand	Anodyne	RPS6KB1	42	33
CC(C)[C@H]1CCN(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000853513954	EG	On-Demand	Bother	SLC27A4	42	31
CC(C)[C@H]1CCN(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1=O	ZINC000853513955	EG	On-Demand	Bother	SLC27A4	42	31
COc1ccc2c(c1)CN(Cn1ncc(Cl)c1C1CC1)CCO2	ZINC000853514022	EG	On-Demand	Anodyne	NPBWR1	44	39
NC(=O)[C@]1(c2ccccc2)CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853514100	EF	On-Demand	Anodyne	TACR2	23	44
NC(=O)[C@]1(c2ccccc2)CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853514100	EF	On-Demand	Anodyne	TACR3	25	40
NC(=O)[C@@]1(c2ccccc2)CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853514101	EF	On-Demand	Anodyne	TACR2	23	44
NC(=O)[C@@]1(c2ccccc2)CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853514101	EF	On-Demand	Anodyne	TACR3	25	40
COC(=O)[C@@H]1CN(CN2CC[C@H](C(C)C)C2=O)C[C@@H]1c1ccccc1	ZINC000853514144	EE	On-Demand	Anodyne	SLC6A4	26	46
COC(=O)[C@@H]1CN(CN2CC[C@H](C(C)C)C2=O)C[C@@H]1c1ccccc1	ZINC000853514144	EE	On-Demand	Anodyne	SLC6A3	49	42
COC(=O)[C@@H]1CN(CN2CC[C@@H](C(C)C)C2=O)C[C@@H]1c1ccccc1	ZINC000853514146	EE	On-Demand	Anodyne	SLC6A4	26	46
COC(=O)[C@@H]1CN(CN2CC[C@@H](C(C)C)C2=O)C[C@@H]1c1ccccc1	ZINC000853514146	EE	On-Demand	Anodyne	SLC6A3	49	42
COC(=O)[C@@]1(c2ccccc2)CCN(CN2CC[C@@H](C(C)C)C2=O)C1	ZINC000853514245	EE	On-Demand	Anodyne	ADRA1A	27	48
COC(=O)[C@@]1(c2ccccc2)CCN(CN2CC[C@@H](C(C)C)C2=O)C1	ZINC000853514245	EE	On-Demand	Anodyne	ADRA1B	18	48
COC(=O)[C@@]1(c2ccccc2)CCN(CN2CC[C@@H](C(C)C)C2=O)C1	ZINC000853514245	EE	On-Demand	Anodyne	KCNA3	20	40
COC(=O)[C@@]1(c2ccccc2)CCN(CN2CC[C@H](C(C)C)C2=O)C1	ZINC000853514247	EE	On-Demand	Anodyne	ADRA1A	27	48
COC(=O)[C@@]1(c2ccccc2)CCN(CN2CC[C@H](C(C)C)C2=O)C1	ZINC000853514247	EE	On-Demand	Anodyne	ADRA1B	18	48
COC(=O)[C@@]1(c2ccccc2)CCN(CN2CC[C@H](C(C)C)C2=O)C1	ZINC000853514247	EE	On-Demand	Anodyne	KCNA3	20	40
OC[C@@]12C[C@@H]1CN(c1nc3ccccc3n3cccc13)C2	ZINC000853514308	CE	On-Demand	Anodyne	HTR3A	25	42
OC[C@@]12C[C@H]1CN(c1nc3ccccc3n3cccc13)C2	ZINC000853514310	CE	On-Demand	Anodyne	HTR3A	25	42
O=c1cccc2n1C[C@H]1C[C@@H]2CN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853514411	EF	On-Demand	Anodyne	CHRNA4	30	55
OC[C@]12C[C@@H]1CN(c1nc3ccccc3n3cccc13)C2	ZINC000853514612	CE	On-Demand	Anodyne	HTR3A	25	42
OC[C@]12C[C@H]1CN(c1nc3ccccc3n3cccc13)C2	ZINC000853514616	CE	On-Demand	Anodyne	HTR3A	25	42
COC(=O)[C@@]1(c2ccccc2)CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853514684	GF	On-Demand	Anodyne	ADRA1D	17	43
COC(=O)[C@@]1(c2ccccc2)CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853514684	GF	On-Demand	Anodyne	ADRA1A	30	43
COC(=O)[C@@]1(c2ccccc2)CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853514684	GF	On-Demand	Anodyne	ADRA1B	21	43
Fc1ccc2c(C3CCN(Cn4ncc(Cl)c4C4CC4)CC3)noc2c1	ZINC000853514704	FJ	On-Demand	Anodyne	DRD2	18	60
Fc1ccc2c(C3CCN(Cn4ncc(Cl)c4C4CC4)CC3)noc2c1	ZINC000853514704	FJ	On-Demand	Anodyne	HTR2A	30	53
Fc1ccc2c(C3CCN(Cn4ncc(Cl)c4C4CC4)CC3)noc2c1	ZINC000853514704	FJ	On-Demand	Anodyne	HTR7	28	51
CC(C)[C@H]1CCN(CN2CCC(c3noc4cc(F)ccc34)CC2)C1=O	ZINC000853514711	FH	On-Demand	Anodyne	DRD2	20	61
CC(C)[C@H]1CCN(CN2CCC(c3noc4cc(F)ccc34)CC2)C1=O	ZINC000853514711	FH	On-Demand	Anodyne	HTR2A	32	53
CC(C)[C@H]1CCN(CN2CCC(c3noc4cc(F)ccc34)CC2)C1=O	ZINC000853514711	FH	On-Demand	Anodyne	HTR7	29	49
COc1cccc(Nc2nc(N3C[C@H]4C[C@]4(CO)C3)nc3[nH]cnc23)c1	ZINC000853514838	FD	On-Demand	Anodyne	PDPK1	15	42
O=c1c2ccc(F)cc2nnn1CN1CCC2(CC1)OCCc1ccccc12	ZINC000853514912	GE	On-Demand	Anodyne	SIGMAR1	24	48
CC(C)[C@H]1CCN(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)C1=O	ZINC000853514956	FD	On-Demand	Bother	COLA	61	31
CC(C)(C)OC(=O)CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853514993	GF	On-Demand	Anodyne	CCR3	62	33
CC(C)(C)OC(=O)CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853514994	GF	On-Demand	Anodyne	CCR3	62	33
COC(=O)[C@@H]1CN(Cn2ncc(Cl)c2C2CC2)C[C@@H]1c1ccccc1	ZINC000853515028	FG	On-Demand	Anodyne	SLC6A4	18	41
COC(=O)[C@@H]1CN(Cn2ncc(Cl)c2C2CC2)C[C@@H]1c1ccccc1	ZINC000853515028	FG	On-Demand	Anodyne	SLC6A3	32	40
COc1cccc(Nc2nc(N3C[C@@H]4C[C@]4(CO)C3)nc3[nH]cnc23)c1	ZINC000853515043	FD	On-Demand	Anodyne	PDPK1	15	42
COc1cccc(Nc2nc(N3C[C@@H]4C[C@@]4(CO)C3)nc3[nH]cnc23)c1	ZINC000853515044	FD	On-Demand	Anodyne	PDPK1	15	42
COc1cccc(Nc2nc(N3C[C@H]4C[C@@]4(CO)C3)nc3[nH]cnc23)c1	ZINC000853515045	FD	On-Demand	Anodyne	PDPK1	15	42
CC(C)c1ccc2ncnc(N3C[C@H]4C[C@]4(CO)C3)c2c1	ZINC000853515206	CF	On-Demand	Anodyne	PDE3B	42	38
CC(C)c1ccc2ncnc(N3C[C@H]4C[C@@]4(CO)C3)c2c1	ZINC000853515207	CF	On-Demand	Anodyne	PDE3B	42	38
CC(C)c1ccc2ncnc(N3C[C@@H]4C[C@@]4(CO)C3)c2c1	ZINC000853515208	CF	On-Demand	Anodyne	PDE3B	42	38
CC(C)c1ccc2ncnc(N3C[C@@H]4C[C@]4(CO)C3)c2c1	ZINC000853515209	CF	On-Demand	Anodyne	PDE3B	42	38
COC(=O)[C@@H]1CN(Cn2nc(C)oc2=O)C[C@@H]1c1ccccc1	ZINC000853515262	DC	On-Demand	Anodyne	SLC6A3	21	46
COC(=O)[C@@H]1CN(Cn2nnc3cc(F)ccc3c2=O)C[C@@H]1c1ccccc1	ZINC000853515317	GD	On-Demand	Anodyne	SLC6A3	21	44
CC(C)[C@H]1CCN(CN2CCC3(CC2)OCCc2ccccc23)C1=O	ZINC000853515339	EG	On-Demand	Anodyne	SIGMAR1	33	53
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](CNS(=O)(=O)C2CC2)C1	ZINC000853515358	GC	On-Demand	Anodyne	CCR3	46	33
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](CNS(=O)(=O)C2CC2)C1	ZINC000853515359	GC	On-Demand	Anodyne	CCR3	46	33
O=C1c2cc(F)c(F)cc2CN1CN1CCC2(CC1)OCCc1ccccc12	ZINC000853515629	GG	On-Demand	Anodyne	OPRL1	41	35
O=C1c2cc(F)c(F)cc2CN1CN1CCC2(CC1)OCCc1ccccc12	ZINC000853515629	GG	On-Demand	Anodyne	SIGMAR1	25	51
COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccc(C(C)C)cc(=O)c2O)C1	ZINC000853515708	GG	On-Demand	Anodyne	ADRA1A	23	47
COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccc(C(C)C)cc(=O)c2O)C1	ZINC000853515708	GG	On-Demand	Anodyne	ADRA1B	16	47
O=C(NC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)C(F)(F)F	ZINC000853515714	GD	On-Demand	Anodyne	CCR3	75	33
CCOC(=O)c1nccc(N2CC(=O)N(C)C[C@H]2C)n1	ZINC000853515742	CC	On-Demand	Anodyne	SORD	27	40
C#Cc1cccnc1NCCN1CCCOCC1	ZINC000853515821	BD	On-Demand	Mild	HNMT	67	36
O=[N+]([O-])c1cn(CN2CCC[C@H]2COc2ccccc2)nc1-c1ccccn1	ZINC000853515959	GG	On-Demand	Bother	CHRNA10	47	40
CCOC(=O)c1nccc(N2CC(=O)N(C)C[C@@H]2C)n1	ZINC000853516014	CC	On-Demand	Anodyne	SORD	27	40
CC(C)[C@H]1CCN(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1=O	ZINC000853516029	ED	On-Demand	Anodyne	CHRNA4	31	55
O=c1c2ccc(F)cc2nnn1CN1CCC(c2noc3cc(F)ccc23)CC1	ZINC000853516030	GG	On-Demand	Anodyne	DRD2	18	59
O=c1c2ccc(F)cc2nnn1CN1CCC(c2noc3cc(F)ccc23)CC1	ZINC000853516030	GG	On-Demand	Anodyne	HTR2A	31	53
O=c1c2ccc(F)cc2nnn1CN1CCC(c2noc3cc(F)ccc23)CC1	ZINC000853516030	GG	On-Demand	Anodyne	HTR7	29	48
CC(C)(C[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)C(N)=O	ZINC000853516046	FD	On-Demand	Anodyne	CCR3	83	34
CC(C)(C[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1)C(N)=O	ZINC000853516046	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	35
NC(=O)[C@@]1(c2ccccc2)CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853516236	FE	On-Demand	Anodyne	TACR2	17	43
NC(=O)[C@]1(c2ccccc2)CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853516237	FE	On-Demand	Anodyne	TACR2	17	43
O=c1c2ccc(F)cc2nnn1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000853516283	FD	On-Demand	Anodyne	CHRNA4	29	55
O=C1c2cc(F)c(F)cc2CN1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000853516330	FE	On-Demand	Anodyne	CHRNA4	30	54
COC(=O)[C@@]1(c2ccccc2)CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853516456	FG	On-Demand	Anodyne	ADRA1A	25	40
COC(=O)[C@@]1(c2ccccc2)CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853516456	FG	On-Demand	Anodyne	ADRA1B	15	40
COC(=O)[C@@]1(c2ccccc2)CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853516456	FG	On-Demand	Anodyne	TACR2	27	40
COc1ccc2c(c1)CN(CN1Cc3cc(F)c(F)cc3C1=O)CCO2	ZINC000853516627	FF	On-Demand	Anodyne	ADAM17	33	41
O=c1cccc2n1C[C@H]1C[C@@H]2CN(Cn2cc([N+](=O)[O-])c(-c3ccccn3)n2)C1	ZINC000853517031	GE	On-Demand	Bother	CHRNA4	27	53
CN(C)C(=O)N[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517049	EC	On-Demand	Anodyne	CCR3	52	38
CN(C)C(=O)N[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517051	EC	On-Demand	Anodyne	CCR3	52	38
O=C1[C@@H](C2CCCCC2)CCN1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000853517079	FF	On-Demand	Anodyne	CHRNA4	30	52
O=C1[C@H](C2CCCCC2)CCN1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000853517080	FF	On-Demand	Anodyne	CHRNA4	30	52
O=C(NCc1ccccc1)[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517706	GD	On-Demand	Anodyne	HTR7	20	41
O=C(NCc1ccccc1)[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517706	GD	On-Demand	Anodyne	SIGMAR1	16	47
O=C(NCc1ccccc1)[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517706	GD	On-Demand	Anodyne	P2RX7	16	40
O=C(NCc1ccccc1)[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517706	GD	On-Demand	Anodyne	CCR3	39	41
O=C(NCc1ccccc1)[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517706	GD	On-Demand	Anodyne	CACNA1G	44	40
O=C(NCc1ccccc1)[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517707	GD	On-Demand	Anodyne	HTR7	20	41
O=C(NCc1ccccc1)[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517707	GD	On-Demand	Anodyne	SIGMAR1	16	47
O=C(NCc1ccccc1)[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517707	GD	On-Demand	Anodyne	P2RX7	16	40
O=C(NCc1ccccc1)[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517707	GD	On-Demand	Anodyne	CCR3	39	41
O=C(NCc1ccccc1)[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853517707	GD	On-Demand	Anodyne	CACNA1G	44	40
CCOC(=O)c1nccc(N2CCCN(c3ncccc3F)CC2)n1	ZINC000853517719	ED	On-Demand	Anodyne	SORD	78	38
CN(C[C@@H]1CCCN1C)Cn1ncc(Cl)c1C1CC1	ZINC000853517848	CE	On-Demand	Anodyne	CHRNA10	46	38
O=C(NCc1ccccc1)[C@H]1CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853517851	FG	On-Demand	Anodyne	SIGMAR1	21	55
O=C(NCc1ccccc1)[C@@H]1CCN(Cn2ncc(Cl)c2C2CC2)C1	ZINC000853517852	FG	On-Demand	Anodyne	SIGMAR1	21	55
CC(C)[C@H]1CCN(CN(C)C[C@](C)(O)c2ccccc2)C1=O	ZINC000853517858	DE	On-Demand	Anodyne	AMY2	44	31
CC(C)[C@H]1CCN(CN(C)C[C@@](C)(O)c2ccccc2)C1=O	ZINC000853517860	DE	On-Demand	Anodyne	AMY2	44	31
NC(=O)c1cc(N2CCCN(c3ncccc3F)CC2)ccc1[N+](=O)[O-]	ZINC000853517905	FD	On-Demand	Bother	STAT6	48	33
O=C(NCc1ccccc1)[C@H]1CCN(CN2CC[C@H](C3CCCCC3)C2=O)C1	ZINC000853517910	GG	On-Demand	Anodyne	SIGMAR1	20	53
O=C(NCc1ccccc1)[C@H]1CCN(CN2CC[C@H](C3CCCCC3)C2=O)C1	ZINC000853517910	GG	On-Demand	Anodyne	EPHX2	19	46
O=C(NCc1ccccc1)[C@H]1CCN(CN2CC[C@H](C3CCCCC3)C2=O)C1	ZINC000853517910	GG	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(NCc1ccccc1)[C@@H]1CCN(CN2CC[C@H](C3CCCCC3)C2=O)C1	ZINC000853517911	GG	On-Demand	Anodyne	SIGMAR1	20	53
O=C(NCc1ccccc1)[C@@H]1CCN(CN2CC[C@H](C3CCCCC3)C2=O)C1	ZINC000853517911	GG	On-Demand	Anodyne	EPHX2	19	46
O=C(NCc1ccccc1)[C@@H]1CCN(CN2CC[C@H](C3CCCCC3)C2=O)C1	ZINC000853517911	GG	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(NCc1ccccc1)[C@@H]1CCN(CN2CC[C@@H](C3CCCCC3)C2=O)C1	ZINC000853517912	GG	On-Demand	Anodyne	SIGMAR1	20	53
O=C(NCc1ccccc1)[C@@H]1CCN(CN2CC[C@@H](C3CCCCC3)C2=O)C1	ZINC000853517912	GG	On-Demand	Anodyne	EPHX2	19	46
O=C(NCc1ccccc1)[C@@H]1CCN(CN2CC[C@@H](C3CCCCC3)C2=O)C1	ZINC000853517912	GG	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(NCc1ccccc1)[C@H]1CCN(CN2CC[C@@H](C3CCCCC3)C2=O)C1	ZINC000853517913	GG	On-Demand	Anodyne	SIGMAR1	20	53
O=C(NCc1ccccc1)[C@H]1CCN(CN2CC[C@@H](C3CCCCC3)C2=O)C1	ZINC000853517913	GG	On-Demand	Anodyne	EPHX2	19	46
O=C(NCc1ccccc1)[C@H]1CCN(CN2CC[C@@H](C3CCCCC3)C2=O)C1	ZINC000853517913	GG	On-Demand	Anodyne	TMPRSS11D	53	33
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CTRA_BOVIN	49	31
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CTSB	26	42
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CTSK	30	42
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CTSL	34	42
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CAPNS1	50	30
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CAPN1	40	36
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CASP1	19	41
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	CAPN2	60	35
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	NPR	47	31
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	NAAA	54	36
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517925	FE	On-Demand	Anodyne	SLC12A5	57	33
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CTRA_BOVIN	49	31
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CTSB	26	42
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CTSK	30	42
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CTSL	34	42
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CAPNS1	50	30
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CAPN1	40	36
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CASP1	19	41
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	CAPN2	60	35
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	NPR	47	31
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	NAAA	54	36
CC(C)[C@H]1CCN(CN2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)C1=O	ZINC000853517931	FE	On-Demand	Anodyne	SLC12A5	57	33
COC(=O)[C@@H]1CN(CN2CC[C@H](C(C)C)C2=O)C[C@H]1c1ccccc1	ZINC000853518028	EE	On-Demand	Anodyne	SLC6A4	26	46
COC(=O)[C@@H]1CN(CN2CC[C@H](C(C)C)C2=O)C[C@H]1c1ccccc1	ZINC000853518028	EE	On-Demand	Anodyne	SLC6A3	49	42
COC(=O)[C@@H]1CN(CN2CC[C@@H](C(C)C)C2=O)C[C@H]1c1ccccc1	ZINC000853518029	EE	On-Demand	Anodyne	SLC6A4	26	46
COC(=O)[C@@H]1CN(CN2CC[C@@H](C(C)C)C2=O)C[C@H]1c1ccccc1	ZINC000853518029	EE	On-Demand	Anodyne	SLC6A3	49	42
CCOc1cc(N2CCCN(c3ncccc3F)CC2)nc(C)n1	ZINC000853518097	EE	On-Demand	Anodyne	GALR2	18	42
CN(C[C@@H]1CCCN1C)Cn1cc([N+](=O)[O-])c(-c2ccccn2)n1	ZINC000853518111	ED	On-Demand	Bother	CHRNA10	42	34
COC(=O)[C@@H]1CN(Cn2nc(C)oc2=O)C[C@H]1c1ccc(Br)cc1	ZINC000853518113	GD	On-Demand	Anodyne	SLC6A4	18	40
COC(=O)[C@@H]1CN(Cn2nc(C)oc2=O)C[C@H]1c1ccc(Br)cc1	ZINC000853518113	GD	On-Demand	Anodyne	SLC6A3	25	40
Cc1cc(CO)cc(N2CCCN(c3ncccc3F)CC2)n1	ZINC000853518140	DE	On-Demand	Anodyne	SORD	49	42
COC(=O)c1ccc(C(F)(F)F)nc1N1CCCN(c2ncccc2F)CC1	ZINC000853518153	GG	On-Demand	Anodyne	TRPV1	47	44
COc1ccc2c(c1)CN(CN1CC[C@@H](C(C)C)C1=O)C2	ZINC000853518168	CE	On-Demand	Anodyne	EBP	42	37
COc1ccc2c(c1)CN(CN1CC[C@H](C(C)C)C1=O)C2	ZINC000853518169	CE	On-Demand	Anodyne	EBP	42	37
CC(C)[C@H]1CCN(CN2CCC(CCNC(=O)OC(C)(C)C)CC2)C1=O	ZINC000853518171	FG	On-Demand	Anodyne	CACNA1I	45	32
COc1ccc2c(c1)CN(CN1Cc3cc(F)c(F)cc3C1=O)C2	ZINC000853518215	EF	On-Demand	Anodyne	ADAM17	41	47
COC(=O)c1nccc(N2CCCN(c3ncccc3F)CC2)n1	ZINC000853518277	ED	On-Demand	Anodyne	SORD	74	37
CC(C)(C)OC(=O)NCCC1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853518388	GH	On-Demand	Anodyne	CACNA1I	58	36
CC(C)(C)OC(=O)NCCC1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853518388	GH	On-Demand	Anodyne	SIRT3	21	41
CC(C)(C)OC(=O)NCCC1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853518388	GH	On-Demand	Anodyne	SIRT2	21	41
CC(C)(C)OC(=O)NCCC1CCN(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853518388	GH	On-Demand	Anodyne	SIRT1	19	41
COC(=O)[C@@H]1CN(Cn2ncc(Cl)c2C2CC2)C[C@H]1c1ccccc1	ZINC000853518448	FG	On-Demand	Anodyne	SLC6A4	18	41
COC(=O)[C@@H]1CN(Cn2ncc(Cl)c2C2CC2)C[C@H]1c1ccccc1	ZINC000853518448	FG	On-Demand	Anodyne	SLC6A3	32	40
CC(C)[C@H]1CCN(CN2CCO[C@H](c3cccc(F)c3)[C@H]2C)C1=O	ZINC000853518455	EG	On-Demand	Anodyne	CCR5	48	32
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518461	EE	On-Demand	Anodyne	SIGMAR1	24	55
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518461	EE	On-Demand	Anodyne	P2RX7	19	41
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518461	EE	On-Demand	Anodyne	CCR5	25	42
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518461	EE	On-Demand	Anodyne	EPHX2	16	48
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518461	EE	On-Demand	Anodyne	XIAP	25	43
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518461	EE	On-Demand	Anodyne	CACNA1G	42	41
CC(C)[C@H]1CCN(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518461	EE	On-Demand	Anodyne	TMPRSS11D	64	36
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518463	EE	On-Demand	Anodyne	SIGMAR1	24	55
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518463	EE	On-Demand	Anodyne	P2RX7	19	41
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518463	EE	On-Demand	Anodyne	CCR5	25	42
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518463	EE	On-Demand	Anodyne	EPHX2	16	48
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518463	EE	On-Demand	Anodyne	XIAP	25	43
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518463	EE	On-Demand	Anodyne	CACNA1G	42	41
CC(C)[C@H]1CCN(CN2CC[C@H](C(=O)NCc3ccccc3)C2)C1=O	ZINC000853518463	EE	On-Demand	Anodyne	TMPRSS11D	64	36
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](CC(F)(F)F)C1	ZINC000853518464	EF	On-Demand	Anodyne	CCR3	49	31
O=c1c2ccc(F)cc2nnn1CN1CCC[C@@H](CC(F)(F)F)C1	ZINC000853518464	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	44	36
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](CC(F)(F)F)C1	ZINC000853518465	EF	On-Demand	Anodyne	CCR3	49	31
O=c1c2ccc(F)cc2nnn1CN1CCC[C@H](CC(F)(F)F)C1	ZINC000853518465	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	44	36
CC(C)[C@H]1CCN(CN(C)C[C@@H]2CCCN2C)C1=O	ZINC000853518499	CD	On-Demand	Anodyne	CHRNA10	41	32
CC(C)[C@H]1CCN(CN(C)C[C@H]2CCCN2C)C1=O	ZINC000853518501	CD	On-Demand	Anodyne	CHRNA10	41	32
Fc1cc(N2CCC(c3ccccc3Br)CC2)ncn1	ZINC000853518542	EH	On-Demand	Anodyne	DCK	38	40
COC(=O)[C@@H]1CN(Cn2nc(C)oc2=O)C[C@H]1c1ccccc1	ZINC000853518547	DC	On-Demand	Anodyne	SLC6A3	21	46
COc1ccc(-c2nccc(N3CCCN(c4ncccc4F)CC3)n2)cc1	ZINC000853518604	GG	On-Demand	Anodyne	SORD	44	35
COc1ccc(-c2nccc(N3CCCN(c4ncccc4F)CC3)n2)cc1	ZINC000853518604	GG	On-Demand	Anodyne	GALR2	42	37
COC(=O)[C@@H]1CN(Cn2nnc3cc(F)ccc3c2=O)C[C@H]1c1ccccc1	ZINC000853518620	GD	On-Demand	Anodyne	SLC6A3	21	44
CN(C[C@@H]1CCCN1C)Cn1nnc2cc(F)ccc2c1=O	ZINC000853518732	DC	On-Demand	Anodyne	HRH1	28	44
CN(C[C@@H]1CCCN1C)Cn1nnc2cc(F)ccc2c1=O	ZINC000853518732	DC	On-Demand	Anodyne	CHRNA10	54	37
CN(C[C@@H]1CCCN1C)Cn1nnc2cc(F)ccc2c1=O	ZINC000853518732	DC	On-Demand	Anodyne	ACKR3	47	33
O=C(NCc1ccccc1)[C@H]1CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853518738	GF	On-Demand	Anodyne	SIGMAR1	16	50
O=C(NCc1ccccc1)[C@@H]1CCN(CN2Cc3cc(F)c(F)cc3C2=O)C1	ZINC000853518740	GF	On-Demand	Anodyne	SIGMAR1	16	50
C#CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518825	DD	On-Demand	Mild	CCR3	40	30
C#CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518825	DD	On-Demand	Mild	Q8MHZ5_SHEEP	40	35
C#CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518826	DD	On-Demand	Mild	CCR3	40	30
C#CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518826	DD	On-Demand	Mild	Q8MHZ5_SHEEP	40	35
COc1ccc2c(c1)CN(Cn1ncc(Cl)c1C1CC1)C2	ZINC000853518890	DG	On-Demand	Anodyne	NPBWR1	65	37
CC(=O)N[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518911	DC	On-Demand	Anodyne	CCR3	43	43
CC(=O)N[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518911	DC	On-Demand	Anodyne	MCHR1	19	42
CC(=O)N[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518913	DC	On-Demand	Anodyne	CCR3	43	43
CC(=O)N[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853518913	DC	On-Demand	Anodyne	MCHR1	19	42
CC(C)[C@H]1CCN(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)C1=O	ZINC000853518917	EF	On-Demand	Anodyne	SIGMAR1	22	41
CC(C)[C@H]1CCN(CN2Cc3ccccc3C[C@H]2C(=O)NC2CC2)C1=O	ZINC000853518934	FE	On-Demand	Anodyne	ADAM9	61	35
CC(C)[C@H]1CCN(CN2Cc3ccccc3C[C@H]2C(=O)NC2CC2)C1=O	ZINC000853518934	FE	On-Demand	Anodyne	BIRC3	44	34
C#Cc1cccnc1N1CCc2ccc(OC)cc2CC1	ZINC000853518944	CF	On-Demand	Mild	DRD5	24	50
CC(=O)c1ccc(C(F)(F)F)nc1N1CCCN(c2ncccc2F)CC1	ZINC000853519031	GH	On-Demand	Anodyne	TRPV1	42	43
CC(=O)N1CCN(c2ccc(CNc3cc(O)nc4cccnc34)cc2)CC1	ZINC000853519132	GF	On-Demand	Clean	STAT6	50	36
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cn3cnnc3)C2)CC1	ZINC000853519135	EF	On-Demand	Anodyne	GPR119	40	47
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cn3cnnc3)C2)CC1	ZINC000853519138	EF	On-Demand	Anodyne	GPR119	40	47
O=C1CCC2=C(CCN(CN3Cc4ccc(F)cc4C3=O)C2)N1	ZINC000853519154	DD	On-Demand	Anodyne	ADAM17	22	42
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cn3ccsc3=O)C2)CC1	ZINC000853519183	GG	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cn3ccsc3=O)C2)CC1	ZINC000853519184	GG	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cn3ncsc3=S)C2)CC1	ZINC000853519202	GH	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cn3ncsc3=S)C2)CC1	ZINC000853519203	GH	On-Demand	Anodyne	GPR119	32	44
CC(=O)N1CCN(c2ccc(CNc3ccc(N)c([N+](=O)[O-])n3)cc2)CC1	ZINC000853519207	FD	On-Demand	Clean	STAT6	51	37
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3CCSC3=O)C2)CC1	ZINC000853519216	GG	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3CCSC3=O)C2)CC1	ZINC000853519217	GG	On-Demand	Anodyne	GPR119	24	42
CC(=O)N1CCN(c2ccc(CNc3ccc([N+](=O)[O-])c(C(N)=O)c3)cc2)CC1	ZINC000853519220	GD	On-Demand	Clean	STAT6	72	41
CC(=O)N1CCN(c2ccc(CNc3cc(F)ncn3)cc2)CC1	ZINC000853519242	ED	On-Demand	Clean	STAT6	57	34
CC(=O)N1CCN(c2ccc(CNc3nc4ncccc4cc3C#N)cc2)CC1	ZINC000853519247	GF	On-Demand	Mild	STAT6	52	38
CC(=O)N1CCN(c2ccc(CNc3nc4ncccc4cc3C#N)cc2)CC1	ZINC000853519247	GF	On-Demand	Mild	SUCNR1	45	35
COC(=O)[C@@H]1CN(Cn2nc(C)oc2=O)C[C@H]1c1ccc(Cl)cc1	ZINC000853519292	FD	On-Demand	Anodyne	SLC6A4	25	48
COC(=O)[C@@H]1CN(Cn2nc(C)oc2=O)C[C@H]1c1ccc(Cl)cc1	ZINC000853519292	FD	On-Demand	Anodyne	SLC6A3	45	48
O=C1CCC2=C(CCN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)C2)N1	ZINC000853519356	GD	On-Demand	Anodyne	SIGMAR1	23	42
Cn1cnn(CN2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1=O	ZINC000853519366	GD	On-Demand	Anodyne	GPR119	38	44
O=C1CCC2=C(CCN(CN3C(=O)C(=O)c4ccc(OC(F)(F)F)cc43)C2)N1	ZINC000853519370	GD	On-Demand	Anodyne	CHRM5	15	40
Cn1cnn(CN2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1=O	ZINC000853519372	GD	On-Demand	Anodyne	GPR119	38	44
Cn1cnn(CN2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c1=O	ZINC000853519374	GD	On-Demand	Anodyne	GPR119	24	40
Cn1cnn(CN2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c1=O	ZINC000853519379	GD	On-Demand	Anodyne	GPR119	24	40
COc1cc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c([N+](=O)[O-])cc1C	ZINC000853519385	GG	On-Demand	Clean	BCL2L1	18	41
C[C@@H]1CCN(CN2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1=O	ZINC000853519392	GG	On-Demand	Anodyne	GPR119	30	43
C[C@H]1CCN(CN2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1=O	ZINC000853519398	GG	On-Demand	Anodyne	GPR119	30	43
C[C@@H]1CCN(CN2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1=O	ZINC000853519404	GG	On-Demand	Anodyne	GPR119	30	43
C[C@H]1CCN(CN2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1=O	ZINC000853519411	GG	On-Demand	Anodyne	GPR119	30	43
CC(=O)N1CCN(c2ccc(CNc3nc4ccccc4n4cccc34)cc2)CC1	ZINC000853519440	GH	On-Demand	Clean	HTR3A	26	40
CC(=O)N1CCN(c2ccc(CNc3nc4ccccc4n4cccc34)cc2)CC1	ZINC000853519440	GH	On-Demand	Clean	STAT6	54	39
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3C(=O)[C@@H]4CCC[C@@H]43)C2)CC1	ZINC000853519469	GG	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3C(=O)[C@@H]4CCC[C@@H]43)C2)CC1	ZINC000853519477	GG	On-Demand	Anodyne	GPR119	26	43
Cc1cc(C(F)(F)F)cc(N2CCCN(c3ncccc3F)CC2)n1	ZINC000853519481	FH	On-Demand	Anodyne	TRPV1	28	42
Cc1cc(C(F)(F)F)cc(N2CCCN(c3ncccc3F)CC2)n1	ZINC000853519481	FH	On-Demand	Anodyne	GALR2	15	49
Cn1cnn(CN2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1=S	ZINC000853519494	GG	On-Demand	Anodyne	GPR119	34	44
Cn1cnn(CN2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1=S	ZINC000853519501	GG	On-Demand	Anodyne	GPR119	34	44
CC(=O)N1CCN(c2ccc(CNc3ncnc4c3nnn4C)cc2)CC1	ZINC000853519527	FD	On-Demand	Clean	STAT6	51	39
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3CCCC3=O)C2)CC1	ZINC000853519542	FF	On-Demand	Anodyne	GPR119	32	45
CN(C[C@@H]1CCCN1C)CN1Cc2cc(F)c(F)cc2C1=O	ZINC000853519545	DD	On-Demand	Anodyne	CHRNA10	51	39
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3CCCC3=O)C2)CC1	ZINC000853519547	FF	On-Demand	Anodyne	GPR119	32	45
O=C1CCC2=C(CCN(CN3C(=O)C(=O)c4cc(-c5ccccc5)ccc43)C2)N1	ZINC000853519616	GF	On-Demand	Anodyne	ALDH1A1	42	34
CC(=O)N1CCN(c2ccc(CNc3nccnc3OC3CCC3)cc2)CC1	ZINC000853519667	GF	On-Demand	Clean	STAT6	53	36
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3C[C@H](O)CC3=O)C2)CC1	ZINC000853519717	GD	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3C[C@H](O)CC3=O)C2)CC1	ZINC000853519719	GD	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3C[C@@H](O)CC3=O)C2)CC1	ZINC000853519721	GD	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3C[C@@H](O)CC3=O)C2)CC1	ZINC000853519723	GD	On-Demand	Anodyne	GPR119	28	45
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(CN3C[C@H](O)CC3=O)CC2)C1	ZINC000853519746	GD	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(CN3C[C@H](O)CC3=O)CC2)C1	ZINC000853519747	GD	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(CN3C[C@@H](O)CC3=O)CC2)C1	ZINC000853519748	GD	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(CN3C[C@@H](O)CC3=O)CC2)C1	ZINC000853519749	GD	On-Demand	Anodyne	GPR119	15	40
CC(=O)N1CCN(c2ccc(CNc3ccc(C)nn3)cc2)CC1	ZINC000853519817	EE	On-Demand	Clean	STAT6	48	38
CC(=O)c1ccnc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c1	ZINC000853519864	FF	On-Demand	Clean	PRNP	45	34
O=C1CCC2=C(CCN(Cn3nc(-c4ccccc4F)ccc3=O)C2)N1	ZINC000853519886	FD	On-Demand	Anodyne	GABRA3	51	34
CC(C)[C@H]1CCN(CN2Cc3ccccc3C[C@@H]2C(=O)NC2CC2)C1=O	ZINC000853519961	FE	On-Demand	Anodyne	ADAM9	61	35
CC(C)[C@H]1CCN(CN2Cc3ccccc3C[C@@H]2C(=O)NC2CC2)C1=O	ZINC000853519961	FE	On-Demand	Anodyne	BIRC3	44	34
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)COc2ccc([N+](=O)[O-])cc2)cc1	ZINC000853520096	HG	On-Demand	Bother	ACACA	21	40
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)COc2ccc([N+](=O)[O-])cc2)cc1	ZINC000853520096	HG	On-Demand	Bother	ACACB	22	42
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(Cn3ccnc3S)CC2)C1	ZINC000853520145	GG	On-Demand	Anodyne	GPR119	31	44
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(Cn3ccnc3S)CC2)C1	ZINC000853520147	GG	On-Demand	Anodyne	GPR119	31	44
CC(C)c1ccc2ncnc(N3CCC[C@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520230	FF	On-Demand	Anodyne	PDE3A	42	45
CC(C)c1ccc2ncnc(N3CCC[C@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520230	FF	On-Demand	Anodyne	PDE3B	45	40
CC(C)c1ccc2ncnc(N3CCC[C@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520230	FF	On-Demand	Anodyne	SIRT3	61	32
CC(C)c1ccc2ncnc(N3CCC[C@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520230	FF	On-Demand	Anodyne	SIRT2	51	32
CC(C)c1ccc2ncnc(N3CCC[C@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520230	FF	On-Demand	Anodyne	SIRT1	49	30
CC(C)c1ccc2ncnc(N3CCC[C@@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520232	FF	On-Demand	Anodyne	PDE3A	42	45
CC(C)c1ccc2ncnc(N3CCC[C@@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520232	FF	On-Demand	Anodyne	PDE3B	45	40
CC(C)c1ccc2ncnc(N3CCC[C@@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520232	FF	On-Demand	Anodyne	SIRT3	61	32
CC(C)c1ccc2ncnc(N3CCC[C@@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520232	FF	On-Demand	Anodyne	SIRT2	51	32
CC(C)c1ccc2ncnc(N3CCC[C@@H](c4n[nH]cc4C(N)=O)C3)c2c1	ZINC000853520232	FF	On-Demand	Anodyne	SIRT1	49	30
O=C1CCC2=C(CCN(CN3C[C@@]4(CN5CCC4CC5)OC3=O)C2)N1	ZINC000853520305	EC	On-Demand	Anodyne	CHRNA7	15	53
O=C1CCC2=C(CCN(CN3C[C@]4(CN5CCC4CC5)OC3=O)C2)N1	ZINC000853520309	EC	On-Demand	Anodyne	CHRNA7	15	53
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(CN3CCCC3=O)CC2)C1	ZINC000853520325	FF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(CN3CCCC3=O)CC2)C1	ZINC000853520326	FF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(Cn3cccnc3=S)CC2)C1	ZINC000853520357	GH	On-Demand	Anodyne	GPR119	24	48
CC(=O)N1CCN(c2ccc(CNc3nc4ccc(N)cc4s3)cc2)CC1	ZINC000853520390	GG	On-Demand	Clean	CSNK1D	40	37
CC(=O)N1CCN(c2ccc(CNc3nc4ccc(N)cc4s3)cc2)CC1	ZINC000853520390	GG	On-Demand	Clean	SLC27A1	23	41
CC(=O)N1CCN(c2ccc(CNc3cnc(F)cn3)cc2)CC1	ZINC000853520394	ED	On-Demand	Clean	STAT6	75	37
CC(=O)N1CCN(c2ccc(CNc3nc(C#N)ccc3C)cc2)CC1	ZINC000853520396	EF	On-Demand	Mild	STAT6	42	36
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3C(=O)CC34CCC4)C2)CC1	ZINC000853520409	GG	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3C(=O)CC34CCC4)C2)CC1	ZINC000853520412	GG	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3C(=O)[C@H]4CC[C@H]3C4)C2)CC1	ZINC000853520460	GG	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3C(=O)[C@H]4CC[C@H]3C4)C2)CC1	ZINC000853520463	GG	On-Demand	Anodyne	GPR119	24	41
CC(=O)N1CCN(c2ccc(CNc3nccc4c(N)cccc34)cc2)CC1	ZINC000853520470	GG	On-Demand	Clean	STAT6	56	39
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3C(=O)[C@H]4C=C[C@H]3C4)C2)CC1	ZINC000853520488	GG	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3C(=O)[C@H]4C=C[C@H]3C4)C2)CC1	ZINC000853520490	GG	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cn3ccnc3S)C2)CC1	ZINC000853520492	GG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cn3ccnc3S)C2)CC1	ZINC000853520495	GG	On-Demand	Anodyne	GPR119	45	49
C#Cc1cccnc1NCc1ccc(N2CCN(C(C)=O)CC2)cc1	ZINC000853520499	EE	On-Demand	Mild	STAT6	54	38
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(Cn3cccnc3=S)CC2)C1	ZINC000853520530	GH	On-Demand	Anodyne	GPR119	24	48
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(Cn3nccc3[N+](=O)[O-])CC2)C1	ZINC000853520591	GG	On-Demand	Bother	GPR119	44	41
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(Cn3nccc3[N+](=O)[O-])CC2)C1	ZINC000853520594	GG	On-Demand	Bother	GPR119	44	41
CO[C@@H](C)[C@H](C)Nc1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853520611	DE	On-Demand	Anodyne	ABCC8	45	34
COc1ccc(-c2nnn(CN3CCC4=C(CCC(=O)N4)C3)n2)cc1OC	ZINC000853520615	FD	On-Demand	Anodyne	SCARB1	23	41
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cn3nccc3[N+](=O)[O-])C2)CC1	ZINC000853520648	GG	On-Demand	Bother	GPR119	52	45
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cn3nccc3[N+](=O)[O-])C2)CC1	ZINC000853520650	GG	On-Demand	Bother	GPR119	52	45
c1ccc(-n2cnc3c(NCC4OCCCO4)ncnc32)cc1	ZINC000853520672	DD	On-Demand	Anodyne	ADORA1	41	40
c1ccc(-n2cnc3c(NCC4OCCCO4)ncnc32)cc1	ZINC000853520672	DD	On-Demand	Anodyne	ADORA3	54	39
c1ccc(-n2cnc3c(NCC4OCCCO4)ncnc32)cc1	ZINC000853520672	DD	On-Demand	Anodyne	TNK2	52	38
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(Cn3cnnc3)CC2)C1	ZINC000853520697	EF	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(Cn3cnnc3)CC2)C1	ZINC000853520700	EF	On-Demand	Anodyne	GPR119	24	42
CC(=O)N1CCN(c2ccc(CNc3nccnc3-c3ccccc3)cc2)CC1	ZINC000853520726	GG	On-Demand	Clean	P2RX3	29	40
CC(=O)N1CCN(c2ccc(CNc3nccnc3-c3ccccc3)cc2)CC1	ZINC000853520726	GG	On-Demand	Clean	PRNP	50	37
CC(=O)N1CCN(c2ccc(CNc3nccnc3-c3ccccc3)cc2)CC1	ZINC000853520726	GG	On-Demand	Clean	STAT6	66	43
CC(=O)N1CCN(c2ccc(CNc3nccnc3-c3ccccc3)cc2)CC1	ZINC000853520726	GG	On-Demand	Clean	SMO	21	45
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3CCSC3=S)C2)CC1	ZINC000853520733	GH	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3CCSC3=S)C2)CC1	ZINC000853520735	GH	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cn3cc([N+](=O)[O-])cn3)C2)CC1	ZINC000853520752	GG	On-Demand	Bother	GPR119	44	43
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cn3cc([N+](=O)[O-])cn3)C2)CC1	ZINC000853520753	GG	On-Demand	Bother	GPR119	44	43
C[C@@H]1CC(=O)N(CN2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1	ZINC000853520756	GG	On-Demand	Anodyne	GPR119	26	42
C[C@H]1CC(=O)N(CN2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1	ZINC000853520758	GG	On-Demand	Anodyne	GPR119	26	42
C[C@@H]1CC(=O)N(CN2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1	ZINC000853520760	GG	On-Demand	Anodyne	GPR119	26	42
C[C@H]1CC(=O)N(CN2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1	ZINC000853520762	GG	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(Cn3cccnc3=S)C2)CC1	ZINC000853520776	GH	On-Demand	Anodyne	GPR119	42	53
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(Cn3cccnc3=S)C2)CC1	ZINC000853520778	GH	On-Demand	Anodyne	GPR119	42	53
CCOc1cc(NCc2ccc(N3CCN(C(C)=O)CC3)cc2)c(F)cn1	ZINC000853520782	FF	On-Demand	Clean	STAT6	72	35
C#CCCCOc1cccnc1NCc1ccc(N2CCN(C(C)=O)CC2)cc1	ZINC000853520934	GG	On-Demand	Mild	STAT6	40	35
CC(=O)N1CCN(c2ccc(CNc3cc(CO)c(F)cn3)cc2)CC1	ZINC000853520941	FD	On-Demand	Clean	BDKRB1	16	40
CC(=O)N1CCN(c2ccc(CNc3cc(CO)c(F)cn3)cc2)CC1	ZINC000853520941	FD	On-Demand	Clean	STAT6	81	35
CC(=O)N1CCN(c2ccc(CNc3cc(C(F)(F)F)cc(C)n3)cc2)CC1	ZINC000853521007	GH	On-Demand	Clean	MET	15	46
Cn1ncc2c(N3CCN(C(=O)COC(=O)COc4ccc([N+](=O)[O-])cc4)CC3)ncnc21	ZINC000853521018	JC	On-Demand	Bother	PDGFRB	37	42
CCNc1nccnc1NCc1ccc(N2CCN(C(C)=O)CC2)cc1	ZINC000853521055	FE	On-Demand	Clean	P2RX3	18	40
CCNc1nccnc1NCc1ccc(N2CCN(C(C)=O)CC2)cc1	ZINC000853521055	FE	On-Demand	Clean	PRNP	40	35
CCNc1nccnc1NCc1ccc(N2CCN(C(C)=O)CC2)cc1	ZINC000853521055	FE	On-Demand	Clean	STAT6	60	40
CC(C)c1ccc2ncnc(NCC3OCCCO3)c2c1	ZINC000853521104	CF	On-Demand	Anodyne	DYRK1A	19	46
CC(C)c1ccc2ncnc(NCC3OCCCO3)c2c1	ZINC000853521104	CF	On-Demand	Anodyne	CLK1	19	46
CC(C)c1ccc2ncnc(NCC3OCCCO3)c2c1	ZINC000853521104	CF	On-Demand	Anodyne	CLK2	22	42
CC(C)c1ccc2ncnc(NCC3OCCCO3)c2c1	ZINC000853521104	CF	On-Demand	Anodyne	CLK4	66	46
CC(C)c1ccc2ncnc(NCC3OCCCO3)c2c1	ZINC000853521104	CF	On-Demand	Anodyne	DYRK1B	18	46
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(CN3CCOC3=S)C2)CC1	ZINC000853521138	GF	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(CN3CCOC3=S)C2)CC1	ZINC000853521140	GF	On-Demand	Anodyne	GPR119	23	41
O=C1CCC2=C(CCN(CN3C(=O)C(=O)c4ccccc43)C2)N1	ZINC000853521216	DD	On-Demand	Anodyne	ALDH1A1	50	40
O=C1CCC2=C(CCN(CN3C(=O)C(=O)c4ccccc43)C2)N1	ZINC000853521216	DD	On-Demand	Anodyne	ALDH3A1	41	50
O=C1CCC2=C(CCN(CN3C(=O)C(=O)c4ccccc43)C2)N1	ZINC000853521216	DD	On-Demand	Anodyne	CES1	15	40
CCOC(=O)c1nccc(N2CC(O)(C(C)C)C2)n1	ZINC000853521401	CC	On-Demand	Anodyne	SORD	69	38
COC(=O)[C@H]1CCN(c2nc(C(F)F)nc3ccc(F)cc23)[C@@H]1C	ZINC000853521476	EG	On-Demand	Anodyne	DHODH	49	36
COC(=O)[C@H]1CCN(c2nc(C(F)F)nc3ccc(F)cc23)[C@H]1C	ZINC000853521478	EG	On-Demand	Anodyne	DHODH	49	36
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853521580	IE	On-Demand	Bother	SSTR1	45	40
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	DRD4	34	48
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	ACHE	21	44
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	LTA4H	30	47
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	SIGMAR1	37	55
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	CACNA1B	15	41
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	CCR3	34	42
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	UTS2R	19	43
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	FAAH	15	46
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	SLC6A5	28	42
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	MCHR1	23	43
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853521593	IE	On-Demand	Bother	BIRC2	42	44
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	DRD4	34	48
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	ACHE	21	44
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	LTA4H	30	47
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	SIGMAR1	37	55
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	CACNA1B	15	41
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	CCR3	34	42
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	UTS2R	19	43
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	FAAH	15	46
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	SLC6A5	28	42
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	MCHR1	23	43
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853521595	IE	On-Demand	Bother	BIRC2	42	44
O=C(COc1ccc(Cl)cc1Cl)N1CCN(c2cc(F)ncn2)CC1	ZINC000853521617	GF	On-Demand	Anodyne	MCHR2	18	40
CC(C)c1ccc2ncnc(N3CCC([C@@H](O)c4ncc[nH]4)CC3)c2c1	ZINC000853521640	FG	On-Demand	Anodyne	PDE3A	41	39
CC(C)c1ccc2ncnc(N3CCC([C@@H](O)c4ncc[nH]4)CC3)c2c1	ZINC000853521640	FG	On-Demand	Anodyne	AKT2	17	40
CC(C)c1ccc2ncnc(N3CCC([C@@H](O)c4ncc[nH]4)CC3)c2c1	ZINC000853521640	FG	On-Demand	Anodyne	PDE3B	45	39
CC(C)c1ccc2ncnc(N3CCC([C@H](O)c4ncc[nH]4)CC3)c2c1	ZINC000853521641	FG	On-Demand	Anodyne	PDE3A	41	39
CC(C)c1ccc2ncnc(N3CCC([C@H](O)c4ncc[nH]4)CC3)c2c1	ZINC000853521641	FG	On-Demand	Anodyne	AKT2	17	40
CC(C)c1ccc2ncnc(N3CCC([C@H](O)c4ncc[nH]4)CC3)c2c1	ZINC000853521641	FG	On-Demand	Anodyne	PDE3B	45	39
FC(F)(F)c1cc(Cl)c(N2CCN3CCC2CC3)nc1Cl	ZINC000853521893	EH	On-Demand	Anodyne	CHRNA7	23	42
O=S1(=O)N=C(Cl)c2ccc(N3CCN4CCC3CC4)cc21	ZINC000853521931	ED	On-Demand	Anodyne	CHRNA7	28	59
CNC(=O)c1nn(CN2CCC[C@H]2c2c(C)cccc2C)c(=O)c2ccccc12	ZINC000853522014	GG	On-Demand	Anodyne	HRH1	38	41
CNC(=O)c1nn(CN2CCC[C@@H]2c2c(C)cccc2C)c(=O)c2ccccc12	ZINC000853522015	GG	On-Demand	Anodyne	HRH1	38	41
COc1cc2c(cc1OC)N(CN1CCC[C@H]1c1c(C)cccc1C)C(=O)C2=O	ZINC000853522016	GH	On-Demand	Anodyne	CASP3	46	35
COc1cc2c(cc1OC)N(CN1CCC[C@H]1c1c(C)cccc1C)C(=O)C2=O	ZINC000853522016	GH	On-Demand	Anodyne	CASP7	64	35
COc1cc2c(cc1OC)N(CN1CCC[C@@H]1c1c(C)cccc1C)C(=O)C2=O	ZINC000853522017	GH	On-Demand	Anodyne	CASP3	46	35
COc1cc2c(cc1OC)N(CN1CCC[C@@H]1c1c(C)cccc1C)C(=O)C2=O	ZINC000853522017	GH	On-Demand	Anodyne	CASP7	64	35
COc1ccc(-c2nccc(N3CCC([C@@H](O)c4ncc[nH]4)CC3)n2)cc1	ZINC000853522033	FF	On-Demand	Anodyne	SORD	41	33
COc1ccc(-c2nccc(N3CCC([C@H](O)c4ncc[nH]4)CC3)n2)cc1	ZINC000853522034	FF	On-Demand	Anodyne	SORD	41	33
COC(=O)[C@H]1CCN(c2nc(Nc3cccc(OC)c3)c3nc[nH]c3n2)[C@H]1C	ZINC000853522059	GE	On-Demand	Anodyne	PDPK1	16	48
COC(=O)[C@H]1CCN(c2nc(Nc3cccc(OC)c3)c3nc[nH]c3n2)[C@@H]1C	ZINC000853522060	GE	On-Demand	Anodyne	PDPK1	16	48
CCOC(=O)c1nccc(N2CCC([C@@H](O)c3ncc[nH]3)CC2)n1	ZINC000853522072	ED	On-Demand	Anodyne	SORD	60	34
CCOC(=O)c1nccc(N2CCC([C@H](O)c3ncc[nH]3)CC2)n1	ZINC000853522073	ED	On-Demand	Anodyne	SORD	60	34
O=C1C(=O)N(CN2CC[C@H](Cn3ccnn3)C2)c2ccc(-c3ccccc3)cc21	ZINC000853522171	GE	On-Demand	Anodyne	CASP3	49	37
O=C1C(=O)N(CN2CC[C@H](Cn3ccnn3)C2)c2ccc(-c3ccccc3)cc21	ZINC000853522171	GE	On-Demand	Anodyne	CASP7	63	35
O=C1C(=O)N(CN2CC[C@@H](Cn3ccnn3)C2)c2ccc(-c3ccccc3)cc21	ZINC000853522172	GE	On-Demand	Anodyne	CASP3	49	37
O=C1C(=O)N(CN2CC[C@@H](Cn3ccnn3)C2)c2ccc(-c3ccccc3)cc21	ZINC000853522172	GE	On-Demand	Anodyne	CASP7	63	35
O=C1C(=O)N(CN2CC[C@@H](Cn3ccnn3)C2)c2ccc(Br)cc21	ZINC000853522259	GD	On-Demand	Anodyne	CASP3	43	37
O=C1C(=O)N(CN2CC[C@@H](Cn3ccnn3)C2)c2ccc(Br)cc21	ZINC000853522259	GD	On-Demand	Anodyne	CASP7	62	37
O=C1C(=O)N(CN2CC[C@H](Cn3ccnn3)C2)c2ccc(Br)cc21	ZINC000853522260	GD	On-Demand	Anodyne	CASP3	43	37
O=C1C(=O)N(CN2CC[C@H](Cn3ccnn3)C2)c2ccc(Br)cc21	ZINC000853522260	GD	On-Demand	Anodyne	CASP7	62	37
CC(C)c1ccc2ncnc(N3CC(O)(C(C)C)C3)c2c1	ZINC000853522261	CF	On-Demand	Anodyne	PDGFRB	26	42
CC(C)c1ccc2ncnc(N3CC(O)(C(C)C)C3)c2c1	ZINC000853522261	CF	On-Demand	Anodyne	PDE3B	41	38
O=c1c2cc(Cl)ccc2nnn1CN1CC[C@@H](Cn2ccnn2)C1	ZINC000853522425	ED	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	34
O=c1c2cc(Cl)ccc2nnn1CN1CC[C@H](Cn2ccnn2)C1	ZINC000853522428	ED	On-Demand	Anodyne	Q8MHZ5_SHEEP	47	34
CCOC(=O)[C@@]1(F)CN(CN2Cc3ccc(OC)cc3C2=O)CC12CCC2	ZINC000853522461	GE	On-Demand	Anodyne	ADAM17	38	42
CCOC(=O)[C@]1(F)CN(CN2Cc3ccc(OC)cc3C2=O)CC12CCC2	ZINC000853522462	GE	On-Demand	Anodyne	ADAM17	38	42
CCOC(=O)[C@@]1(F)CN(CN2C(=O)C(=O)c3ccccc32)CC12CCC2	ZINC000853522527	FD	On-Demand	Anodyne	ALDH1A1	39	40
CCOC(=O)[C@@]1(F)CN(CN2C(=O)C(=O)c3ccccc32)CC12CCC2	ZINC000853522527	FD	On-Demand	Anodyne	ALDH3A1	36	41
CCOC(=O)[C@]1(F)CN(CN2C(=O)C(=O)c3ccccc32)CC12CCC2	ZINC000853522529	FD	On-Demand	Anodyne	ALDH1A1	39	40
CCOC(=O)[C@]1(F)CN(CN2C(=O)C(=O)c3ccccc32)CC12CCC2	ZINC000853522529	FD	On-Demand	Anodyne	ALDH3A1	36	41
COC(=O)[C@H]1CCN(c2nccnc2-c2ccccc2)[C@H]1C	ZINC000853522608	CF	On-Demand	Anodyne	SLC6A3	15	47
COC(=O)[C@H]1CCN(c2nccnc2-c2ccccc2)[C@@H]1C	ZINC000853522610	CF	On-Demand	Anodyne	SLC6A3	15	47
Fc1cnc(N2CCN3CCC2CC3)cn1	ZINC000853522629	BC	On-Demand	Anodyne	CHRNA7	24	45
O=C1C(=O)N(CN2CC[C@@H](Cn3ccnn3)C2)c2ccccc21	ZINC000853522716	DC	On-Demand	Anodyne	ALDH3A1	38	48
O=C1C(=O)N(CN2CC[C@H](Cn3ccnn3)C2)c2ccccc21	ZINC000853522718	DC	On-Demand	Anodyne	ALDH3A1	38	48
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CC[C@H](Cn2ccnn2)C1	ZINC000853522789	FE	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	33
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CC[C@@H](Cn2ccnn2)C1	ZINC000853522791	FE	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	33
c1ccc(-n2cnc3c(NOC[C@@H]4CCOC4)ncnc32)cc1	ZINC000853523015	DE	On-Demand	Anodyne	ADORA1	22	40
c1ccc(-n2cnc3c(NOC[C@H]4CCOC4)ncnc32)cc1	ZINC000853523017	DE	On-Demand	Anodyne	ADORA1	22	40
N#CC[C@H]1CCCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853523084	DD	On-Demand	Mild	CHRNA7	15	53
N#CC[C@H]1CCCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853523088	DD	On-Demand	Mild	CHRNA7	15	53
N#CC[C@@H]1CCCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853523093	DD	On-Demand	Mild	CHRNA7	15	53
N#CC[C@@H]1CCCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853523103	DD	On-Demand	Mild	CHRNA7	15	53
COC(=O)[C@H]1CCN(c2nccc3cc(OC)c(OC)cc23)[C@H]1C	ZINC000853523106	EF	On-Demand	Anodyne	KDR	45	35
COC(=O)[C@H]1CCN(c2nccc3cc(OC)c(OC)cc23)[C@@H]1C	ZINC000853523114	EF	On-Demand	Anodyne	KDR	45	35
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H](Cn2ccnn2)C1	ZINC000853523122	GC	On-Demand	Anodyne	ACHE	34	42
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H](Cn2ccnn2)C1	ZINC000853523125	GC	On-Demand	Anodyne	ACHE	34	42
O=C1C(=O)N(CN2CC[C@H](Cn3ccnn3)C2)C(=O)N1Cc1ccccc1	ZINC000853523375	FC	On-Demand	Anodyne	ACHE	33	42
O=C1C(=O)N(CN2CC[C@@H](Cn3ccnn3)C2)C(=O)N1Cc1ccccc1	ZINC000853523376	FC	On-Demand	Anodyne	ACHE	33	42
CN1CCN(c2ccc(Nc3cc(F)ncn3)cc2Br)CC1	ZINC000853523496	FF	On-Demand	Anodyne	PAK1	42	36
CN1CCN(c2ccc(Nc3cc(F)ncn3)cc2Br)CC1	ZINC000853523496	FF	On-Demand	Anodyne	TNIK	48	42
COC(=O)[C@H]1CCN(c2ncnc3ccc(C(C)C)cc23)[C@H]1C	ZINC000853523551	DG	On-Demand	Anodyne	PDGFRB	45	43
COC(=O)[C@H]1CCN(c2ncnc3ccc(C(C)C)cc23)[C@H]1C	ZINC000853523551	DG	On-Demand	Anodyne	PDE3B	42	38
COC(=O)[C@H]1CCN(c2ncnc3ccc(C(C)C)cc23)[C@@H]1C	ZINC000853523556	DG	On-Demand	Anodyne	PDGFRB	45	43
COC(=O)[C@H]1CCN(c2ncnc3ccc(C(C)C)cc23)[C@@H]1C	ZINC000853523556	DG	On-Demand	Anodyne	PDE3B	42	38
O[C@@H](c1ncc[nH]1)C1CCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853523705	EG	On-Demand	Anodyne	HTR3A	26	46
O[C@H](c1ncc[nH]1)C1CCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853523707	EG	On-Demand	Anodyne	HTR3A	26	46
COC(=O)[C@H]1CCN(c2nc3ccccc3n3cccc23)[C@@H]1C	ZINC000853523762	DF	On-Demand	Anodyne	HTR3A	24	40
COC(=O)[C@H]1CCN(c2nc3ccccc3n3cccc23)[C@H]1C	ZINC000853523766	DF	On-Demand	Anodyne	HTR3A	24	40
Cn1ncc2c(=O)n(CN3CC[C@H](Cn4ccnn4)C3)nnc21	ZINC000853524024	DB	On-Demand	Anodyne	Q9M629_MAIZE	46	33
Cn1ncc2c(=O)n(CN3CC[C@@H](Cn4ccnn4)C3)nnc21	ZINC000853524033	DB	On-Demand	Anodyne	Q9M629_MAIZE	46	33
COc1ccc(-c2nccc(N3CC(O)(C(C)C)C3)n2)cc1	ZINC000853524154	CE	On-Demand	Anodyne	SORD	50	34
COC(=O)[C@H]1CCN(c2cc(-c3ccccc3)nc3ccnn23)[C@@H]1C	ZINC000853524173	EF	On-Demand	Anodyne	VCP	41	35
COC(=O)[C@H]1CCN(c2cc(-c3ccccc3)nc3ccnn23)[C@H]1C	ZINC000853524181	EF	On-Demand	Anodyne	VCP	41	35
COC(=O)c1nn(CN2CCC[C@H](CC#N)C2)c2ccccc12	ZINC000853524227	DE	On-Demand	Mild	HTR4	42	41
COC(=O)c1nn(CN2CCC[C@@H](CC#N)C2)c2ccccc12	ZINC000853524242	DE	On-Demand	Mild	HTR4	42	41
N#CC[C@@H]1CCCN(CN2CC(=O)N(Cc3ccccc3C#N)C2=O)C1	ZINC000853524415	FD	On-Demand	Mild	DPP4	15	42
N#CC[C@H]1CCCN(CN2CC(=O)N(Cc3ccccc3C#N)C2=O)C1	ZINC000853524416	FD	On-Demand	Mild	DPP4	15	42
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853524586	JD	On-Demand	Bother	CA2	31	47
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853524586	JD	On-Demand	Bother	CA1	24	47
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853524586	JD	On-Demand	Bother	CA7	25	47
C[C@@H](OC(=O)COc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853524586	JD	On-Demand	Bother	CA12	23	47
C[C@H](NC(=O)[C@@H](C)OC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853524601	JD	On-Demand	Bother	CA2	31	47
C[C@H](NC(=O)[C@@H](C)OC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853524601	JD	On-Demand	Bother	CA1	24	47
C[C@H](NC(=O)[C@@H](C)OC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853524601	JD	On-Demand	Bother	CA7	25	47
C[C@H](NC(=O)[C@@H](C)OC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853524601	JD	On-Demand	Bother	CA12	23	47
CC(C)c1ccc2ncnc(NOC[C@@H]3CCOC3)c2c1	ZINC000853524686	CG	On-Demand	Anodyne	DYRK1A	17	48
CC(C)c1ccc2ncnc(NOC[C@@H]3CCOC3)c2c1	ZINC000853524686	CG	On-Demand	Anodyne	CLK1	15	48
CC(C)c1ccc2ncnc(NOC[C@@H]3CCOC3)c2c1	ZINC000853524686	CG	On-Demand	Anodyne	CLK2	21	48
CC(C)c1ccc2ncnc(NOC[C@@H]3CCOC3)c2c1	ZINC000853524686	CG	On-Demand	Anodyne	CLK4	31	48
CC(C)c1ccc2ncnc(NOC[C@@H]3CCOC3)c2c1	ZINC000853524686	CG	On-Demand	Anodyne	DYRK1B	15	48
CC(C)c1ccc2ncnc(NOC[C@H]3CCOC3)c2c1	ZINC000853524687	CG	On-Demand	Anodyne	DYRK1A	17	48
CC(C)c1ccc2ncnc(NOC[C@H]3CCOC3)c2c1	ZINC000853524687	CG	On-Demand	Anodyne	CLK1	15	48
CC(C)c1ccc2ncnc(NOC[C@H]3CCOC3)c2c1	ZINC000853524687	CG	On-Demand	Anodyne	CLK2	21	48
CC(C)c1ccc2ncnc(NOC[C@H]3CCOC3)c2c1	ZINC000853524687	CG	On-Demand	Anodyne	CLK4	31	48
CC(C)c1ccc2ncnc(NOC[C@H]3CCOC3)c2c1	ZINC000853524687	CG	On-Demand	Anodyne	DYRK1B	15	48
N#CC[C@@H]1CCCN(CN2CC(c3ccc(Cl)cc3)=CC2=O)C1	ZINC000853524692	EG	On-Demand	Mild	Q8MHZ5_SHEEP	50	37
N#CC[C@H]1CCCN(CN2CC(c3ccc(Cl)cc3)=CC2=O)C1	ZINC000853524693	EG	On-Demand	Mild	Q8MHZ5_SHEEP	50	37
N#CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853524737	DD	On-Demand	Mild	CCR3	41	33
N#CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853524737	DD	On-Demand	Mild	Q8MHZ5_SHEEP	50	37
N#CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853524738	DD	On-Demand	Mild	CCR3	41	33
N#CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853524738	DD	On-Demand	Mild	Q8MHZ5_SHEEP	50	37
Cc1ccccc1[C@@H]1CC(=O)N(CN2CCC[C@@H](CC#N)C2)C1	ZINC000853524837	DF	On-Demand	Mild	Q8MHZ5_SHEEP	40	34
Cc1ccccc1[C@@H]1CC(=O)N(CN2CCC[C@H](CC#N)C2)C1	ZINC000853524838	DF	On-Demand	Mild	Q8MHZ5_SHEEP	40	34
N#CC[C@@H]1CCCN(CN2C[C@@H]3CN(Cc4ccccc4)CC[C@@H]3C2=O)C1	ZINC000853524901	FF	On-Demand	Mild	SIGMAR1	34	42
N#CC[C@H]1CCCN(CN2C[C@@H]3CN(Cc4ccccc4)CC[C@@H]3C2=O)C1	ZINC000853524903	FF	On-Demand	Mild	SIGMAR1	34	42
CN1CCN(c2ccc(Nc3cnccn3)cc2Br)CC1	ZINC000853524929	EF	On-Demand	Anodyne	PAK1	45	35
CN1CCN(c2ccc(Nc3cnccn3)cc2Br)CC1	ZINC000853524929	EF	On-Demand	Anodyne	TNIK	53	44
CN1CCN(c2ccc(Nc3cnccn3)cc2Br)CC1	ZINC000853524929	EF	On-Demand	Anodyne	KARS	51	35
CCCN(CCCN(C)C)c1cc(Cl)nc2cc(C)nn12	ZINC000853524962	DF	On-Demand	Anodyne	CRHR1	37	41
C=CCn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@@H](CC#N)C2)c1=S	ZINC000853525023	GJ	On-Demand	Mild	Q8MHZ5_SHEEP	41	35
C=CCn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@H](CC#N)C2)c1=S	ZINC000853525024	GJ	On-Demand	Mild	Q8MHZ5_SHEEP	41	35
N#CC[C@H]1CCCN(Cn2nnc3ccccc3c2=O)C1	ZINC000853525033	CD	On-Demand	Mild	Q8MHZ5_SHEEP	46	33
N#CC[C@@H]1CCCN(Cn2nnc3ccccc3c2=O)C1	ZINC000853525034	CD	On-Demand	Mild	Q8MHZ5_SHEEP	46	33
N#CC[C@@H]1CCCN(Cn2nc(-c3ccc(F)cc3)c3ccccc3c2=O)C1	ZINC000853525049	GH	On-Demand	Mild	Q8MHZ5_SHEEP	63	38
N#CC[C@H]1CCCN(Cn2nc(-c3ccc(F)cc3)c3ccccc3c2=O)C1	ZINC000853525050	GH	On-Demand	Mild	Q8MHZ5_SHEEP	63	38
N#CC[C@H]1CCCN(Cn2ncc3ccccc3c2=O)C1	ZINC000853525059	CD	On-Demand	Mild	Q8MHZ5_SHEEP	46	33
N#CC[C@@H]1CCCN(Cn2ncc3ccccc3c2=O)C1	ZINC000853525060	CD	On-Demand	Mild	Q8MHZ5_SHEEP	46	33
COc1ccc(-c2nn(CN3CCC[C@@H](CC#N)C3)c(=O)c3ccccc23)cc1	ZINC000853525120	GH	On-Demand	Mild	HRH1	23	42
COc1ccc(-c2nn(CN3CCC[C@@H](CC#N)C3)c(=O)c3ccccc23)cc1	ZINC000853525120	GH	On-Demand	Mild	HRH3	16	44
COc1ccc(-c2nn(CN3CCC[C@@H](CC#N)C3)c(=O)c3ccccc23)cc1	ZINC000853525120	GH	On-Demand	Mild	Q8MHZ5_SHEEP	74	40
COc1ccc(-c2nn(CN3CCC[C@H](CC#N)C3)c(=O)c3ccccc23)cc1	ZINC000853525121	GH	On-Demand	Mild	HRH1	23	42
COc1ccc(-c2nn(CN3CCC[C@H](CC#N)C3)c(=O)c3ccccc23)cc1	ZINC000853525121	GH	On-Demand	Mild	HRH3	16	44
COc1ccc(-c2nn(CN3CCC[C@H](CC#N)C3)c(=O)c3ccccc23)cc1	ZINC000853525121	GH	On-Demand	Mild	Q8MHZ5_SHEEP	74	40
N#CC[C@@H]1CCCN(Cn2nc(-c3ccccc3F)ccc2=O)C1	ZINC000853525151	EF	On-Demand	Mild	Q8MHZ5_SHEEP	42	33
N#CC[C@@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000853525164	EF	On-Demand	Mild	Q8MHZ5_SHEEP	40	40
N#CC[C@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000853525165	EF	On-Demand	Mild	Q8MHZ5_SHEEP	40	40
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@@H](Cn2ccnn2)C1	ZINC000853525225	EC	On-Demand	Anodyne	CHRNA7	15	47
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H](Cn2ccnn2)C1	ZINC000853525229	EC	On-Demand	Anodyne	CHRNA7	15	47
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H](Cn2ccnn2)C1	ZINC000853525232	EC	On-Demand	Anodyne	CHRNA7	15	47
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@H](Cn2ccnn2)C1	ZINC000853525234	EC	On-Demand	Anodyne	CHRNA7	15	47
N#CC[C@H]1CCCN(CN2C(=O)c3ccccc3C2=O)C1	ZINC000853525342	CD	On-Demand	Mild	Q8MHZ5_SHEEP	49	34
N#CC[C@@H]1CCCN(CN2C(=O)c3ccccc3C2=O)C1	ZINC000853525345	CD	On-Demand	Mild	Q8MHZ5_SHEEP	49	34
FC(F)(F)c1cc(Cl)c(NOC[C@H]2CCOC2)nc1Cl	ZINC000853525475	EH	On-Demand	Anodyne	XDH	17	45
FC(F)(F)c1cc(Cl)c(NOC[C@@H]2CCOC2)nc1Cl	ZINC000853525476	EH	On-Demand	Anodyne	XDH	17	45
Cn1ncc2c(=O)n(CN3CCC[C@@H](CC#N)C3)nnc21	ZINC000853525500	CC	On-Demand	Mild	Q9M629_MAIZE	51	36
Cn1ncc2c(=O)n(CN3CCC[C@H](CC#N)C3)nnc21	ZINC000853525501	CC	On-Demand	Mild	Q9M629_MAIZE	51	36
C=CCn1c(-c2ccccc2C)nn(CN2CCC[C@@H](CC#N)C2)c1=S	ZINC000853525520	FI	On-Demand	Mild	Q8MHZ5_SHEEP	52	36
C=CCn1c(-c2ccccc2C)nn(CN2CCC[C@H](CC#N)C2)c1=S	ZINC000853525521	FI	On-Demand	Mild	Q8MHZ5_SHEEP	52	36
N#CC[C@H]1CCCN(Cn2[nH]c(-c3ccc(Cl)cc3)nc2=S)C1	ZINC000853525615	EH	On-Demand	Mild	Q8MHZ5_SHEEP	40	34
N#CC[C@@H]1CCCN(Cn2[nH]c(-c3ccc(Cl)cc3)nc2=S)C1	ZINC000853525616	EH	On-Demand	Mild	Q8MHZ5_SHEEP	40	34
CCOc1ccc(-c2nnn(CN3CCC[C@@H](CC#N)C3)n2)cc1	ZINC000853525670	EE	On-Demand	Mild	CACNA2D2	49	31
CCOc1ccc(-c2nnn(CN3CCC[C@H](CC#N)C3)n2)cc1	ZINC000853525671	EE	On-Demand	Mild	CACNA2D2	49	31
N#CC[C@H]1CCCN(Cn2nnc3ccc(Cl)cc3c2=O)C1	ZINC000853525685	DE	On-Demand	Mild	Q8MHZ5_SHEEP	84	40
N#CC[C@@H]1CCCN(Cn2nnc3ccc(Cl)cc3c2=O)C1	ZINC000853525687	DE	On-Demand	Mild	Q8MHZ5_SHEEP	84	40
N#CC[C@@H]1CCCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)C1	ZINC000853525886	FG	On-Demand	Mild	SLC6A1	61	35
N#CC[C@H]1CCCN(Cc2c(O)ccc(C(=O)c3ccccc3)c2O)C1	ZINC000853525887	FG	On-Demand	Mild	SLC6A1	61	35
N#CC[C@@H]1CCCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000853525896	FH	On-Demand	Mild	Q8MHZ5_SHEEP	52	33
N#CC[C@H]1CCCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000853525897	FH	On-Demand	Mild	Q8MHZ5_SHEEP	52	33
COC(=O)c1nn(CN2CC[C@@H](Cn3ccnn3)C2)c2ccccc12	ZINC000853525965	ED	On-Demand	Anodyne	HTR4	48	41
COC(=O)c1nn(CN2CC[C@H](Cn3ccnn3)C2)c2ccccc12	ZINC000853525967	ED	On-Demand	Anodyne	HTR4	48	41
CN1CCN(c2ccc(Nc3cnc(F)cn3)cc2Br)CC1	ZINC000853525986	FF	On-Demand	Anodyne	PAK1	43	36
CN1CCN(c2ccc(Nc3cnc(F)cn3)cc2Br)CC1	ZINC000853525986	FF	On-Demand	Anodyne	TNIK	49	41
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853525996	CD	On-Demand	Mild	ALDH1A1	50	40
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853525996	CD	On-Demand	Mild	ALDH3A1	42	49
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853525998	CD	On-Demand	Mild	ALDH1A1	50	40
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853525998	CD	On-Demand	Mild	ALDH3A1	42	49
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H](Cn2ccnn2)C1	ZINC000853526026	GD	On-Demand	Anodyne	SIGMAR1	29	40
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H](Cn2ccnn2)C1	ZINC000853526028	GD	On-Demand	Anodyne	SIGMAR1	29	40
CN1CCN(c2ccc(Nc3cc(C#N)cnn3)cc2Br)CC1	ZINC000853526059	FF	On-Demand	Mild	PAK1	49	40
CN1CCN(c2ccc(Nc3cc(C#N)cnn3)cc2Br)CC1	ZINC000853526059	FF	On-Demand	Mild	TNIK	55	48
N#CC[C@H]1CCCN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000853526083	DF	On-Demand	Mild	Q8MHZ5_SHEEP	44	35
N#CC[C@@H]1CCCN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000853526085	DF	On-Demand	Mild	Q8MHZ5_SHEEP	44	35
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526171	FG	On-Demand	Mild	CASP3	51	37
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526171	FG	On-Demand	Mild	ALDH1A1	48	34
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526171	FG	On-Demand	Mild	CASP7	71	36
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526171	FG	On-Demand	Mild	Q8MHZ5_SHEEP	47	35
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526172	FG	On-Demand	Mild	CASP3	51	37
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526172	FG	On-Demand	Mild	ALDH1A1	48	34
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526172	FG	On-Demand	Mild	CASP7	71	36
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853526172	FG	On-Demand	Mild	Q8MHZ5_SHEEP	47	35
C#Cc1cccnc1N(CC)CCCN1CCCC1	ZINC000853526186	CE	On-Demand	Mild	HNMT	40	52
Cn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@H](CC#N)C2)c1=S	ZINC000853526223	FH	On-Demand	Mild	Q8MHZ5_SHEEP	42	35
Cn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@@H](CC#N)C2)c1=S	ZINC000853526224	FH	On-Demand	Mild	Q8MHZ5_SHEEP	42	35
CCn1c(-c2ccccc2)nn(CN2CCC[C@@H](CC#N)C2)c1=S	ZINC000853526247	EH	On-Demand	Mild	Q8MHZ5_SHEEP	41	34
CCn1c(-c2ccccc2)nn(CN2CCC[C@H](CC#N)C2)c1=S	ZINC000853526248	EH	On-Demand	Mild	Q8MHZ5_SHEEP	41	34
COc1ccc(-c2nnn(CN3CCC[C@H](CC#N)C3)n2)cc1OC	ZINC000853526354	ED	On-Demand	Mild	SCARB1	19	40
COc1ccc(-c2nnn(CN3CCC[C@@H](CC#N)C3)n2)cc1OC	ZINC000853526355	ED	On-Demand	Mild	SCARB1	19	40
CCOC(=O)[C@@]1(F)CN(Cn2nnc3c(cnn3C)c2=O)CC12CCC2	ZINC000853526508	FC	On-Demand	Anodyne	Q9M629_MAIZE	56	43
CCOC(=O)[C@]1(F)CN(Cn2nnc3c(cnn3C)c2=O)CC12CCC2	ZINC000853526509	FC	On-Demand	Anodyne	Q9M629_MAIZE	56	43
N#CC[C@@H]1CCCN(Cn2nc(-c3ccc(F)c(F)c3)c3ccccc3c2=O)C1	ZINC000853526554	GH	On-Demand	Mild	HRH1	26	41
N#CC[C@@H]1CCCN(Cn2nc(-c3ccc(F)c(F)c3)c3ccccc3c2=O)C1	ZINC000853526554	GH	On-Demand	Mild	Q8MHZ5_SHEEP	65	36
N#CC[C@H]1CCCN(Cn2nc(-c3ccc(F)c(F)c3)c3ccccc3c2=O)C1	ZINC000853526555	GH	On-Demand	Mild	HRH1	26	41
N#CC[C@H]1CCCN(Cn2nc(-c3ccc(F)c(F)c3)c3ccccc3c2=O)C1	ZINC000853526555	GH	On-Demand	Mild	Q8MHZ5_SHEEP	65	36
N#CC[C@@H]1CCCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000853526564	DE	On-Demand	Mild	Q8MHZ5_SHEEP	42	32
N#CC[C@H]1CCCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000853526565	DE	On-Demand	Mild	Q8MHZ5_SHEEP	42	32
N#CC[C@@H]1CCCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000853526656	GH	On-Demand	Mild	Q8MHZ5_SHEEP	49	37
N#CC[C@H]1CCCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000853526657	GH	On-Demand	Mild	Q8MHZ5_SHEEP	49	37
Cn1ncc2c(=O)n(CN3Cc4ccccc4[C@@H](C(=O)OC(C)(C)C)C3)nnc21	ZINC000853526678	GD	On-Demand	Anodyne	Q9M629_MAIZE	46	33
Cn1ncc2c(=O)n(CN3Cc4ccccc4[C@H](C(=O)OC(C)(C)C)C3)nnc21	ZINC000853526679	GD	On-Demand	Anodyne	Q9M629_MAIZE	46	33
CCn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@@H](CC#N)C2)c1=S	ZINC000853526701	GI	On-Demand	Mild	Q8MHZ5_SHEEP	50	40
CCn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@H](CC#N)C2)c1=S	ZINC000853526702	GI	On-Demand	Mild	Q8MHZ5_SHEEP	50	40
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000853526748	FF	On-Demand	Mild	CASP3	41	39
N#CC[C@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000853526748	FF	On-Demand	Mild	CASP7	62	39
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000853526749	FF	On-Demand	Mild	CASP3	41	39
N#CC[C@@H]1CCCN(CN2C(=O)C(=O)c3cc(Br)ccc32)C1	ZINC000853526749	FF	On-Demand	Mild	CASP7	62	39
CCC(=O)c1ccc(N(CC)CCCN2CCCC2)c(S(=O)(=O)NC)c1	ZINC000853526784	GE	On-Demand	Anodyne	HNMT	29	40
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CCC(c2ccco2)CC1	ZINC000853526914	GF	On-Demand	Anodyne	ACHE	20	40
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CCC(c2ccco2)CC1	ZINC000853526914	GF	On-Demand	Anodyne	SIGMAR1	38	41
Cc1ccn(CN2CCC(c3ccco3)CC2)c(=O)c1C#N	ZINC000853526986	CE	On-Demand	Mild	GRM2	15	40
O=C1C(=O)N(CN2CCC(c3ccco3)CC2)c2ccccc21	ZINC000853527133	DF	On-Demand	Anodyne	ALDH1A1	57	41
O=C1C(=O)N(CN2CCC(c3ccco3)CC2)c2ccccc21	ZINC000853527133	DF	On-Demand	Anodyne	ALDH3A1	43	54
O=C1C(=O)N(CN2CCC(c3ccco3)CC2)c2ccccc21	ZINC000853527133	DF	On-Demand	Anodyne	CES1	16	41
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC(c2ccco2)CC1	ZINC000853527173	EE	On-Demand	Anodyne	CHRNA7	19	52
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC(c2ccco2)CC1	ZINC000853527174	EE	On-Demand	Anodyne	CHRNA7	19	52
O=C1C(=O)N(CN2CCC(c3ccco3)CC2)C(=O)N1Cc1ccccc1	ZINC000853527220	FE	On-Demand	Anodyne	SIGMAR1	31	40
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CCC(c3ccco3)CC2)C1	ZINC000853527458	GF	On-Demand	Anodyne	CACNA1I	40	33
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CCC(c3ccco3)CC2)C1	ZINC000853527459	GF	On-Demand	Anodyne	CACNA1I	40	33
COC(=O)c1nn(CN2CCC(c3ccco3)CC2)c2ccccc12	ZINC000853527462	EG	On-Demand	Anodyne	HTR4	45	36
O=C1C(=O)N(CN2CCC(c3ccco3)CC2)c2ccc(Br)cc21	ZINC000853527521	GG	On-Demand	Anodyne	ALDH1A1	19	45
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CCc2cc(Cl)ccc2C1	ZINC000853527608	GG	On-Demand	Anodyne	AKR1C3	15	40
Cn1ncc2c(=O)n(CN3CCC(c4ccco4)CC3)nnc21	ZINC000853527689	DC	On-Demand	Anodyne	Q9M629_MAIZE	51	34
Cn1nnc2c(N3CCC4(CCN(C(=O)OC(C)(C)C)CC4)CC3)ncnc21	ZINC000853528007	GE	On-Demand	Anodyne	GPR119	28	40
Cc1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)CC2)nn1	ZINC000853528008	EG	On-Demand	Anodyne	GPR119	38	47
CC(C)(C)OC(=O)N1CCC2(CC1)CCN(c1cnc(F)cn1)CC2	ZINC000853528009	FG	On-Demand	Anodyne	GPR119	39	48
O=C1C(=O)N(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)c2ccccc21	ZINC000853528013	GD	On-Demand	Anodyne	ALDH1A1	76	65
O=C1C(=O)N(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)c2ccccc21	ZINC000853528013	GD	On-Demand	Anodyne	ALDH3A1	51	68
O=C1C(=O)N(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)c2ccccc21	ZINC000853528013	GD	On-Demand	Anodyne	CES1	19	55
C#Cc1cccnc1N1CCC(c2noc(-c3ccccc3OC)n2)CC1	ZINC000853528025	FH	On-Demand	Mild	LUCI_PHOPE	24	44
CCOC(=O)c1cnn(CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)c1	ZINC000853528043	GF	On-Demand	Anodyne	NOD2	32	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccccc1Br)c1ccccc1	ZINC000853528045	HK	On-Demand	Anodyne	KCNQ2	47	37
COc1ccccc1-c1nc(C2CCN(c3cnc(F)cn3)CC2)no1	ZINC000853528068	FG	On-Demand	Anodyne	LUCI_PHOPE	32	41
Cc1cc(C)c(O)c(CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)c1	ZINC000853528075	FI	On-Demand	Clean	HDAH	22	40
Cc1cc(CO)cc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)CC2)n1	ZINC000853528080	GG	On-Demand	Anodyne	GPR119	29	48
Cn1c(=O)n(CN2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)c2ccccc21	ZINC000853528090	GF	On-Demand	Anodyne	CALCRL	39	46
O=C1[C@@H]2CN(Cc3cc4c(cc3O)OCO4)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853528117	GD	On-Demand	Clean	SIGMAR1	18	42
O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[C@H](OCc2ccncc2)C1	ZINC000853528210	EH	On-Demand	Bother	LIPG	47	41
O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[C@@H](OCc2ccncc2)C1	ZINC000853528211	EH	On-Demand	Bother	LIPG	47	41
CC(C)(C)OC(=O)N1CCC2(CC1)CCN(c1cc(F)ncn1)CC2	ZINC000853528308	FG	On-Demand	Anodyne	GPR119	43	51
COC(=O)c1nccc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)CC2)n1	ZINC000853528323	GF	On-Demand	Anodyne	GPR119	33	49
CC(C)(C)OC(=O)N1CCC2(CC1)CCN(c1cc(C#N)cnn1)CC2	ZINC000853528324	FF	On-Demand	Mild	GPR119	26	47
CC(C)(C)OC(=O)N1CCC2(CC1)CCN(c1ccnc(O)c1[N+](=O)[O-])CC2	ZINC000853528326	GG	On-Demand	Bother	GPR119	39	43
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N1CCc2sccc2C1)c1ccccc1	ZINC000853528332	GI	On-Demand	Anodyne	DPP8	20	45
O=C1c2ccccc2C(=O)N1CN1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853528339	GD	On-Demand	Anodyne	ALDH1A1	41	45
O=C1c2ccccc2C(=O)N1CN1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853528339	GD	On-Demand	Anodyne	ALDH3A1	24	47
Cn1ncc2c(=O)n(CN3Cc4ccc(NC(=O)C(F)(F)F)cc4C3)nnc21	ZINC000853528377	GC	On-Demand	Anodyne	Q9M629_MAIZE	52	36
COc1ccccc1-c1nc(C2CCN(c3cc(F)ncn3)CC2)no1	ZINC000853528378	FG	On-Demand	Anodyne	DCK	44	42
COc1ccccc1-c1nc(C2CCN(c3cc(F)ncn3)CC2)no1	ZINC000853528378	FG	On-Demand	Anodyne	LUCI_PHOPE	32	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1	ZINC000853528618	GJ	On-Demand	Bother	COLA	105	41
O=C1[C@@H]2CN(Cn3c(=O)oc4ccccc43)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853528652	GD	On-Demand	Anodyne	MIF	17	43
O=C1[C@@H]2CN(Cn3c(=O)oc4ccccc43)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853528652	GD	On-Demand	Anodyne	SIGMAR1	15	47
C#Cc1cccnc1N1CCC2(CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000853528774	FH	On-Demand	Mild	GPR119	34	46
CC(C)(C)OC(=O)N1CCC2(CC1)CCN(c1ccc(N)c([N+](=O)[O-])n1)CC2	ZINC000853528797	GG	On-Demand	Bother	GPR119	20	42
CC(C)(C)OC(=O)N1CCC2(CC1)CCN(c1cc(CO)c(F)cn1)CC2	ZINC000853528885	GG	On-Demand	Anodyne	GPR119	43	45
CC(=O)c1ccnc(N2CCC3(CCN(C(=O)OC(C)(C)C)CC3)CC2)c1	ZINC000853528895	FH	On-Demand	Anodyne	GPR119	40	48
COC(=O)c1nn(CN2CCO[C@@](C)(C3CC3)C2)c2ccccc12	ZINC000853529024	EE	On-Demand	Anodyne	HTR4	38	41
COC(=O)c1nn(CN2CCO[C@](C)(C3CC3)C2)c2ccccc12	ZINC000853529025	EE	On-Demand	Anodyne	HTR4	38	41
Cn1ncc2c(=O)n(CN3CCO[C@](C)(C4CC4)C3)nnc21	ZINC000853529150	DB	On-Demand	Anodyne	Q9M629_MAIZE	51	34
Cn1ncc2c(=O)n(CN3CCO[C@@](C)(C4CC4)C3)nnc21	ZINC000853529151	DB	On-Demand	Anodyne	Q9M629_MAIZE	51	34
COc1ccc(-c2nccc(N(C)[C@H]3CCN(Cc4ccccc4)C3=O)n2)cc1	ZINC000853529216	GG	On-Demand	Anodyne	TRY2_BOVIN	17	44
COc1ccc(-c2nccc(N(C)[C@@H]3CCN(Cc4ccccc4)C3=O)n2)cc1	ZINC000853529217	GG	On-Demand	Anodyne	TRY2_BOVIN	17	44
Fc1ccc(OC2CCN(c3cnc(F)cn3)CC2)cn1	ZINC000853529611	CE	On-Demand	Anodyne	DCK	45	39
COc1ccc(-c2nccc(N3CCC(Oc4ccc(F)nc4)CC3)n2)cc1	ZINC000853529612	GH	On-Demand	Anodyne	DCK	52	45
C#Cc1cccnc1N1CCC(Oc2ccc(F)nc2)CC1	ZINC000853529620	CF	On-Demand	Mild	DCK	41	38
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853529626	FD	On-Demand	Anodyne	ALDH1A1	48	40
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853529626	FD	On-Demand	Anodyne	ALDH3A1	38	44
CCOC(=O)c1nccc(N(C)[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853529640	GF	On-Demand	Anodyne	AMY2	44	30
CCOC(=O)c1nccc(N(C)[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853529640	GF	On-Demand	Anodyne	GPR119	66	42
CCOC(=O)c1nccc(N(C)[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853529641	GF	On-Demand	Anodyne	AMY2	44	30
CCOC(=O)c1nccc(N(C)[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853529641	GF	On-Demand	Anodyne	GPR119	66	42
Cn1ncc2c(=O)n(CN3C[C@H]4C(=O)N(Cc5ccccc5)C(=O)[C@H]4C3)nnc21	ZINC000853529648	GB	On-Demand	Anodyne	Q9M629_MAIZE	53	35
N#Cc1cc2cccnc2nc1N1CCC(Oc2ccc(F)nc2)CC1	ZINC000853529652	EG	On-Demand	Mild	DCK	48	40
CC(=O)c1ccc(C(F)(F)F)nc1N1CCC(Oc2ccc(F)nc2)CC1	ZINC000853529655	GH	On-Demand	Anodyne	LIPG	34	41
CCOc1cc(N2CCC(Oc3ccc(F)nc3)CC2)c(F)cn1	ZINC000853529661	EG	On-Demand	Anodyne	DCK	49	39
CN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529664	GF	On-Demand	Bother	GPR119	36	43
CN(c1ccc([N+](=O)[O-])c(C(N)=O)c1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529665	GF	On-Demand	Bother	GPR119	36	43
COC(=O)c1nccc(N(C)[C@@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853529668	FE	On-Demand	Anodyne	GPR119	59	42
COC(=O)c1nccc(N(C)[C@H]2CCCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853529669	FE	On-Demand	Anodyne	GPR119	59	42
COc1cc(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)c(O)cc1C	ZINC000853529679	GE	On-Demand	Clean	TSHR	51	34
COc1cc(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)c(O)cc1C	ZINC000853529679	GE	On-Demand	Clean	SIGMAR1	15	41
O=C1[C@@H]2CN(Cn3cnc4cc(F)c(F)cc43)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853529689	GE	On-Demand	Anodyne	NR1I2	46	44
Nc1ccc(N2CCC(Oc3ccc(F)nc3)CC2)nc1[N+](=O)[O-]	ZINC000853529692	EE	On-Demand	Bother	DCK	49	38
N#Cc1cnnc(N2CCC(Oc3ccc(F)nc3)CC2)c1	ZINC000853529708	CD	On-Demand	Mild	DCK	54	42
C[C@@H]1CCN(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)C1=O	ZINC000853529711	EC	On-Demand	Anodyne	SIGMAR1	46	37
C[C@H]1CCN(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)C1=O	ZINC000853529712	EC	On-Demand	Anodyne	SIGMAR1	46	37
OCc1cc(N2CCC(Oc3ccc(F)nc3)CC2)ncc1F	ZINC000853529720	DE	On-Demand	Anodyne	DCK	54	42
Fc1ccc(OC2CCN(c3ccc(OCC(F)(F)F)nn3)CC2)cn1	ZINC000853529727	FF	On-Demand	Anodyne	SCD1	56	46
Cc1cc(CO)cc(N2CCC(Oc3ccc(F)nc3)CC2)n1	ZINC000853529731	DE	On-Demand	Anodyne	DCK	50	41
COC(=O)c1ccc(C(F)(F)F)nc1N1CCC(Oc2ccc(F)nc2)CC1	ZINC000853529732	GG	On-Demand	Anodyne	TRPV1	28	40
COC(=O)c1ccc(C(F)(F)F)nc1N1CCC(Oc2ccc(F)nc2)CC1	ZINC000853529732	GG	On-Demand	Anodyne	LIPG	28	40
COC(=O)c1nccc(N2CCC(Oc3ccc(F)nc3)CC2)n1	ZINC000853529734	ED	On-Demand	Anodyne	DCK	46	39
Nc1cccc2c(N3CCC(Oc4ccc(F)nc4)CC3)nccc12	ZINC000853529736	EG	On-Demand	Anodyne	DCK	49	36
CC[C@H](C)[C@H](C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1	ZINC000853529738	JF	On-Demand	Anodyne	CAPN2	23	41
CC[C@@H](C)[C@H](C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCOCC1)c1ccccc1	ZINC000853529739	JF	On-Demand	Anodyne	CAPN2	23	41
Fc1ccc(OC2CCN(c3nccnc3-c3ccccc3)CC2)cn1	ZINC000853529743	FH	On-Demand	Anodyne	DCK	43	35
Cc1ccn(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)c(=O)c1C#N	ZINC000853529760	GD	On-Demand	Mild	GRM2	15	40
CN1C(=O)C(=O)N(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)C1=O	ZINC000853529764	FB	On-Demand	Anodyne	ALDH3A1	16	40
CCOC(=O)c1nccc(N2CCC(Oc3ccc(F)nc3)CC2)n1	ZINC000853529766	EE	On-Demand	Anodyne	DCK	47	39
CCCc1ccc(N2CCC(Oc3ccc(F)nc3)CC2)nn1	ZINC000853529776	DG	On-Demand	Anodyne	SCD1	51	42
CCOC(=O)c1cnn(CN2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)c1	ZINC000853529806	GD	On-Demand	Anodyne	F2RL3	20	43
CC(=O)c1ccnc(N2CCC(Oc3ccc(F)nc3)CC2)c1	ZINC000853529831	DF	On-Demand	Anodyne	DCK	41	39
CC(=O)c1ccnc(N2CCC(Oc3ccc(F)nc3)CC2)c1	ZINC000853529831	DF	On-Demand	Anodyne	SCD1	40	39
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cc2c(O)ccc3ccc(OC)cc23)C1	ZINC000853529834	GH	On-Demand	Clean	MTNR1A	33	42
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cc2c(O)ccc3ccc(OC)cc23)C1	ZINC000853529834	GH	On-Demand	Clean	MTNR1B	22	42
Cc1cc(C(F)(F)F)cc(N2CCC(Oc3ccc(F)nc3)CC2)n1	ZINC000853529847	FH	On-Demand	Anodyne	DCK	51	42
Cc1cc(C(F)(F)F)cc(N2CCC(Oc3ccc(F)nc3)CC2)n1	ZINC000853529847	FH	On-Demand	Anodyne	SCD1	36	42
Cc1cc(C(F)(F)F)cc(N2CCC(Oc3ccc(F)nc3)CC2)n1	ZINC000853529847	FH	On-Demand	Anodyne	LIPG	29	41
O=C1CC2(CCCC2)CN1CN1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853529849	GD	On-Demand	Anodyne	ADRA1D	21	40
CN(c1cnc(F)cn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529853	DF	On-Demand	Anodyne	GPR119	55	43
CN(c1cnc(F)cn1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529854	DF	On-Demand	Anodyne	GPR119	55	43
CCOc1cc(N2CCC(Oc3ccc(F)nc3)CC2)nc(C)n1	ZINC000853529855	EF	On-Demand	Anodyne	DCK	54	46
Cn1ncnc1N1CCC(Oc2ccc(F)nc2)CC1	ZINC000853529856	CD	On-Demand	Anodyne	DCK	40	36
Fc1ccc(OC2CCN(c3cc(F)ncn3)CC2)cn1	ZINC000853529889	CE	On-Demand	Anodyne	DCK	64	48
Fc1ccc(OC2CCN(c3cc(F)ncn3)CC2)cn1	ZINC000853529889	CE	On-Demand	Anodyne	PDE3B	44	37
Fc1ccc(OC2CCN(c3ncnc(F)c3Br)CC2)cn1	ZINC000853529892	FF	On-Demand	Anodyne	DCK	51	42
Fc1ccc(OC2CCN(c3ncnc(F)c3Br)CC2)cn1	ZINC000853529892	FF	On-Demand	Anodyne	PDE3B	40	35
CN(c1ncnc2c1nnn2C)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529903	FD	On-Demand	Anodyne	GPR119	44	47
CN(c1ncnc2c1nnn2C)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529904	FD	On-Demand	Anodyne	GPR119	44	47
CN(c1nc(C#N)c(Cl)s1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529906	FH	On-Demand	Mild	GPR119	25	40
CN(c1nc(C#N)c(Cl)s1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529907	FH	On-Demand	Mild	GPR119	25	40
Cn1nnc2c(N3CCC(Oc4ccc(F)nc4)CC3)ncnc21	ZINC000853529909	ED	On-Demand	Anodyne	DCK	44	39
Cn1nnc2c(N3CCC(Oc4ccc(F)nc4)CC3)ncnc21	ZINC000853529909	ED	On-Demand	Anodyne	PDE3B	45	39
Cc1ccc(N2CCC(Oc3ccc(F)nc3)CC2)nn1	ZINC000853529916	CE	On-Demand	Anodyne	DCK	45	40
Cc1ccc(N2CCC(Oc3ccc(F)nc3)CC2)nn1	ZINC000853529916	CE	On-Demand	Anodyne	SCD1	64	49
CN(c1nc2ncccc2cc1C#N)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529936	GH	On-Demand	Mild	GPR119	42	44
CN(c1nc2ncccc2cc1C#N)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529937	GH	On-Demand	Mild	GPR119	42	44
Fc1ccc(OC2CCN(c3cc(Nc4ccccc4)ncn3)CC2)cn1	ZINC000853529954	FH	On-Demand	Anodyne	DCK	60	46
Fc1ccc(OC2CCN(c3cc(Nc4ccccc4)ncn3)CC2)cn1	ZINC000853529954	FH	On-Demand	Anodyne	PDE3B	40	34
Fc1ccc(OC2CCN(c3cc(Nc4ccccc4)ncn3)CC2)cn1	ZINC000853529954	FH	On-Demand	Anodyne	GALR2	47	33
O=C1CCCN1c1cnc(N2CCC(Oc3ccc(F)nc3)CC2)cn1	ZINC000853529956	FE	On-Demand	Anodyne	SCD1	19	42
CN(c1cnccn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529957	DF	On-Demand	Anodyne	GPR119	52	56
CN(c1cnccn1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853529958	DF	On-Demand	Anodyne	GPR119	52	56
O=C1[C@@H]2CN(Cn3sc4ccccc4c3=O)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853529962	GE	On-Demand	Anodyne	CASP3	21	40
O=C1[C@@H]2CN(Cn3sc4ccccc4c3=O)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853529962	GE	On-Demand	Anodyne	CASP7	28	40
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cn2sc3ccccc3c2=O)C1	ZINC000853529976	FF	On-Demand	Anodyne	CASP3	28	40
Nc1ccc2nc(N3CCC(Oc4ccc(F)nc4)CC3)sc2c1	ZINC000853529989	EG	On-Demand	Anodyne	DCK	47	36
Fc1ccc(OC2CCN(c3cc(Cl)c4ncccc4n3)CC2)cn1	ZINC000853529990	FH	On-Demand	Anodyne	DCK	50	40
CC[C@@H](C)[C@H](C(=O)OCC(=O)NCCc1cccc2cccnc12)c1ccccc1	ZINC000853530019	HI	On-Demand	Anodyne	MTNR1A	42	38
CC[C@H](C)[C@H](C(=O)OCC(=O)NCCc1cccc2cccnc12)c1ccccc1	ZINC000853530020	HI	On-Demand	Anodyne	MTNR1A	42	38
O=C1[C@@H]2CN(Cn3c(=O)oc4ccc(F)cc43)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853530033	GD	On-Demand	Anodyne	MIF	20	64
Fc1ccc2nc(C(F)F)nc(N3CCC(Oc4ccc(F)nc4)CC3)c2c1	ZINC000853530087	GI	On-Demand	Anodyne	PDE3B	41	36
C#CCCCOc1cccnc1N1CCC(Oc2ccc(F)nc2)CC1	ZINC000853530096	FG	On-Demand	Mild	DCK	41	35
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530177	IG	On-Demand	Anodyne	CA2	68	46
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530177	IG	On-Demand	Anodyne	CA1	48	46
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530177	IG	On-Demand	Anodyne	CA7	39	45
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530177	IG	On-Demand	Anodyne	CA4	52	46
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530177	IG	On-Demand	Anodyne	CA14	32	45
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530177	IG	On-Demand	Anodyne	ACE2	44	37
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530177	IG	On-Demand	Anodyne	CA12	29	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530178	IG	On-Demand	Anodyne	CA2	68	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530178	IG	On-Demand	Anodyne	CA1	48	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530178	IG	On-Demand	Anodyne	CA7	39	45
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530178	IG	On-Demand	Anodyne	CA4	52	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530178	IG	On-Demand	Anodyne	CA14	32	45
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530178	IG	On-Demand	Anodyne	ACE2	44	37
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530178	IG	On-Demand	Anodyne	CA12	29	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530179	IG	On-Demand	Anodyne	CA2	68	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530179	IG	On-Demand	Anodyne	CA1	48	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530179	IG	On-Demand	Anodyne	CA7	39	45
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530179	IG	On-Demand	Anodyne	CA4	52	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530179	IG	On-Demand	Anodyne	CA14	32	45
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530179	IG	On-Demand	Anodyne	ACE2	44	37
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1)c1ccccc1	ZINC000853530179	IG	On-Demand	Anodyne	CA12	29	40
Cn1ncc2c(=O)n(CN3C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C3)nnc21	ZINC000853530345	GB	On-Demand	Anodyne	Q9M629_MAIZE	54	36
CCOC(=O)c1nccc(Oc2ccc(NC(=O)OC(C)(C)C)cc2Cl)n1	ZINC000853530420	GI	On-Demand	Anodyne	AGPAT2	43	33
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)c1ccccc1	ZINC000853530454	HJ	On-Demand	Mild	VIPR1	30	51
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	ACE	19	44
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	SSTR2	57	34
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MME	28	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	EDNRB	25	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	EDNRA	39	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	TACR1	26	52
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MC4R	39	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	NQO2	15	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	CTSB	20	51
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	CCKAR	107	52
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	CTSL	29	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	BRS3	30	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	NMBR	42	52
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MC3R	66	36
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MC5R	69	38
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MTNR1A	24	43
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	GRPR	63	34
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	ECE1	58	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MMP11	84	37
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	CCKBR	93	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	GHSR	56	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MMP9	22	43
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	CAPN2	32	51
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	MC1R	83	37
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	NPR	38	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	KISS1R	74	34
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12)c1ccccc1	ZINC000853530482	HJ	On-Demand	Anodyne	ERAP2	40	38
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1ccccc1F)c1ccccc1	ZINC000853530568	FI	On-Demand	Anodyne	ACE2	45	34
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1ccccc1F)c1ccccc1	ZINC000853530568	FI	On-Demand	Anodyne	PDS	49	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccccc1S(C)(=O)=O)c1ccccc1	ZINC000853530588	HH	On-Demand	Anodyne	KCNQ2	43	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccccc1S(C)(=O)=O)c1ccccc1	ZINC000853530588	HH	On-Demand	Anodyne	ACE2	49	35
Cn1ncc2c(=O)n(CN3CCN(c4ccsc4C#N)CC3)nnc21	ZINC000853530705	FC	On-Demand	Mild	Q9M629_MAIZE	52	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc(N2CCCC2=O)c1)c1ccccc1	ZINC000853530789	HJ	On-Demand	Anodyne	KCNQ2	41	38
N#Cc1sccc1N1CCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)CC1	ZINC000853530890	GD	On-Demand	Mild	CHRNA7	15	47
N#Cc1sccc1N1CCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)CC1	ZINC000853530891	GD	On-Demand	Mild	CHRNA7	15	47
N#Cc1sccc1N1CCN(Cc2c(O)ccc3ccccc23)CC1	ZINC000853530936	EH	On-Demand	Mild	DRD4	15	45
N#Cc1sccc1N1CCN(CN2C(=O)CC3(CCCCC3)C2=O)CC1	ZINC000853530938	FE	On-Demand	Mild	ADRA1D	27	45
N#Cc1sccc1N1CCN(CN2C(=O)CC3(CCCCC3)C2=O)CC1	ZINC000853530938	FE	On-Demand	Mild	ADRA1B	15	45
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N1CCN(c2ccccc2O)CC1)c1ccccc1	ZINC000853530971	HH	On-Demand	Anodyne	MC4R	42	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N1CCN(c2ccccc2O)CC1)c1ccccc1	ZINC000853530971	HH	On-Demand	Anodyne	KCNQ2	48	38
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N1CCN(c2ccccc2O)CC1)c1ccccc1	ZINC000853530971	HH	On-Demand	Anodyne	NPY2R	44	36
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1	ZINC000853531021	HJ	On-Demand	Anodyne	KCNQ2	44	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccc(N2CCCC2=O)cc1)c1ccccc1	ZINC000853531021	HJ	On-Demand	Anodyne	NPY2R	22	43
N#Cc1sccc1N1CCN(CN2CC3(CCCC3)CC2=O)CC1	ZINC000853531047	EE	On-Demand	Mild	ADRA1D	30	48
N#Cc1sccc1N1CCN(CN2CC3(CCCC3)CC2=O)CC1	ZINC000853531047	EE	On-Demand	Mild	ADRA1B	15	48
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	CHRM2	23	44
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	CHRM1	26	44
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	ACE	43	39
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	DRD2	23	49
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	DRD4	48	49
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	ACHE	44	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	DRD3	15	49
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	SLC6A3	21	44
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	KCNH2	16	43
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	HTR4	20	46
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	CHRM3	32	44
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	LTA4H	22	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	SIGMAR1	52	53
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	SSTR5	62	38
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	CCR3	29	44
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	ACE2	44	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	MCHR1	48	48
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	GAG-PRO	57	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	XIAP	59	36
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	CACNA1G	40	43
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000853531072	IJ	On-Demand	Anodyne	CCR8	20	42
N#Cc1sccc1N1CCN(CN2C(=O)CC3(CCCC3)C2=O)CC1	ZINC000853531108	FE	On-Demand	Mild	ADRA1D	28	46
N#Cc1sccc1N1CCN(CN2C(=O)CC3(CCCC3)C2=O)CC1	ZINC000853531108	FE	On-Demand	Mild	ADRA1B	16	46
O=C1c2ccccc2C(=O)N1CN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1	ZINC000853531138	GD	On-Demand	Anodyne	ALDH3A1	17	41
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531139	EH	On-Demand	Anodyne	CAPN1	49	35
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531139	EH	On-Demand	Anodyne	CAPN2	83	40
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531139	EH	On-Demand	Anodyne	ACE2	51	36
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531139	EH	On-Demand	Anodyne	NPR	46	41
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531139	EH	On-Demand	Anodyne	PDS	48	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531140	EH	On-Demand	Anodyne	CAPN1	49	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531140	EH	On-Demand	Anodyne	CAPN2	83	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531140	EH	On-Demand	Anodyne	ACE2	51	36
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531140	EH	On-Demand	Anodyne	NPR	46	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCCC(C)C)c1ccccc1	ZINC000853531140	EH	On-Demand	Anodyne	PDS	48	35
CCn1cc([C@@H]2CN(c3nccc4cc(OC)c(OC)cc34)CCO2)cn1	ZINC000853531156	FG	On-Demand	Anodyne	PDE3A	42	35
CCn1cc([C@@H]2CN(c3nccc4cc(OC)c(OC)cc34)CCO2)cn1	ZINC000853531156	FG	On-Demand	Anodyne	PDE3B	45	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NC(C)(C)CC)c1ccccc1	ZINC000853531164	EI	On-Demand	Anodyne	ACE2	45	36
CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)NC(C)(C)CC)c1ccccc1	ZINC000853531167	EI	On-Demand	Anodyne	ACE2	45	36
O=C1C(=O)N(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c2ccccc21	ZINC000853531173	GD	On-Demand	Anodyne	ALDH1A1	61	49
O=C1C(=O)N(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c2ccccc21	ZINC000853531173	GD	On-Demand	Anodyne	ALDH3A1	43	58
O=C1C(=O)N(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c2ccccc21	ZINC000853531173	GD	On-Demand	Anodyne	CES1	15	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc(C(=O)NC)c1)c1ccccc1	ZINC000853531186	GH	On-Demand	Anodyne	KCNK3	109	38
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc(C(=O)NC)c1)c1ccccc1	ZINC000853531186	GH	On-Demand	Anodyne	KCNK9	73	38
O=c1oc2ccccc2n1CN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1	ZINC000853531194	FE	On-Demand	Anodyne	SIGMAR1	15	45
N#Cc1sccc1N1CCN(CN2C(=O)CC23CCC3)CC1	ZINC000853531251	DD	On-Demand	Mild	ADRA1D	22	40
COc1cccc([C@H]2CC(=O)N(CN3CCN(c4ccsc4C#N)CC3)C2)c1	ZINC000853531276	GF	On-Demand	Mild	DRD4	42	33
COc1ccccc1-c1csc(C2CCN(c3cc(F)ncn3)CC2)n1	ZINC000853531356	FI	On-Demand	Anodyne	DCK	46	44
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cn2nc(-c3ccccc3)oc2=O)C1	ZINC000853531463	GE	On-Demand	Anodyne	PDE8B	56	38
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N1CCN(C(C)=O)CC1)c1ccccc1	ZINC000853531495	FE	On-Demand	Anodyne	DPP7	40	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)N1CCN(C(C)=O)CC1)c1ccccc1	ZINC000853531495	FE	On-Demand	Anodyne	DPP8	15	45
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cn2nnc3c(cnn3C)c2=O)C1	ZINC000853531522	FC	On-Demand	Anodyne	Q9M629_MAIZE	53	34
COc1cc(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c(O)cc1C	ZINC000853531537	FF	On-Demand	Clean	DRD4	24	42
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000853531578	GF	On-Demand	Anodyne	TSPO	15	43
Cn1c(=O)n(CN2CCN(c3ccsc3C#N)CC2)c2ccccc21	ZINC000853531581	FE	On-Demand	Mild	HTR1A	22	41
N#Cc1sccc1N1CCN(CN2C(=O)c3ccccc3C2=O)CC1	ZINC000853531590	FD	On-Demand	Mild	HTR1A	15	41
N#Cc1sccc1N1CCN(CN2C(=O)CC3(CCC3)C2=O)CC1	ZINC000853531598	ED	On-Demand	Mild	ADRA1D	23	44
C=CCc1cc(CN2CCN(c3ccsc3C#N)CC2)c(O)c(OC)c1	ZINC000853531672	FG	On-Demand	Mild	DRD2	16	42
COc1cc(CN2CCN(c3ccsc3C#N)CC2)c(O)cc1C	ZINC000853531673	EF	On-Demand	Mild	DRD2	17	44
COc1cc(CN2CCN(c3ccsc3C#N)CC2)c(O)cc1C	ZINC000853531673	EF	On-Demand	Mild	HTR7	15	40
N#Cc1sccc1N1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853531674	FD	On-Demand	Mild	ALDH1A1	57	41
N#Cc1sccc1N1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853531674	FD	On-Demand	Mild	ALDH3A1	43	60
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	MME	18	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	CTSB	28	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	MTNR1A	47	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	MTNR1B	48	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	ROCK2	33	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	CAPN1	28	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	CAPN2	60	41
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	ACE2	41	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	BACE1	20	40
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	AMP1_PLAFQ	42	44
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	CARM1	43	38
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)NCc1cccc(OC)c1)c1ccccc1	ZINC000853531736	GI	On-Demand	Anodyne	PDS	100	52
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	ACE	23	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	MME	40	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	CTSB	39	41
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	CAPNS1	51	31
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	CAPN1	58	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	CAPN2	90	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	ACE2	67	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@H](C)CC	ZINC000853531825	DH	On-Demand	Anodyne	NPR	42	33
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	ACE	23	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	MME	40	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	CTSB	39	41
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	CAPNS1	51	31
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	CAPN1	58	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	CAPN2	90	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	ACE2	67	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@H](c1ccccc1)[C@@H](C)CC	ZINC000853531827	DH	On-Demand	Anodyne	NPR	42	33
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	ACE	23	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	MME	40	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	CTSB	39	41
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	CAPNS1	51	31
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	CAPN1	58	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	CAPN2	90	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	ACE2	67	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@@H](C)CC	ZINC000853531829	DH	On-Demand	Anodyne	NPR	42	33
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	ACE	23	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	MME	40	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	CTSB	39	41
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	CAPNS1	51	31
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	CAPN1	58	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	CAPN2	90	39
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	ACE2	67	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)[C@@H](c1ccccc1)[C@H](C)CC	ZINC000853531832	DH	On-Demand	Anodyne	NPR	42	33
N#Cc1sccc1N1CCN(CN2C(=O)CC23CCCC3)CC1	ZINC000853531866	EE	On-Demand	Mild	ADRA1D	25	43
CCn1cc([C@@H]2CN(c3nc4ccc(S(N)(=O)=O)cc4[nH]3)CCO2)cn1	ZINC000853531911	GD	On-Demand	Anodyne	NPY5R	15	56
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cn2c(=O)oc3ccc(C)cc32)C1	ZINC000853531935	FF	On-Demand	Anodyne	MIF	17	42
C=CCN(CCOC)c1cc(Cl)nc2cc(C)nn12	ZINC000853531975	CE	On-Demand	Mild	CRHR1	15	42
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cc(NC(C)=O)ccc1OC)c1ccccc1	ZINC000853532031	II	On-Demand	Anodyne	TSHR	46	30
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000853532087	GI	On-Demand	Anodyne	ACE2	40	35
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000853532087	GI	On-Demand	Anodyne	KCNK3	75	34
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000853532087	GI	On-Demand	Anodyne	KCNK9	58	34
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1)c1ccccc1	ZINC000853532087	GI	On-Demand	Anodyne	PDS	57	38
O=c1oc2ccc(F)cc2n1CN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1	ZINC000853532095	GE	On-Demand	Anodyne	MIF	15	57
CC[C@H](C)[C@H](C(=O)O[C@H](C)C(=O)Nc1ccc(OC)cc1OC)c1ccccc1	ZINC000853532127	GI	On-Demand	Anodyne	SOAT1	38	43
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(CN2Cc3ccc(OC)cc3C2=O)C1	ZINC000853532131	GE	On-Demand	Anodyne	ADAM17	37	41
O=C1c2cccc3cccc(c23)N1CN1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1	ZINC000853532159	GG	On-Demand	Anodyne	ALDH3A1	17	42
COC(=O)c1c([N+](=O)[O-])ccc(NCC2(C)OCCCO2)c1Cl	ZINC000853532241	EF	On-Demand	Bother	NMBR	58	30
C=CCN(Cn1nnc(-c2ccc(OC)c(OC)c2)n1)[C@H](C)COC	ZINC000853532272	ED	On-Demand	Mild	SCARB1	17	40
C=CCN(Cn1nnc(-c2ccc(OC)c(OC)c2)n1)[C@@H](C)COC	ZINC000853532273	ED	On-Demand	Mild	SCARB1	17	40
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(Cn2cc(-c3ccccc3)cn2)C1	ZINC000853532324	FG	On-Demand	Anodyne	PDE8B	49	34
CCn1cc([C@@H]2CN(c3ncnc4ccc(C(C)C)cc34)CCO2)cn1	ZINC000853532328	FH	On-Demand	Anodyne	PDE3B	42	37
Cn1ncc2c(=O)n(CN3C[C@@H]4OCCN(Cc5ccccc5)[C@@H]4C3)nnc21	ZINC000853532366	GC	On-Demand	Anodyne	Q9M629_MAIZE	42	32
O=C1C(=O)N(CN2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c2c(F)cccc21	ZINC000853532395	GD	On-Demand	Anodyne	ALDH3A1	22	41
Cn1ncc2c(=O)n(CN3CCc4ccccc4C(C)(C)C3)nnc21	ZINC000853532448	ED	On-Demand	Anodyne	Q9M629_MAIZE	47	33
CC1(CNc2ncnc3c2ncn3-c2ccccc2)OCCCO1	ZINC000853532563	EE	On-Demand	Anodyne	ADORA3	54	39
C=CCN(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853532828	ED	On-Demand	Mild	GALR1	48	37
C=CCN(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853532828	ED	On-Demand	Mild	GHRL	48	34
C=CCN(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853532829	ED	On-Demand	Mild	GALR1	48	37
C=CCN(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853532829	ED	On-Demand	Mild	GHRL	48	34
C=CCN(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853532830	ED	On-Demand	Mild	GALR1	48	37
C=CCN(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853532830	ED	On-Demand	Mild	GHRL	48	34
C=CCN(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853532831	ED	On-Demand	Mild	GALR1	48	37
C=CCN(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853532831	ED	On-Demand	Mild	GHRL	48	34
C=CCN(Cn1c(=O)oc2ccc(C)cc21)[C@H](C)COC	ZINC000853532856	CE	On-Demand	Mild	MIF	16	44
C=CCN(Cn1c(=O)oc2ccc(C)cc21)[C@@H](C)COC	ZINC000853532857	CE	On-Demand	Mild	MIF	16	44
CC(C)c1ccc2ncnc(NCC3(C)OCCCO3)c2c1	ZINC000853532862	DG	On-Demand	Anodyne	CLK4	64	39
CC(=O)c1ccnc(N[C@@H]2CCOc3c2ccc(Cl)c3Cl)c1	ZINC000853532970	EJ	On-Demand	Anodyne	TYK2	56	40
CC(=O)c1ccnc(N[C@H]2CCOc3c2ccc(Cl)c3Cl)c1	ZINC000853532971	EJ	On-Demand	Anodyne	TYK2	56	40
C=CCN(CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21)[C@H](C)COC	ZINC000853533212	FF	On-Demand	Mild	CHRM5	15	42
C=CCN(CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21)[C@@H](C)COC	ZINC000853533213	FF	On-Demand	Mild	CHRM5	15	42
C=CCN(CN1C(=O)C(=O)c2ccccc21)[C@H](C)COC	ZINC000853533236	CD	On-Demand	Mild	ALDH1A1	51	42
C=CCN(CN1C(=O)C(=O)c2ccccc21)[C@H](C)COC	ZINC000853533236	CD	On-Demand	Mild	ALDH3A1	38	42
C=CCN(CN1C(=O)C(=O)c2ccccc21)[C@H](C)COC	ZINC000853533236	CD	On-Demand	Mild	CES1	17	42
C=CCN(CN1C(=O)C(=O)c2ccccc21)[C@@H](C)COC	ZINC000853533237	CD	On-Demand	Mild	ALDH1A1	51	42
C=CCN(CN1C(=O)C(=O)c2ccccc21)[C@@H](C)COC	ZINC000853533237	CD	On-Demand	Mild	ALDH3A1	38	42
C=CCN(CN1C(=O)C(=O)c2ccccc21)[C@@H](C)COC	ZINC000853533237	CD	On-Demand	Mild	CES1	17	42
Cn1cnn(CN2CCc3ccc(Cl)c(Cl)c3C2)c1=O	ZINC000853533276	DD	On-Demand	Anodyne	PNMT	17	58
Fc1cnc(NC[C@H]2CN(Cc3ccccc3)CCCO2)cn1	ZINC000853533286	DE	On-Demand	Anodyne	DRD4	20	45
Fc1cnc(NC[C@@H]2CN(Cc3ccccc3)CCCO2)cn1	ZINC000853533287	DE	On-Demand	Anodyne	DRD4	20	45
Sc1nccn1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533291	DG	On-Demand	Anodyne	PNMT	17	58
COc1ccc(-c2nnn(CN3CCc4ccc(C)cc4C3)n2)cc1OC	ZINC000853533305	FF	On-Demand	Anodyne	ABCB1B	62	36
COc1ccc(-c2nnn(CN3CCc4ccc(C)cc4C3)n2)cc1OC	ZINC000853533305	FF	On-Demand	Anodyne	ABCB1	23	42
O=C1C[C@H](O)CN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533343	DD	On-Demand	Anodyne	PNMT	16	54
O=C1C[C@@H](O)CN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533344	DD	On-Demand	Anodyne	PNMT	16	54
O=C1N(CN2CCc3ccc(Cl)c(Cl)c3C2)CCC12CCOCC2	ZINC000853533345	FG	On-Demand	Anodyne	PNMT	15	51
C[C@H]1CCN(CN2CCc3ccc(Cl)c(Cl)c3C2)C1=O	ZINC000853533355	DG	On-Demand	Anodyne	PNMT	16	56
C[C@@H]1CCN(CN2CCc3ccc(Cl)c(Cl)c3C2)C1=O	ZINC000853533356	DG	On-Demand	Anodyne	PNMT	16	56
O=C1CCCN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533367	CF	On-Demand	Anodyne	PNMT	18	61
COc1ccccc1-c1nn(CN2CCc3ccc(C)cc3C2)c(=S)n1C	ZINC000853533401	GH	On-Demand	Anodyne	ABCB1B	48	35
O=c1sccn1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533420	DG	On-Demand	Anodyne	PNMT	17	57
O=C1[C@H]2C=C[C@@H](C2)N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533424	DG	On-Demand	Anodyne	PNMT	15	53
CC(C)c1ccc2c(c1)CN(Cn1ncc3ccccc3c1=O)CC2	ZINC000853533426	EH	On-Demand	Anodyne	ABCB1B	28	42
CC(C)c1ccc2c(c1)CN(CN1C[C@@]3(CN4CCC3CC4)OC1=O)CC2	ZINC000853533427	FG	On-Demand	Anodyne	CHRNA7	18	49
CC(C)c1ccc2c(c1)CN(CN1C[C@]3(CN4CCC3CC4)OC1=O)CC2	ZINC000853533428	FG	On-Demand	Anodyne	CHRNA7	18	49
O=C1c2nccnc2C(=O)N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533457	FE	On-Demand	Anodyne	PNMT	17	58
S=c1n(C2CC2)cnn1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533459	FI	On-Demand	Anodyne	PNMT	15	52
S=C1SCCN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533485	EH	On-Demand	Anodyne	PNMT	17	58
C#CCCCOc1cccnc1NCCCN1CCCO[C@@H](C)C1	ZINC000853533546	EF	On-Demand	Mild	HNMT	64	35
C#CCCCOc1cccnc1NCCCN1CCCO[C@H](C)C1	ZINC000853533547	EF	On-Demand	Mild	HNMT	64	35
C#Cc1cccnc1NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000853533606	DF	On-Demand	Mild	DRD4	16	45
C#Cc1cccnc1NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000853533606	DF	On-Demand	Mild	TNK2	43	39
C#Cc1cccnc1NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000853533607	DF	On-Demand	Mild	DRD4	16	45
C#Cc1cccnc1NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000853533607	DF	On-Demand	Mild	TNK2	43	39
O=C1[C@H]2CC[C@@H](C2)N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533611	EG	On-Demand	Anodyne	PNMT	15	53
S=c1ncccn1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533621	EH	On-Demand	Anodyne	PNMT	16	54
S=C1OCCN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853533639	DF	On-Demand	Anodyne	PNMT	17	58
COC(=O)c1cn(CN2CCc3ccc(C)cc3C2)nn1	ZINC000853533648	CD	On-Demand	Anodyne	NOD2	40	36
N#Cc1cccn(CN2CCc3ccc(Cl)c(Cl)c3C2)c1=O	ZINC000853533654	EG	On-Demand	Mild	PNMT	16	52
C=CCN(CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@H](C)COC	ZINC000853533797	EE	On-Demand	Mild	SLC27A4	44	33
C=CCN(CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@H](C)COC	ZINC000853533799	EE	On-Demand	Mild	SLC27A4	44	33
C=CCN(CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H](C)COC	ZINC000853533801	EE	On-Demand	Mild	SLC27A4	44	33
C=CCN(CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O)[C@@H](C)COC	ZINC000853533803	EE	On-Demand	Mild	SLC27A4	44	33
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1CCC(C2CCC2)CC1	ZINC000853533823	EF	On-Demand	Anodyne	GHRL	45	34
O=C1C(=O)N(CN2CCC(C3CCC3)CC2)C(=O)N1Cc1ccccc1	ZINC000853533837	FE	On-Demand	Anodyne	ACHE	28	46
O=C1C(=O)N(CN2CCC(C3CCC3)CC2)C(=O)N1Cc1ccccc1	ZINC000853533837	FE	On-Demand	Anodyne	SIGMAR1	51	47
O=C1C(=O)N(CN2CCC(C3CCC3)CC2)C(=O)N1Cc1ccccc1	ZINC000853533837	FE	On-Demand	Anodyne	CTSG	15	47
C#CCCCOc1cccnc1N(C)CCCNC(=O)C1CCC1	ZINC000853533838	EF	On-Demand	Mild	TBK1	61	34
C[C@@H](CNC(=O)OC(C)(C)C)Nc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853533940	FD	On-Demand	Anodyne	CA2	26	47
C[C@@H](CNC(=O)OC(C)(C)C)Nc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853533940	FD	On-Demand	Anodyne	CA1	19	47
C[C@@H](CNC(=O)OC(C)(C)C)Nc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853533940	FD	On-Demand	Anodyne	CA12	16	47
COc1ccc(-c2nn(CN3CCc4ccc(C)cc4C3)c(=S)n2C)cc1	ZINC000853533982	GH	On-Demand	Anodyne	ABCB1B	44	35
COc1ccc(-c2nn(CN3CCc4ccc(C)cc4C3)c(=S)n2C)cc1	ZINC000853533982	GH	On-Demand	Anodyne	ABCB1	17	43
C[C@H]1CC(=O)N(CN2CCc3ccc(Cl)c(Cl)c3C2)C1	ZINC000853533983	DG	On-Demand	Anodyne	PNMT	16	56
C[C@@H]1CC(=O)N(CN2CCc3ccc(Cl)c(Cl)c3C2)C1	ZINC000853533984	DG	On-Demand	Anodyne	PNMT	16	56
CCn1c(C)nn(CN2CCc3ccc(Cl)c(Cl)c3C2)c1=S	ZINC000853533992	FI	On-Demand	Anodyne	PNMT	16	52
CCOC(=O)c1nccc(N2CCN(c3nc(F)c(F)cc3F)CC2)n1	ZINC000853534029	FD	On-Demand	Anodyne	SORD	81	39
O=[N+]([O-])c1ccnn1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534057	EG	On-Demand	Bother	PNMT	15	53
CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](O)C(=O)NC	ZINC000853534061	FB	On-Demand	Bother	TBXA2R	23	41
CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](O)C(=O)NC	ZINC000853534064	FB	On-Demand	Bother	TBXA2R	23	41
COC(=O)c1ccc(=O)n(CN2CCc3ccc(C)cc3C2)n1	ZINC000853534081	DD	On-Demand	Anodyne	ABCB1B	50	33
COC(=O)c1ncn(CN2CCc3ccc(C)cc3C2)n1	ZINC000853534087	CD	On-Demand	Anodyne	ABCB1B	51	34
CC(C)c1ccc2c(c1)CN(Cn1nc(-c3ccccc3)ccc1=O)CC2	ZINC000853534098	FI	On-Demand	Anodyne	ABCB1B	17	41
O=C1SCCN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534152	DG	On-Demand	Anodyne	PNMT	17	58
O=[N+]([O-])c1cnn(CN2CCc3ccc(Cl)c(Cl)c3C2)c1	ZINC000853534178	EG	On-Demand	Bother	PNMT	15	51
CN1C(=O)C(=O)N(CN2CCc3ccc(Cl)c(Cl)c3C2)C1=O	ZINC000853534244	ED	On-Demand	Anodyne	PNMT	18	63
O=C1[C@H]2[C@H](C(=O)N1CN1CCc3ccc(Cl)c(Cl)c3C1)[C@H]1C=C[C@H]2O1	ZINC000853534245	GE	On-Demand	Anodyne	PNMT	16	54
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534249	GE	On-Demand	Anodyne	PNMT	16	54
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534251	GE	On-Demand	Anodyne	PNMT	16	54
COc1cc2c(cc1OC)N(CN1CCc3ccc(C)cc3C1)C(=O)C2=O	ZINC000853534265	FF	On-Demand	Anodyne	ABCB1B	61	36
CNC(=O)[C@@H](O)CNc1c(Br)cccc1[N+](=O)[O-]	ZINC000853534296	DC	On-Demand	Bother	COLA	115	36
CNC(=O)[C@@H](O)CNc1ccc(C(C)=O)cc1I	ZINC000853534298	FD	On-Demand	Anodyne	AKR1C3	15	40
CNC(=O)[C@@H](O)CNc1nc(C(F)(F)F)ccc1C(C)=O	ZINC000853534369	DC	On-Demand	Anodyne	TRPV1	48	33
O=c1c(Cl)c(Cl)cnn1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534461	GH	On-Demand	Anodyne	PNMT	17	58
O=C1C(=O)N(CN2CCC(C3CCC3)CC2)c2ccccc21	ZINC000853534468	CF	On-Demand	Anodyne	ALDH1A1	64	47
O=C1C(=O)N(CN2CCC(C3CCC3)CC2)c2ccccc21	ZINC000853534468	CF	On-Demand	Anodyne	ALDH3A1	48	61
O=C1C(=O)N(CN2CCC(C3CCC3)CC2)c2ccccc21	ZINC000853534468	CF	On-Demand	Anodyne	CES1	18	48
O=C1C(=O)N(CN2CCC(C3CCC3)CC2)c2ccccc21	ZINC000853534468	CF	On-Demand	Anodyne	CASP7	46	34
C/C(=C/c1ccccc1)CN(C)c1ccc(C(=O)C2CC2)cc1S(N)(=O)=O	ZINC000853534490	GG	On-Demand	Anodyne	ACKR3	42	35
O=C1c2ncccc2CN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534492	EG	On-Demand	Anodyne	PNMT	15	52
CC(C)c1ccc2c(c1)CN(Cn1nnc3c(cnn3C)c1=O)CC2	ZINC000853534507	ED	On-Demand	Anodyne	Q9M629_MAIZE	52	34
O=c1n(CN2CCc3ccc(Cl)c(Cl)c3C2)nnn1C1CC1	ZINC000853534516	EE	On-Demand	Anodyne	PNMT	15	52
Cn1ncc2c(=O)n(CN3CCc4ccc(Cl)c(Cl)c4C3)nnc21	ZINC000853534562	FD	On-Demand	Anodyne	Q9M629_MAIZE	57	38
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534570	GG	On-Demand	Anodyne	CHRNA7	17	48
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534571	GG	On-Demand	Anodyne	CHRNA7	17	48
CCOC(=O)c1cnn(CN2CCc3ccc(C)cc3C2)c1	ZINC000853534597	CE	On-Demand	Anodyne	NOD1	15	43
CCOC(=O)c1cnn(CN2CCc3ccc(C)cc3C2)c1	ZINC000853534597	CE	On-Demand	Anodyne	NOD2	40	43
CNC(=O)[C@@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853534604	FC	On-Demand	Anodyne	PDPK1	17	45
CNC(=O)[C@@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853534604	FC	On-Demand	Anodyne	SYK	26	46
C[C@@H](CNC(=O)OC(C)(C)C)Nc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000853534612	FD	On-Demand	Bother	COLA	31	41
C#Cc1cccnc1NCCCN1CCCO[C@@H](C)C1	ZINC000853534686	CD	On-Demand	Mild	HNMT	70	38
C#Cc1cccnc1NCCCN1CCCO[C@H](C)C1	ZINC000853534687	CD	On-Demand	Mild	HNMT	70	38
CC(=O)c1ccnc(N2CCN(c3nc(F)c(F)cc3F)CC2)c1	ZINC000853534769	EE	On-Demand	Anodyne	SORD	44	36
O=C1CC2(CCC2)N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534876	EG	On-Demand	Anodyne	PNMT	16	54
O=c1ccc(C(F)(F)F)nn1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534881	GH	On-Demand	Anodyne	PNMT	15	51
Cn1cnn(CN2CCc3ccc(Cl)c(Cl)c3C2)c1=S	ZINC000853534886	EG	On-Demand	Anodyne	PNMT	17	58
O=c1scc(C(F)(F)F)n1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534895	GI	On-Demand	Anodyne	PNMT	15	52
O=C1C[C@H](C(F)F)CN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534899	EG	On-Demand	Anodyne	PNMT	15	51
O=C1C[C@@H](C(F)F)CN1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534900	EG	On-Demand	Anodyne	PNMT	15	51
COC[C@@]1(C)CC(=O)N(CN2CCc3ccc(Cl)c(Cl)c3C2)C1	ZINC000853534909	FG	On-Demand	Anodyne	PNMT	15	49
COC[C@]1(C)CC(=O)N(CN2CCc3ccc(Cl)c(Cl)c3C2)C1	ZINC000853534910	FG	On-Demand	Anodyne	PNMT	15	49
COC[C@]1(C)NC(=O)N(CN2CCc3ccc(Cl)c(Cl)c3C2)C1=O	ZINC000853534913	FE	On-Demand	Anodyne	PNMT	15	49
O=C1[C@@H]2CCC[C@@H]2N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534926	EG	On-Demand	Anodyne	PNMT	16	54
O=c1cc2c(nn1CN1CCc3ccc(Cl)c(Cl)c3C1)CCCC2	ZINC000853534968	FG	On-Demand	Anodyne	PNMT	16	53
O=C1NC2(CCOCC2)C(=O)N1CN1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853534972	GE	On-Demand	Anodyne	PNMT	15	51
NC(=O)c1cc(N2CCN(c3nc(F)c(F)cc3F)CC2)ccc1[N+](=O)[O-]	ZINC000853534993	GD	On-Demand	Bother	STAT6	46	31
CNC(=O)[C@@H](O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535046	DA	On-Demand	Anodyne	CA2	46	38
CNC(=O)[C@@H](O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535046	DA	On-Demand	Anodyne	CA1	43	37
CNC(=O)[C@@H](O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535046	DA	On-Demand	Anodyne	NCE103	52	33
CNC(=O)[C@@H](O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535046	DA	On-Demand	Anodyne	MTCA1	52	31
CNC(=O)[C@@H](O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535046	DA	On-Demand	Anodyne	P96878_MYCTU	59	31
C=CCN(Cn1nnc2c(cnn2C)c1=O)[C@@H](C)COC	ZINC000853535127	CC	On-Demand	Mild	Q9M629_MAIZE	67	39
C=CCN(Cn1nnc2c(cnn2C)c1=O)[C@H](C)COC	ZINC000853535129	CC	On-Demand	Mild	Q9M629_MAIZE	67	39
C=CCN(CN1Cc2ccc(OC)cc2C1=O)[C@H](C)COC	ZINC000853535179	DE	On-Demand	Mild	ADAM17	37	42
C=CCN(CN1Cc2ccc(OC)cc2C1=O)[C@@H](C)COC	ZINC000853535180	DE	On-Demand	Mild	ADAM17	37	42
C[C@@H](CNC(=O)OC(C)(C)C)Nc1ncnc2c1ncn2-c1ccccc1	ZINC000853535190	FG	On-Demand	Anodyne	ADORA1	18	43
C[C@@H](CNC(=O)OC(C)(C)C)Nc1ncnc2c1ncn2-c1ccccc1	ZINC000853535190	FG	On-Demand	Anodyne	ADORA3	34	41
C[C@@H](CNC(=O)OC(C)(C)C)Nc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535211	FD	On-Demand	Anodyne	CA2	24	44
C[C@@H](CNC(=O)OC(C)(C)C)Nc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535211	FD	On-Demand	Anodyne	CA1	20	44
C[C@@H](CNC(=O)OC(C)(C)C)Nc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853535211	FD	On-Demand	Anodyne	NCE103	41	31
C=CCN(CN1C[C@]2(CN3CCC2CC3)OC1=O)[C@H](C)COC	ZINC000853535212	DD	On-Demand	Mild	CHRNA7	15	54
C=CCN(CN1C[C@@]2(CN3CCC2CC3)OC1=O)[C@H](C)COC	ZINC000853535213	DD	On-Demand	Mild	CHRNA7	15	54
C=CCN(CN1C[C@@]2(CN3CCC2CC3)OC1=O)[C@@H](C)COC	ZINC000853535214	DD	On-Demand	Mild	CHRNA7	15	54
C=CCN(CN1C[C@]2(CN3CCC2CC3)OC1=O)[C@@H](C)COC	ZINC000853535215	DD	On-Demand	Mild	CHRNA7	15	54
CC(=O)N(C[C@H]1CCCN1c1cc(F)ncn1)C1CC1	ZINC000853535247	CD	On-Demand	Anodyne	ACKR3	50	32
CC(=O)N(C[C@@H]1CCCN1c1cc(F)ncn1)C1CC1	ZINC000853535249	CD	On-Demand	Anodyne	ACKR3	50	32
C=CCN(Cn1nc(C)c2cc([N+](=O)[O-])ccc21)[C@H](C)COC	ZINC000853535255	DF	On-Demand	Mild	F2RL3	44	34
C=CCN(Cn1nc(C)c2cc([N+](=O)[O-])ccc21)[C@@H](C)COC	ZINC000853535257	DF	On-Demand	Mild	F2RL3	44	34
CNC(=O)[C@@H](O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853535272	DA	On-Demand	Anodyne	CA2	47	37
CNC(=O)[C@@H](O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853535272	DA	On-Demand	Anodyne	CA1	40	37
CNC(=O)[C@@H](O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853535272	DA	On-Demand	Anodyne	CA5B	45	31
CNC(=O)[C@@H](O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853535272	DA	On-Demand	Anodyne	CA4	40	36
CNC(=O)[C@@H](O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853535272	DA	On-Demand	Anodyne	CA5A	51	31
CNC(=O)[C@@H](O)CNc1nccc2cc(OC)c(OC)cc12	ZINC000853535297	DC	On-Demand	Anodyne	KDR	54	35
CNC(=O)[C@@H](O)CNc1nccc2cc(OC)c(OC)cc12	ZINC000853535297	DC	On-Demand	Anodyne	PDGFRA	51	37
C#CCCCOc1cccnc1NC1CCN(c2cccnn2)CC1	ZINC000853535315	EF	On-Demand	Mild	EHMT2	77	36
COC(=O)c1nccc(N2CCN(c3nc(F)c(F)cc3F)CC2)n1	ZINC000853535331	FD	On-Demand	Anodyne	SORD	80	38
CNC(=O)c1nn(CN2CCC(C3CCC3)CC2)c(=O)c2ccccc12	ZINC000853535360	FE	On-Demand	Anodyne	HRH1	41	42
CNC(=O)[C@@H](O)CNc1nc(C(F)(F)F)ccc1C(=O)OC	ZINC000853535411	DC	On-Demand	Anodyne	TRPV1	42	32
C#Cc1cccnc1N(C)CCCNC(=O)C1CCC1	ZINC000853535526	CD	On-Demand	Mild	TBK1	80	37
CNC(=O)[C@@H](O)CNc1nc2ccc(N)cc2s1	ZINC000853535589	CC	On-Demand	Anodyne	CSNK1D	41	38
CNC(=O)[C@@H](O)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853535662	CD	On-Demand	Anodyne	EGFR	46	35
CNC(=O)[C@@H](O)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853535662	CD	On-Demand	Anodyne	CLK4	51	35
CNC(=O)[C@@H](O)CNc1ccc(C(F)F)cc1[N+](=O)[O-]	ZINC000853535673	CD	On-Demand	Bother	COLA	59	33
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CCC(C3CCC3)CC2)C1	ZINC000853535724	FF	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CCC(C3CCC3)CC2)C1	ZINC000853535725	FF	On-Demand	Anodyne	CACNA1I	43	33
Cc1onc2c(=O)n(CN3CCC(C4CCC4)CC3)nc(-c3ccccc3)c12	ZINC000853535739	GH	On-Demand	Anodyne	GRM7	51	33
O=C1N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)CCC12CCOCC2	ZINC000853535740	GG	On-Demand	Anodyne	BCL2A1	48	40
O=C1C[C@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535741	GF	On-Demand	Anodyne	ADRA1D	21	54
O=C1C[C@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535741	GF	On-Demand	Anodyne	BCL2A1	40	37
O=C1C[C@@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535742	GF	On-Demand	Anodyne	ADRA1D	21	54
O=C1C[C@@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535742	GF	On-Demand	Anodyne	BCL2A1	40	37
C=CC[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853535769	CE	On-Demand	Mild	ALDH1A1	50	40
C=CC[C@@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853535769	CE	On-Demand	Mild	ALDH3A1	41	49
C=CC[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853535770	CE	On-Demand	Mild	ALDH1A1	50	40
C=CC[C@H]1CCCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853535770	CE	On-Demand	Mild	ALDH3A1	41	49
Cn1cnn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=O	ZINC000853535777	ED	On-Demand	Anodyne	HTR1A	24	49
Cn1cnn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=O	ZINC000853535777	ED	On-Demand	Anodyne	DRD4	21	43
Cn1cnn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=O	ZINC000853535777	ED	On-Demand	Anodyne	HTR7	22	49
Cn1cnn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=O	ZINC000853535777	ED	On-Demand	Anodyne	BCL2A1	58	44
O=C1[C@H]2CC[C@@H](C2)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535779	FG	On-Demand	Anodyne	BCL2A1	54	40
Oc1cc2c(cc1CN1CCN(c3ccc(Cl)c(Cl)c3)CC1)[C@H](O)CO2	ZINC000853535788	GG	On-Demand	Clean	DRD4	22	46
Oc1cc2c(cc1CN1CCN(c3ccc(Cl)c(Cl)c3)CC1)[C@@H](O)CO2	ZINC000853535789	GG	On-Demand	Clean	DRD4	22	46
Cn1ncc2c(=O)n(CN3CCN(c4ccc(Cl)c(Cl)c4)CC3)nnc21	ZINC000853535810	GD	On-Demand	Anodyne	HTR7	15	43
Cn1ncc2c(=O)n(CN3CCN(c4ccc(Cl)c(Cl)c4)CC3)nnc21	ZINC000853535810	GD	On-Demand	Anodyne	BCL2A1	52	38
Cn1ncc2c(=O)n(CN3CCN(c4ccc(Cl)c(Cl)c4)CC3)nnc21	ZINC000853535810	GD	On-Demand	Anodyne	Q9M629_MAIZE	65	42
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	BMP1	68	38
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	NQO2	19	42
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	CTSL	15	41
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	MTNR1A	54	43
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	MTNR1B	42	37
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	MMP3	23	41
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	MMP9	17	41
COc1ccc(CC[C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535811	DD	On-Demand	Anodyne	MMP1	28	41
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	BMP1	68	38
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	NQO2	19	42
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	CTSL	15	41
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	MTNR1A	54	43
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	MTNR1B	42	37
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	MMP3	23	41
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	MMP9	17	41
COc1ccc(CC[C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853535812	DD	On-Demand	Anodyne	MMP1	28	41
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535919	GG	On-Demand	Anodyne	HTR1A	29	46
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535919	GG	On-Demand	Anodyne	DRD4	24	43
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535919	GG	On-Demand	Anodyne	HTR2A	18	44
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535919	GG	On-Demand	Anodyne	HTR7	30	44
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535919	GG	On-Demand	Anodyne	BCL2A1	47	38
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535919	GG	On-Demand	Anodyne	NPBWR1	45	36
COc1cc2c(cc1OC)N(CN1CCC(C3CCC3)CC1)C(=O)C2=O	ZINC000853535933	FF	On-Demand	Anodyne	CASP7	53	35
O=C1[C@H]2C=C[C@@H](C2)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535951	FF	On-Demand	Anodyne	BCL2A1	54	40
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC(C2CCC2)CC1	ZINC000853535957	EE	On-Demand	Anodyne	CHRNA7	19	61
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC(C2CCC2)CC1	ZINC000853535958	EE	On-Demand	Anodyne	CHRNA7	19	61
COC(=O)c1cn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)nn1	ZINC000853535965	FE	On-Demand	Anodyne	HTR1A	17	40
COC(=O)c1cn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)nn1	ZINC000853535965	FE	On-Demand	Anodyne	DRD4	44	36
COC(=O)c1cn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)nn1	ZINC000853535965	FE	On-Demand	Anodyne	HTR7	16	45
COC(=O)c1cn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)nn1	ZINC000853535965	FE	On-Demand	Anodyne	BCL2A1	53	39
O=[N+]([O-])c1ccnn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853535968	FF	On-Demand	Bother	BCL2A1	46	38
O=C1N(Cc2cccnc2)CCN1CN1CCC(C2CCC2)CC1	ZINC000853535977	EF	On-Demand	Anodyne	CHRNA7	45	35
O=C1N(Cc2cccnc2)CCN1CN1CCC(C2CCC2)CC1	ZINC000853535977	EF	On-Demand	Anodyne	ACHP_LYMST	25	40
O=C1C[C@@H](C(F)F)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536030	GG	On-Demand	Anodyne	BCL2A1	48	38
O=C1C[C@H](C(F)F)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536031	GG	On-Demand	Anodyne	BCL2A1	48	38
O=c1sccn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536075	EF	On-Demand	Anodyne	BCL2A1	57	42
S=C1OCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536093	EF	On-Demand	Anodyne	BCL2A1	40	38
S=c1ncccn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536103	FH	On-Demand	Anodyne	DRD4	32	46
S=c1ncccn1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536103	FH	On-Demand	Anodyne	BCL2A1	44	36
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536107	FD	On-Demand	Anodyne	HTR1A	33	51
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536107	FD	On-Demand	Anodyne	DRD4	27	45
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536107	FD	On-Demand	Anodyne	HTR2A	18	46
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536107	FD	On-Demand	Anodyne	HTR7	28	46
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536107	FD	On-Demand	Anodyne	BCL2A1	71	48
O=C1c2cccnc2CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536123	GG	On-Demand	Anodyne	HTR1A	15	41
O=C1c2cccnc2CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536123	GG	On-Demand	Anodyne	DRD4	20	42
O=C1c2cccnc2CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536123	GG	On-Demand	Anodyne	BCL2A1	59	42
O=C1CC2(CCOCC2)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536130	GG	On-Demand	Anodyne	ADRA1D	23	55
O=C1CC2(CCOCC2)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536130	GG	On-Demand	Anodyne	BCL2A1	48	40
COC[C@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536170	GF	On-Demand	Anodyne	ADRA1D	16	47
COC[C@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536170	GF	On-Demand	Anodyne	BCL2A1	53	39
COC[C@@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536171	GF	On-Demand	Anodyne	ADRA1D	16	47
COC[C@@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536171	GF	On-Demand	Anodyne	BCL2A1	53	39
O=C1SCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536194	EG	On-Demand	Anodyne	HTR1A	16	45
O=C1SCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536194	EG	On-Demand	Anodyne	DRD4	25	48
O=C1SCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536194	EG	On-Demand	Anodyne	HTR7	17	41
O=C1SCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536194	EG	On-Demand	Anodyne	BCL2A1	58	43
O=C1CC2(CCC2)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536220	FG	On-Demand	Anodyne	HTR1A	17	58
O=C1CC2(CCC2)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536220	FG	On-Demand	Anodyne	ADRA1D	23	58
O=C1CC2(CCC2)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536220	FG	On-Demand	Anodyne	BCL2A1	56	41
COc1ccc(CC[C@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853536221	GG	On-Demand	Anodyne	PROKR1	54	33
COc1ccc(CC[C@@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853536222	GG	On-Demand	Anodyne	PROKR1	54	33
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	HTR1A	26	46
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	DRD2	17	46
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	DRD4	43	35
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	HTR2A	15	46
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	DRD3	22	45
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	HTR7	19	46
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	SIGMAR1	15	40
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	CCR1	24	41
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	BCL2A1	55	41
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	RPA1	47	35
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536254	FE	On-Demand	Anodyne	Q9FYV8_MAIZE	31	40
C=CC[C@H]1CCCN(Cn2nnc(-c3ccc(OC)c(OC)c3)n2)C1	ZINC000853536295	EF	On-Demand	Mild	SCARB1	19	40
C=CC[C@@H]1CCCN(Cn2nnc(-c3ccc(OC)c(OC)c3)n2)C1	ZINC000853536296	EF	On-Demand	Mild	SCARB1	19	40
Cn1ncc2c(=O)n(CN3CCC(C4CCC4)CC3)nnc21	ZINC000853536297	DC	On-Demand	Anodyne	Q9M629_MAIZE	56	37
O=C1C[C@@H](O)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536333	ED	On-Demand	Anodyne	ADRA1D	21	46
O=C1C[C@@H](O)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536333	ED	On-Demand	Anodyne	ADRA1B	15	43
O=C1C[C@H](O)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536334	ED	On-Demand	Anodyne	ADRA1D	21	46
O=C1C[C@H](O)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536334	ED	On-Demand	Anodyne	ADRA1B	15	43
CON(C)CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853536351	CC	On-Demand	Bother	CACNA1C	68	42
CON(C)CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853536351	CC	On-Demand	Bother	CACNA1D	103	42
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@@H](CC(F)(F)F)C1	ZINC000853536370	GF	On-Demand	Anodyne	LIPG	42	36
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@H](CC(F)(F)F)C1	ZINC000853536371	GF	On-Demand	Anodyne	LIPG	42	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853536389	EE	On-Demand	Mild	TYMS	17	43
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853536389	EE	On-Demand	Mild	CACNA1C	52	39
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853536389	EE	On-Demand	Mild	CACNA1D	81	39
N#Cc1cccn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=O	ZINC000853536415	FF	On-Demand	Mild	DRD4	25	45
N#Cc1cccn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=O	ZINC000853536415	FF	On-Demand	Mild	BCL2A1	47	38
COc1ccc(CC[C@@H](C)NC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853536416	FD	On-Demand	Anodyne	PROKR1	42	34
COc1ccc(CC[C@H](C)NC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853536417	FD	On-Demand	Anodyne	PROKR1	42	34
Cn1cnn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=S	ZINC000853536439	FG	On-Demand	Anodyne	DRD4	15	43
Cn1cnn(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1=S	ZINC000853536439	FG	On-Demand	Anodyne	BCL2A1	45	39
C=CC[C@H]1CCCN(Cn2nc(-c3ccccc3OC)n(C)c2=S)C1	ZINC000853536468	FH	On-Demand	Mild	Q8MHZ5_SHEEP	23	40
C=CC[C@@H]1CCCN(Cn2nc(-c3ccccc3OC)n(C)c2=S)C1	ZINC000853536470	FH	On-Demand	Mild	Q8MHZ5_SHEEP	23	40
O=C1c2cccnc2CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536475	GG	On-Demand	Anodyne	HTR1A	15	40
O=C1c2cccnc2CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536475	GG	On-Demand	Anodyne	DPP8	45	35
O=C1c2cccnc2CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536475	GG	On-Demand	Anodyne	DPP9	43	34
O=c1cc2c(nn1CN1CCN(c3ccc(Cl)c(Cl)c3)CC1)CCCC2	ZINC000853536503	GG	On-Demand	Anodyne	BCL2A1	56	41
COC(=O)c1nccc(N2CCC(O)(c3ccccc3C(F)(F)F)CC2)n1	ZINC000853536521	GF	On-Demand	Anodyne	SORD	44	34
C=CC[C@@H]1CCCN(Cn2nnc3ccccc3c2=O)C1	ZINC000853536527	CE	On-Demand	Mild	Q8MHZ5_SHEEP	42	32
C=CC[C@H]1CCCN(Cn2nnc3ccccc3c2=O)C1	ZINC000853536528	CE	On-Demand	Mild	Q8MHZ5_SHEEP	42	32
C=CC[C@H]1CCCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000853536543	GI	On-Demand	Mild	Q8MHZ5_SHEEP	42	35
C=CC[C@@H]1CCCN(Cn2nc(-c3ccccc3)cc(C(F)(F)F)c2=O)C1	ZINC000853536545	GI	On-Demand	Mild	Q8MHZ5_SHEEP	42	35
C=CC[C@@H]1CCCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853536561	DE	On-Demand	Mild	CHRNA7	16	53
C=CC[C@H]1CCCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853536563	DE	On-Demand	Mild	CHRNA7	16	53
C=CC[C@@H]1CCCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853536564	DE	On-Demand	Mild	CHRNA7	16	53
C=CC[C@H]1CCCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853536565	DE	On-Demand	Mild	CHRNA7	16	53
CCOC(=O)c1nccc(N2CCC(O)(c3ccccc3Cl)CC2)n1	ZINC000853536576	FF	On-Demand	Anodyne	SORD	57	34
O=C1[C@@H]2CCC[C@@H]2N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536577	FG	On-Demand	Anodyne	BCL2A1	56	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000853536585	GF	On-Demand	Bother	CACNA1C	58	36
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000853536585	GF	On-Demand	Bother	CACNA1D	86	36
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000853536586	GF	On-Demand	Bother	CACNA1C	58	36
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000853536586	GF	On-Demand	Bother	CACNA1D	86	36
O=C1C[C@@H](C(F)F)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536588	GG	On-Demand	Anodyne	ADRA1D	18	44
O=C1C[C@H](C(F)F)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853536589	GG	On-Demand	Anodyne	ADRA1D	18	44
O=C1c2ncccc2CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536713	GG	On-Demand	Anodyne	HTR1A	15	43
O=C1c2ncccc2CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536713	GG	On-Demand	Anodyne	DRD4	22	43
O=C1c2ncccc2CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536713	GG	On-Demand	Anodyne	BCL2A1	60	43
O=C1c2nccnc2C(=O)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536736	GE	On-Demand	Anodyne	HTR1A	16	48
O=C1c2nccnc2C(=O)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536736	GE	On-Demand	Anodyne	DRD4	17	45
O=C1c2nccnc2C(=O)N1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536736	GE	On-Demand	Anodyne	BCL2A1	62	45
O=C1CCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536752	EF	On-Demand	Anodyne	HTR1A	22	52
O=C1CCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536752	EF	On-Demand	Anodyne	DRD4	19	46
O=C1CCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536752	EF	On-Demand	Anodyne	ADRA1D	18	52
O=C1CCCN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536752	EF	On-Demand	Anodyne	BCL2A1	59	43
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536763	GE	On-Demand	Anodyne	HTR1A	30	46
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536763	GE	On-Demand	Anodyne	DRD4	44	36
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536763	GE	On-Demand	Anodyne	HTR2A	18	46
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536763	GE	On-Demand	Anodyne	DRD3	18	44
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536763	GE	On-Demand	Anodyne	HTR7	21	46
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536763	GE	On-Demand	Anodyne	BCL2A1	47	40
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853536763	GE	On-Demand	Anodyne	RPA1	70	35
O=C1C[C@@H](O)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536774	ED	On-Demand	Anodyne	HTR1A	16	46
O=C1C[C@@H](O)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536774	ED	On-Demand	Anodyne	BCL2A1	58	42
O=C1C[C@H](O)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536775	ED	On-Demand	Anodyne	HTR1A	16	46
O=C1C[C@H](O)CN1CN1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853536775	ED	On-Demand	Anodyne	BCL2A1	58	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536782	FG	On-Demand	Anodyne	BMP1	43	33
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536782	FG	On-Demand	Anodyne	MMP2	20	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536782	FG	On-Demand	Anodyne	MMP3	34	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536782	FG	On-Demand	Anodyne	MMP9	24	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536782	FG	On-Demand	Anodyne	PSMB8	40	30
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536783	FG	On-Demand	Anodyne	BMP1	43	33
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536783	FG	On-Demand	Anodyne	MMP2	20	42
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536783	FG	On-Demand	Anodyne	MMP3	34	42
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536783	FG	On-Demand	Anodyne	MMP9	24	42
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853536783	FG	On-Demand	Anodyne	PSMB8	40	30
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536784	FG	On-Demand	Anodyne	BMP1	43	33
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536784	FG	On-Demand	Anodyne	MMP2	20	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536784	FG	On-Demand	Anodyne	MMP3	34	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536784	FG	On-Demand	Anodyne	MMP9	24	42
COc1ccc(CC[C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536784	FG	On-Demand	Anodyne	PSMB8	40	30
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536785	FG	On-Demand	Anodyne	BMP1	43	33
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536785	FG	On-Demand	Anodyne	MMP2	20	42
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536785	FG	On-Demand	Anodyne	MMP3	34	42
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536785	FG	On-Demand	Anodyne	MMP9	24	42
COc1ccc(CC[C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853536785	FG	On-Demand	Anodyne	PSMB8	40	30
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000853536822	GE	On-Demand	Bother	CACNA1D	53	33
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2cccc([N+](=O)[O-])c2)C1	ZINC000853536823	GE	On-Demand	Bother	CACNA1D	53	33
O=c1cc2c(nn1CN1CCN(c3ccc(Cl)cc3Cl)CC1)CCCC2	ZINC000853536835	GG	On-Demand	Anodyne	CNR1	59	37
O=c1cc2c(nn1CN1CCN(c3ccc(Cl)cc3Cl)CC1)CCCC2	ZINC000853536835	GG	On-Demand	Anodyne	ADRA1D	19	46
C[C@@H]1CCN(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536882	EF	On-Demand	Anodyne	HTR1A	16	44
C[C@@H]1CCN(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536882	EF	On-Demand	Anodyne	HTR7	18	44
C[C@@H]1CCN(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536882	EF	On-Demand	Anodyne	BCL2A1	59	44
C[C@H]1CCN(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536884	EF	On-Demand	Anodyne	HTR1A	16	44
C[C@H]1CCN(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536884	EF	On-Demand	Anodyne	HTR7	18	44
C[C@H]1CCN(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1=O	ZINC000853536884	EF	On-Demand	Anodyne	BCL2A1	59	44
C[C@@H]1CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536888	EF	On-Demand	Anodyne	HTR1A	15	46
C[C@@H]1CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536888	EF	On-Demand	Anodyne	HTR7	16	43
C[C@@H]1CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536888	EF	On-Demand	Anodyne	BCL2A1	58	43
C[C@H]1CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536890	EF	On-Demand	Anodyne	HTR1A	15	46
C[C@H]1CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536890	EF	On-Demand	Anodyne	HTR7	16	43
C[C@H]1CC(=O)N(CN2CCN(c3ccc(Cl)c(Cl)c3)CC2)C1	ZINC000853536890	EF	On-Demand	Anodyne	BCL2A1	58	43
CC(=O)c1ccc(N2CC[C@@H](CC(F)(F)F)C2)c(I)c1	ZINC000853536906	GI	On-Demand	Anodyne	LIPG	47	39
CC(=O)c1ccc(N2CC[C@H](CC(F)(F)F)C2)c(I)c1	ZINC000853536909	GI	On-Demand	Anodyne	LIPG	47	39
C=CC[C@@H]1CCCN(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000853536943	FF	On-Demand	Mild	SLC27A4	49	32
C=CC[C@H]1CCCN(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000853536944	FF	On-Demand	Mild	SLC27A4	49	32
C=CC[C@@H]1CCCN(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000853536945	FF	On-Demand	Mild	SLC27A4	49	32
C=CC[C@H]1CCCN(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)C1	ZINC000853536946	FF	On-Demand	Mild	SLC27A4	49	32
Cc1ccc(N2CCC(O)(c3ccccc3C(F)(F)F)CC2)nn1	ZINC000853536965	EG	On-Demand	Anodyne	SCD1	41	40
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	HTR1A	37	43
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	DRD2	27	43
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	CNR1	51	39
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	ADRA1D	32	43
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	HTR2A	22	40
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	HTR2C	15	40
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	ADRA1A	25	43
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	ADRA1B	31	40
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853536981	GE	On-Demand	Anodyne	DRD3	30	43
O=C1CCCN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537007	EF	On-Demand	Anodyne	HTR1A	19	53
O=C1CCCN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537007	EF	On-Demand	Anodyne	DRD2	15	46
O=C1CCCN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537007	EF	On-Demand	Anodyne	ADRA1D	32	53
O=C1CCCN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537007	EF	On-Demand	Anodyne	ADRA1A	22	53
O=C1CCCN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537007	EF	On-Demand	Anodyne	ADRA1B	23	53
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1=O	ZINC000853537014	FD	On-Demand	Anodyne	HTR1A	28	51
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1=O	ZINC000853537014	FD	On-Demand	Anodyne	DRD2	17	44
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1=O	ZINC000853537014	FD	On-Demand	Anodyne	ADRA1D	29	51
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1=O	ZINC000853537014	FD	On-Demand	Anodyne	ADRA1A	17	48
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1=O	ZINC000853537014	FD	On-Demand	Anodyne	ADRA1B	22	48
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1=O	ZINC000853537014	FD	On-Demand	Anodyne	DRD3	15	44
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1=O	ZINC000853537014	FD	On-Demand	Anodyne	HTR7	16	43
O=C1C[C@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537027	GF	On-Demand	Anodyne	ADRA1D	30	54
O=C1C[C@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537027	GF	On-Demand	Anodyne	ADRA1B	20	48
O=C1C[C@@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537028	GF	On-Demand	Anodyne	ADRA1D	30	54
O=C1C[C@@]2(CCOC2)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537028	GF	On-Demand	Anodyne	ADRA1B	20	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853537048	GF	On-Demand	Bother	CACNA1C	59	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853537048	GF	On-Demand	Bother	CACNA1D	89	36
O=C1N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)CCC12CCOCC2	ZINC000853537068	GG	On-Demand	Anodyne	ADRA1D	19	46
O=C1CC2(CCOCC2)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537071	GG	On-Demand	Anodyne	ADRA1D	31	56
O=C1CC2(CCOCC2)CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537071	GG	On-Demand	Anodyne	ADRA1B	21	49
C#CCCN(CCOC)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853537072	DD	On-Demand	Mild	TYMS	16	44
C#CCCN(CCOC)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853537072	DD	On-Demand	Mild	CACNA1C	61	46
C#CCCN(CCOC)C(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853537072	DD	On-Demand	Mild	CACNA1D	96	46
CC(C)(C)OC(=O)NC1(CNC(=O)NCc2cccc([N+](=O)[O-])c2)CCCC1	ZINC000853537086	GG	On-Demand	Bother	CACNA1C	56	37
CC(C)(C)OC(=O)NC1(CNC(=O)NCc2cccc([N+](=O)[O-])c2)CCCC1	ZINC000853537086	GG	On-Demand	Bother	CACNA1D	85	37
CC(C)(C)OC(=O)NC1(CNC(=O)NCc2cccc([N+](=O)[O-])c2)CCCC1	ZINC000853537086	GG	On-Demand	Bother	NMBR	63	35
O=C1c2ncccc2CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537118	GG	On-Demand	Anodyne	HTR1A	15	43
O=C1c2ncccc2CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537118	GG	On-Demand	Anodyne	DRD4	17	40
O=C1c2ncccc2CN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537118	GG	On-Demand	Anodyne	ADRA1D	16	43
C=CC[C@@H]1CCCN(Cn2nc(-c3ccc(OC)cc3)c3ccccc3c2=O)C1	ZINC000853537120	GI	On-Demand	Mild	HRH1	23	42
C=CC[C@@H]1CCCN(Cn2nc(-c3ccc(OC)cc3)c3ccccc3c2=O)C1	ZINC000853537120	GI	On-Demand	Mild	Q8MHZ5_SHEEP	76	39
C=CC[C@H]1CCCN(Cn2nc(-c3ccc(OC)cc3)c3ccccc3c2=O)C1	ZINC000853537121	GI	On-Demand	Mild	HRH1	23	42
C=CC[C@H]1CCCN(Cn2nc(-c3ccc(OC)cc3)c3ccccc3c2=O)C1	ZINC000853537121	GI	On-Demand	Mild	Q8MHZ5_SHEEP	76	39
COC[C@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1	ZINC000853537130	GF	On-Demand	Anodyne	ADRA1D	27	47
COC[C@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1	ZINC000853537130	GF	On-Demand	Anodyne	ADRA1A	15	47
COC[C@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1	ZINC000853537130	GF	On-Demand	Anodyne	ADRA1B	20	47
COC[C@@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1	ZINC000853537131	GF	On-Demand	Anodyne	ADRA1D	27	47
COC[C@@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1	ZINC000853537131	GF	On-Demand	Anodyne	ADRA1A	15	47
COC[C@@]1(C)CC(=O)N(CN2CCN(c3ccc(Cl)cc3Cl)CC2)C1	ZINC000853537131	GF	On-Demand	Anodyne	ADRA1B	20	47
COc1ccc(-c2nccc(N3CCC(O)(c4ccccc4Cl)CC3)n2)cc1	ZINC000853537136	GI	On-Demand	Anodyne	SORD	47	33
C=CC[C@@H]1CCCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000853537161	FI	On-Demand	Mild	Q8MHZ5_SHEEP	55	33
C=CC[C@H]1CCCN(Cn2nc(-c3ccccc3)c3ccccc3c2=O)C1	ZINC000853537162	FI	On-Demand	Mild	Q8MHZ5_SHEEP	55	33
Oc1cc2c(cc1CN1CCN(c3ccc(Cl)cc3Cl)CC1)[C@H](O)CO2	ZINC000853537188	GG	On-Demand	Clean	DRD4	18	42
Oc1cc2c(cc1CN1CCN(c3ccc(Cl)cc3Cl)CC1)[C@@H](O)CO2	ZINC000853537189	GG	On-Demand	Clean	DRD4	18	42
C=CC[C@@H]1CCCN(Cn2nnc3c(cnn3C)c2=O)C1	ZINC000853537194	CC	On-Demand	Mild	Q9M629_MAIZE	59	38
C=CC[C@H]1CCCN(Cn2nnc3c(cnn3C)c2=O)C1	ZINC000853537195	CC	On-Demand	Mild	Q9M629_MAIZE	59	38
Cn1ncc2c(=O)n(CN3CCN(c4ccc(Cl)cc4Cl)CC3)nnc21	ZINC000853537210	GD	On-Demand	Anodyne	Q9M629_MAIZE	85	46
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	HTR1A	48	42
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	DRD2	40	44
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	CNR1	58	42
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	DRD4	37	41
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	ADRA1D	37	42
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	ADRA1A	31	42
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	ADRA1B	29	41
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	DRD3	43	44
COC(=O)c1ncn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853537237	FE	On-Demand	Anodyne	ALPL	30	40
O=C1c2nccnc2C(=O)N1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537245	GE	On-Demand	Anodyne	HTR1A	15	47
O=C1c2nccnc2C(=O)N1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537245	GE	On-Demand	Anodyne	ADRA1D	20	47
O=c1sccn1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537266	EF	On-Demand	Anodyne	ADRA1D	15	45
C=CC[C@H]1CCCN(Cn2nc(COc3ccccc3)n(C)c2=S)C1	ZINC000853537269	FH	On-Demand	Mild	NPY1R	40	36
C=CC[C@@H]1CCCN(Cn2nc(COc3ccccc3)n(C)c2=S)C1	ZINC000853537270	FH	On-Demand	Mild	NPY1R	40	36
O=C(NCCc1nnc(S)n1C1CC1)NCc1cccc([N+](=O)[O-])c1	ZINC000853537282	FD	On-Demand	Bother	CACNA1C	45	34
O=C(NCCc1nnc(S)n1C1CC1)NCc1cccc([N+](=O)[O-])c1	ZINC000853537282	FD	On-Demand	Bother	CACNA1D	71	34
Cn1cnn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1=O	ZINC000853537300	ED	On-Demand	Anodyne	HTR1A	23	46
Cn1cnn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1=O	ZINC000853537300	ED	On-Demand	Anodyne	ADRA1D	22	46
Cn1cnn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)c1=O	ZINC000853537300	ED	On-Demand	Anodyne	ADRA1B	20	44
COC(=O)c1nccc(N2CCC(O)(c3ccccc3Cl)CC2)n1	ZINC000853537301	EE	On-Demand	Anodyne	SORD	57	34
C=CC[C@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000853537304	EG	On-Demand	Mild	Q8MHZ5_SHEEP	36	40
C=CC[C@@H]1CCCN(Cn2nc(-c3ccc(F)cc3)ccc2=O)C1	ZINC000853537305	EG	On-Demand	Mild	Q8MHZ5_SHEEP	36	40
Cn1c(S)nnc1CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853537306	ED	On-Demand	Bother	CACNA1C	53	36
Cn1c(S)nnc1CCNC(=O)NCc1cccc([N+](=O)[O-])c1	ZINC000853537306	ED	On-Demand	Bother	CACNA1D	81	36
C=CC[C@@H]1CCCN(CN2C(=O)C(=O)c3ccc(OC)cc32)C1	ZINC000853537329	DE	On-Demand	Mild	CASP7	43	37
C=CC[C@H]1CCCN(CN2C(=O)C(=O)c3ccc(OC)cc32)C1	ZINC000853537330	DE	On-Demand	Mild	CASP7	43	37
O=C1SCCN1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537379	EG	On-Demand	Anodyne	ADRA1D	18	45
C=CC[C@H]1CCCN(CN2Cc3ccc(OC)cc3C2=O)C1	ZINC000853537412	DF	On-Demand	Mild	ADAM17	38	43
C=CC[C@@H]1CCCN(CN2Cc3ccc(OC)cc3C2=O)C1	ZINC000853537413	DF	On-Demand	Mild	ADAM17	38	43
C=CC[C@H]1CCCN(Cn2nc(C)c3ccccc3c2=O)C1	ZINC000853537455	CF	On-Demand	Mild	HRH1	41	42
C=CC[C@H]1CCCN(Cn2nc(C)c3ccccc3c2=O)C1	ZINC000853537455	CF	On-Demand	Mild	Q8MHZ5_SHEEP	77	35
C=CC[C@@H]1CCCN(Cn2nc(C)c3ccccc3c2=O)C1	ZINC000853537456	CF	On-Demand	Mild	HRH1	41	42
C=CC[C@@H]1CCCN(Cn2nc(C)c3ccccc3c2=O)C1	ZINC000853537456	CF	On-Demand	Mild	Q8MHZ5_SHEEP	77	35
C=CC[C@H]1CCCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000853537468	DG	On-Demand	Mild	Q8MHZ5_SHEEP	41	32
C=CC[C@@H]1CCCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000853537470	DG	On-Demand	Mild	Q8MHZ5_SHEEP	41	32
C=CC[C@@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853537490	DE	On-Demand	Mild	Q8MHZ5_SHEEP	55	37
C=CC[C@H]1CCCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853537492	DE	On-Demand	Mild	Q8MHZ5_SHEEP	55	37
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537499	GG	On-Demand	Anodyne	HTR1A	33	45
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537499	GG	On-Demand	Anodyne	DRD2	18	45
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537499	GG	On-Demand	Anodyne	DRD4	21	42
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537499	GG	On-Demand	Anodyne	ADRA1D	16	40
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537499	GG	On-Demand	Anodyne	HTR2A	17	44
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853537499	GG	On-Demand	Anodyne	NPBWR1	47	35
Cc1noc(C2CN(c3ncnc4ccc(C(C)C)cc34)C2)n1	ZINC000853537507	DG	On-Demand	Anodyne	PDE3B	43	38
Cc1ccc(OC[C@@H](C)NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000853537517	GH	On-Demand	Anodyne	SLC6A3	17	43
Cc1ccc(OC[C@@H](C)NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000853537517	GH	On-Demand	Anodyne	EPHX2	17	46
Cc1ccc(OC[C@H](C)NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000853537519	GH	On-Demand	Anodyne	SLC6A3	17	43
Cc1ccc(OC[C@H](C)NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000853537519	GH	On-Demand	Anodyne	EPHX2	17	46
COC(=O)c1cn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)nn1	ZINC000853537543	FE	On-Demand	Anodyne	DRD2	20	42
COC(=O)c1cn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)nn1	ZINC000853537543	FE	On-Demand	Anodyne	CNR1	41	44
COC(=O)c1cn(CN2CCN(c3ccc(Cl)cc3Cl)CC2)nn1	ZINC000853537543	FE	On-Demand	Anodyne	DRD3	25	42
CCOc1cc(N2CCC23CCN(C(=O)OC(C)(C)C)CC3)nc(C)n1	ZINC000853537662	FG	On-Demand	Anodyne	GPR119	34	42
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2c1cc(C#N)cnn1	ZINC000853537687	EE	On-Demand	Mild	GPR119	27	42
Fc1cc(NC2CCN(Cc3cccnc3)CC2)ncn1	ZINC000853537747	CE	On-Demand	Anodyne	DRD4	15	51
Fc1cc(NC2CCN(Cc3cccnc3)CC2)ncn1	ZINC000853537747	CE	On-Demand	Anodyne	SIGMAR1	22	43
Fc1cc(NC2CCN(Cc3cccnc3)CC2)ncn1	ZINC000853537747	CE	On-Demand	Anodyne	SSTR5	75	40
Fc1cc(NC2CCN(Cc3cccnc3)CC2)ncn1	ZINC000853537747	CE	On-Demand	Anodyne	MCHR1	17	43
Cc1ccc(N2CCC23CCN(C(=O)OC(C)(C)C)CC3)nn1	ZINC000853537748	DF	On-Demand	Anodyne	GPR119	36	42
Cc1ccc(OC[C@@H](C)NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000853537763	EF	On-Demand	Anodyne	CPT1A	111	41
Cc1ccc(OC[C@H](C)NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000853537764	EF	On-Demand	Anodyne	CPT1A	111	41
Cc1ccc(OC[C@H](C)NC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000853537765	EF	On-Demand	Anodyne	CPT1A	111	41
Cc1ccc(OC[C@@H](C)NC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000853537766	EF	On-Demand	Anodyne	CPT1A	111	41
Fc1ncnc(NC2CCN(Cc3cccnc3)CC2)c1Br	ZINC000853537809	FF	On-Demand	Anodyne	SIGMAR1	22	43
Fc1ncnc(NC2CCN(Cc3cccnc3)CC2)c1Br	ZINC000853537809	FF	On-Demand	Anodyne	SSTR5	63	38
Fc1ncnc(NC2CCN(Cc3cccnc3)CC2)c1Br	ZINC000853537809	FF	On-Demand	Anodyne	SCN5A	58	39
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2c1cnc(F)cn1	ZINC000853537852	DF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2c1cc(F)ncn1	ZINC000853537875	DF	On-Demand	Anodyne	GPR119	41	44
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC2(CCCC2)[C@@H]1c1ccco1	ZINC000853537884	FG	On-Demand	Anodyne	CHRNA7	18	48
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC2(CCCC2)[C@H]1c1ccco1	ZINC000853537885	FG	On-Demand	Anodyne	CHRNA7	18	48
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC2(CCCC2)[C@@H]1c1ccco1	ZINC000853537886	FG	On-Demand	Anodyne	CHRNA7	18	48
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC2(CCCC2)[C@H]1c1ccco1	ZINC000853537887	FG	On-Demand	Anodyne	CHRNA7	18	48
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2c1nc2ncccc2cc1C#N	ZINC000853537933	GG	On-Demand	Mild	GPR119	20	41
Fc1cnc(NC2CCN(Cc3cccnc3)CC2)cn1	ZINC000853537934	CE	On-Demand	Anodyne	DRD4	16	42
Fc1cnc(NC2CCN(Cc3cccnc3)CC2)cn1	ZINC000853537934	CE	On-Demand	Anodyne	SIGMAR1	24	45
Fc1cnc(NC2CCN(Cc3cccnc3)CC2)cn1	ZINC000853537934	CE	On-Demand	Anodyne	SSTR5	60	39
O=S1(=O)N=C(Cl)c2ccc(NC3CCN(Cc4cccnc4)CC3)cc21	ZINC000853537955	GF	On-Demand	Anodyne	MCHR1	15	42
COc1ccc(-c2nccc(N3CC(c4nc(C)no4)C3)n2)cc1	ZINC000853537956	DE	On-Demand	Anodyne	SORD	54	33
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000853537961	GF	On-Demand	Bother	GPR119	19	43
Cc1ccc(OC[C@@H](C)NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853537962	GF	On-Demand	Anodyne	CASR	53	39
Cc1ccc(OC[C@H](C)NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853537963	GF	On-Demand	Anodyne	CASR	53	39
Cn1cc(-c2cc3c(nn2)CCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C3)cn1	ZINC000853537986	GF	On-Demand	Anodyne	EPHX2	18	40
Cn1cc(-c2cc3c(nn2)CCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C3)cn1	ZINC000853537987	GF	On-Demand	Anodyne	EPHX2	18	40
Cn1cc(-c2cc3c(nn2)CCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C3)cn1	ZINC000853537988	GF	On-Demand	Anodyne	EPHX2	18	40
Cn1cc(-c2cc3c(nn2)CCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C3)cn1	ZINC000853537989	GF	On-Demand	Anodyne	EPHX2	18	40
Cc1ccc(OC[C@H](C)NC(=O)N2CCCC[C@H]2[C@@H](C)CO)cc1	ZINC000853538173	EF	On-Demand	Anodyne	CPT1A	48	34
Cc1ccc(OC[C@H](C)NC(=O)N2CCCC[C@H]2[C@H](C)CO)cc1	ZINC000853538174	EF	On-Demand	Anodyne	CPT1A	48	34
Cc1ccc(OC[C@H](C)NC(=O)N2CCCC[C@@H]2[C@H](C)CO)cc1	ZINC000853538175	EF	On-Demand	Anodyne	CPT1A	48	34
Cc1ccc(OC[C@H](C)NC(=O)N2CCCC[C@@H]2[C@@H](C)CO)cc1	ZINC000853538176	EF	On-Demand	Anodyne	CPT1A	48	34
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000853538260	FG	On-Demand	Reactive	SIGMAR1	15	42
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000853538260	FG	On-Demand	Reactive	EPHX2	28	42
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000853538260	FG	On-Demand	Reactive	CXCR3	16	44
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CC(F)(F)F)CC1	ZINC000853538260	FG	On-Demand	Reactive	HPGDS	37	43
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538324	FG	On-Demand	Anodyne	PPARA	15	41
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538324	FG	On-Demand	Anodyne	MME	48	41
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538324	FG	On-Demand	Anodyne	NPY5R	25	46
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538324	FG	On-Demand	Anodyne	ACE2	44	36
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538324	FG	On-Demand	Anodyne	PSMB8	40	31
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853538325	FG	On-Demand	Anodyne	PPARA	15	41
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853538325	FG	On-Demand	Anodyne	MME	48	41
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853538325	FG	On-Demand	Anodyne	NPY5R	25	46
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853538325	FG	On-Demand	Anodyne	ACE2	44	36
Cc1ccc(OC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853538325	FG	On-Demand	Anodyne	PSMB8	40	31
Cc1ccc(OC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538326	FG	On-Demand	Anodyne	PPARA	15	41
Cc1ccc(OC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538326	FG	On-Demand	Anodyne	MME	48	41
Cc1ccc(OC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538326	FG	On-Demand	Anodyne	NPY5R	25	46
Cc1ccc(OC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538326	FG	On-Demand	Anodyne	ACE2	44	36
Cc1ccc(OC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853538326	FG	On-Demand	Anodyne	PSMB8	40	31
CC[C@@H](O)CNC(=O)N[C@H](C)COc1ccc(C)cc1	ZINC000853538331	CD	On-Demand	Anodyne	ADRB2	22	50
CC[C@@H](O)CNC(=O)N[C@H](C)COc1ccc(C)cc1	ZINC000853538331	CD	On-Demand	Anodyne	ADRB1	30	41
CC[C@@H](O)CNC(=O)N[C@@H](C)COc1ccc(C)cc1	ZINC000853538332	CD	On-Demand	Anodyne	ADRB2	22	50
CC[C@@H](O)CNC(=O)N[C@@H](C)COc1ccc(C)cc1	ZINC000853538332	CD	On-Demand	Anodyne	ADRB1	30	41
Cc1ccc(OC[C@H](C)NC(=O)N2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000853538343	GD	On-Demand	Anodyne	MMP13	20	40
Cc1ccc(OC[C@@H](C)NC(=O)N2CCN(S(=O)(=O)NC(C)C)CC2)cc1	ZINC000853538344	GD	On-Demand	Anodyne	MMP13	20	40
Cc1ccc(OC[C@@H](C)NC(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1	ZINC000853538358	GF	On-Demand	Anodyne	HRH3	29	41
Cc1ccc(OC[C@@H](C)NC(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1	ZINC000853538358	GF	On-Demand	Anodyne	L3MBTL3	59	37
Cc1ccc(OC[C@H](C)NC(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1	ZINC000853538359	GF	On-Demand	Anodyne	HRH3	29	41
Cc1ccc(OC[C@H](C)NC(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1	ZINC000853538359	GF	On-Demand	Anodyne	L3MBTL3	59	37
Cc1ccc(OC[C@H](C)NC(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1	ZINC000853538360	GF	On-Demand	Anodyne	HRH3	29	41
Cc1ccc(OC[C@H](C)NC(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1	ZINC000853538360	GF	On-Demand	Anodyne	L3MBTL3	59	37
Cc1ccc(OC[C@@H](C)NC(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1	ZINC000853538361	GF	On-Demand	Anodyne	HRH3	29	41
Cc1ccc(OC[C@@H](C)NC(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1	ZINC000853538361	GF	On-Demand	Anodyne	L3MBTL3	59	37
Cn1nnc2c(N3CCC(CO)(NC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853538384	FC	On-Demand	Anodyne	SIRT3	25	40
Cn1nnc2c(N3CCC(CO)(NC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853538384	FC	On-Demand	Anodyne	SIRT2	21	40
Cn1nnc2c(N3CCC(CO)(NC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853538384	FC	On-Demand	Anodyne	SIRT1	19	40
COC(=O)c1nccc(N2CCC23CCN(C(=O)OC(C)(C)C)CC3)n1	ZINC000853538393	FE	On-Demand	Anodyne	GPR119	33	42
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](C)COc2ccc(C)cc2)C1	ZINC000853538397	EF	On-Demand	Anodyne	CCR5	21	45
CCN1CC[C@@H](N(CC)C(=O)N[C@H](C)COc2ccc(C)cc2)C1	ZINC000853538398	EF	On-Demand	Anodyne	CCR5	21	45
CCN1CC[C@H](N(CC)C(=O)N[C@@H](C)COc2ccc(C)cc2)C1	ZINC000853538399	EF	On-Demand	Anodyne	CCR5	21	45
CCN1CC[C@H](N(CC)C(=O)N[C@H](C)COc2ccc(C)cc2)C1	ZINC000853538400	EF	On-Demand	Anodyne	CCR5	21	45
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H](N2CCOC2=O)C1	ZINC000853538442	GC	On-Demand	Anodyne	SIGMAR1	34	42
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H](N2CCOC2=O)C1	ZINC000853538443	GC	On-Demand	Anodyne	SIGMAR1	34	42
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H](N2CCOC2=O)C1	ZINC000853538470	GD	On-Demand	Anodyne	SIGMAR1	30	43
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H](N2CCOC2=O)C1	ZINC000853538471	GD	On-Demand	Anodyne	SIGMAR1	30	43
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000853538558	GF	On-Demand	Anodyne	CCR5	57	31
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000853538558	GF	On-Demand	Anodyne	EPHX2	21	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000853538559	GF	On-Demand	Anodyne	CCR5	57	31
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000853538559	GF	On-Demand	Anodyne	EPHX2	21	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000853538560	GF	On-Demand	Anodyne	CCR5	57	31
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)C1	ZINC000853538560	GF	On-Demand	Anodyne	EPHX2	21	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000853538561	GF	On-Demand	Anodyne	CCR5	57	31
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)C1	ZINC000853538561	GF	On-Demand	Anodyne	EPHX2	21	41
COC(=O)c1nccc(N2C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)n1	ZINC000853538595	ED	On-Demand	Anodyne	SORD	36	40
COC(=O)c1nccc(N2C[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000853538596	ED	On-Demand	Anodyne	SORD	36	40
COC(=O)c1nccc(N2C[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000853538597	ED	On-Demand	Anodyne	SORD	36	40
COC(=O)c1nccc(N2C[C@H](C)[C@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000853538598	ED	On-Demand	Anodyne	SORD	36	40
O=C(NNc1cccc2c1OC(F)(F)O2)NC1CCN(CC(F)(F)F)CC1	ZINC000853538691	GF	On-Demand	Reactive	HPGDS	38	42
Cn1c(S)nnc1CCNC(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000853538712	FC	On-Demand	Anodyne	HPGDS	37	40
CON(C)CCNC(=O)NCCc1ccccc1Cl	ZINC000853538714	CD	On-Demand	Anodyne	MTNR1A	53	48
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2c1cnccn1	ZINC000853538784	DE	On-Demand	Anodyne	GPR119	35	61
CON(C)CCNC(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000853538830	DC	On-Demand	Anodyne	SLC6A5	29	40
CON(C)CCNC(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000853538830	DC	On-Demand	Anodyne	HPGDS	39	42
COC(=O)c1cccc(NNC(=O)NC2CCN(CC(F)(F)F)CC2)c1C	ZINC000853538869	GE	On-Demand	Reactive	HPGDS	38	43
COc1cccc([C@H]2CC(=O)N(CN3CC[C@H](N4CCOC4=O)C3)C2)c1	ZINC000853538893	FD	On-Demand	Anodyne	PDE11A	15	40
COc1cccc([C@H]2CC(=O)N(CN3CC[C@@H](N4CCOC4=O)C3)C2)c1	ZINC000853538895	FD	On-Demand	Anodyne	PDE11A	15	40
CC(C)(C)OC(=O)N1CCC2(CC1)CCN2c1cc(C(C)(C)C)ncn1	ZINC000853538959	FH	On-Demand	Anodyne	GPR119	35	44
Cc1ccc(OC[C@H](C)NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853538970	GF	On-Demand	Anodyne	MCHR1	28	46
Cc1ccc(OC[C@H](C)NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853538970	GF	On-Demand	Anodyne	CACNA1I	15	41
Cc1ccc(OC[C@H](C)NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853538970	GF	On-Demand	Anodyne	VHL	47	31
Cc1ccc(OC[C@@H](C)NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853538971	GF	On-Demand	Anodyne	MCHR1	28	46
Cc1ccc(OC[C@@H](C)NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853538971	GF	On-Demand	Anodyne	CACNA1I	15	41
Cc1ccc(OC[C@@H](C)NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853538971	GF	On-Demand	Anodyne	VHL	47	31
Cc1ccc(OC[C@H](C)NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853538972	GF	On-Demand	Anodyne	MCHR1	28	46
Cc1ccc(OC[C@H](C)NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853538972	GF	On-Demand	Anodyne	CACNA1I	15	41
Cc1ccc(OC[C@H](C)NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853538972	GF	On-Demand	Anodyne	VHL	47	31
Cc1ccc(OC[C@@H](C)NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853538973	GF	On-Demand	Anodyne	MCHR1	28	46
Cc1ccc(OC[C@@H](C)NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853538973	GF	On-Demand	Anodyne	CACNA1I	15	41
Cc1ccc(OC[C@@H](C)NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853538973	GF	On-Demand	Anodyne	VHL	47	31
Cc1ccc(OC[C@H](C)NC(=O)N[C@H](c2ccncc2)C2(CO)CCC2)cc1	ZINC000853539013	GG	On-Demand	Anodyne	CYP26A1	41	37
Cc1ccc(OC[C@H](C)NC(=O)N[C@@H](c2ccncc2)C2(CO)CCC2)cc1	ZINC000853539014	GG	On-Demand	Anodyne	CYP26A1	41	37
Cc1ccc(OC[C@@H](C)NC(=O)N[C@@H](c2ccncc2)C2(CO)CCC2)cc1	ZINC000853539015	GG	On-Demand	Anodyne	CYP26A1	41	37
Cc1ccc(OC[C@@H](C)NC(=O)N[C@H](c2ccncc2)C2(CO)CCC2)cc1	ZINC000853539016	GG	On-Demand	Anodyne	CYP26A1	41	37
CCOC(=O)c1nccc(N2CCC23CCN(C(=O)OC(C)(C)C)CC3)n1	ZINC000853539018	GF	On-Demand	Anodyne	GPR119	42	42
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@@H](N2CCOC2=O)C1	ZINC000853539171	FC	On-Demand	Anodyne	CHRNA7	15	53
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H](N2CCOC2=O)C1	ZINC000853539172	FC	On-Demand	Anodyne	CHRNA7	15	53
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H](N2CCOC2=O)C1	ZINC000853539173	FC	On-Demand	Anodyne	CHRNA7	15	53
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@H](N2CCOC2=O)C1	ZINC000853539174	FC	On-Demand	Anodyne	CHRNA7	15	53
O=C1C(=O)N(CN2CC3(CCCC3)[C@H]2c2ccco2)c2ccccc21	ZINC000853539380	EG	On-Demand	Anodyne	ALDH1A1	41	38
O=C1C(=O)N(CN2CC3(CCCC3)[C@H]2c2ccco2)c2ccccc21	ZINC000853539380	EG	On-Demand	Anodyne	ALDH3A1	37	40
O=C1C(=O)N(CN2CC3(CCCC3)[C@@H]2c2ccco2)c2ccccc21	ZINC000853539381	EG	On-Demand	Anodyne	ALDH1A1	41	38
O=C1C(=O)N(CN2CC3(CCCC3)[C@@H]2c2ccco2)c2ccccc21	ZINC000853539381	EG	On-Demand	Anodyne	ALDH3A1	37	40
O=C1C[C@@H](c2ccccc2)N1CN1CC[C@@H](N2CCOC2=O)C1	ZINC000853539521	DD	On-Demand	Anodyne	PDE11A	67	33
O=C1OCCN1[C@H]1CCN(CN2C(=O)C[C@H]2c2ccccc2)C1	ZINC000853539522	DD	On-Demand	Anodyne	PDE11A	67	33
O=C1OCCN1[C@@H]1CCN(CN2C(=O)C[C@@H]2c2ccccc2)C1	ZINC000853539523	DD	On-Demand	Anodyne	PDE11A	67	33
O=C1OCCN1[C@H]1CCN(CN2C(=O)C[C@@H]2c2ccccc2)C1	ZINC000853539524	DD	On-Demand	Anodyne	PDE11A	67	33
O=C1C[C@@H](Cc2ccccc2)C(=O)N1CN1CC[C@H](N2CCOC2=O)C1	ZINC000853539537	FD	On-Demand	Anodyne	PDE11A	47	34
O=C1C[C@H](Cc2ccccc2)C(=O)N1CN1CC[C@H](N2CCOC2=O)C1	ZINC000853539538	FD	On-Demand	Anodyne	PDE11A	47	34
O=C1C[C@@H](Cc2ccccc2)C(=O)N1CN1CC[C@@H](N2CCOC2=O)C1	ZINC000853539539	FD	On-Demand	Anodyne	PDE11A	47	34
O=C1C[C@H](Cc2ccccc2)C(=O)N1CN1CC[C@@H](N2CCOC2=O)C1	ZINC000853539540	FD	On-Demand	Anodyne	PDE11A	47	34
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853539600	FE	On-Demand	Anodyne	DRD4	15	45
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853539600	FE	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853539600	FE	On-Demand	Anodyne	EPHX2	34	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853539600	FE	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853539601	FE	On-Demand	Anodyne	DRD4	15	45
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853539601	FE	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853539601	FE	On-Demand	Anodyne	EPHX2	34	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853539601	FE	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853539603	FE	On-Demand	Anodyne	DRD4	15	45
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853539603	FE	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853539603	FE	On-Demand	Anodyne	EPHX2	34	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853539603	FE	On-Demand	Anodyne	HPGDS	41	48
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853539605	FE	On-Demand	Anodyne	DRD4	15	45
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853539605	FE	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853539605	FE	On-Demand	Anodyne	EPHX2	34	42
O=C(NC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853539605	FE	On-Demand	Anodyne	HPGDS	41	48
C#CCCN(CCOC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853539679	GD	On-Demand	Mild	HTR1A	43	48
C#CCCN(CCOC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853539679	GD	On-Demand	Mild	DRD2	39	43
C#CCCN(CCOC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853539679	GD	On-Demand	Mild	DRD4	59	48
C#CCCN(CCOC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853539679	GD	On-Demand	Mild	HTR2A	24	41
C#CCCN(CCOC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853539679	GD	On-Demand	Mild	DRD3	67	42
C#CCCN(CCOC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853539679	GD	On-Demand	Mild	HTR7	30	41
C#CCCN(CCOC)C(=O)NC1CCN(CC(F)(F)F)CC1	ZINC000853539717	ED	On-Demand	Mild	HPGDS	35	40
O=C1OCCN1[C@H]1CCN(Cc2c(O)ccc3ccccc23)C1	ZINC000853539745	DF	On-Demand	Clean	PDE11A	42	32
O=C1OCCN1[C@@H]1CCN(Cc2c(O)ccc3ccccc23)C1	ZINC000853539748	DF	On-Demand	Clean	PDE11A	42	32
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000853539858	FF	On-Demand	Mild	DRD2	38	47
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000853539858	FF	On-Demand	Mild	SIGMAR1	15	48
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000853539858	FF	On-Demand	Mild	ACKR3	47	32
C#CCCN(CCOC)C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000853539859	FF	On-Demand	Mild	DRD2	38	47
C#CCCN(CCOC)C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000853539859	FF	On-Demand	Mild	SIGMAR1	15	48
C#CCCN(CCOC)C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000853539859	FF	On-Demand	Mild	ACKR3	47	32
C#Cc1cccnc1NCCN1CCCC(C)(C)C1	ZINC000853539915	CF	On-Demand	Mild	HNMT	57	36
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853539931	GD	On-Demand	Anodyne	DRD4	22	42
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853539931	GD	On-Demand	Anodyne	SLC6A1	100	33
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853539931	GD	On-Demand	Anodyne	SIGMAR1	21	42
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853539931	GD	On-Demand	Anodyne	CCR3	46	46
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853539933	GD	On-Demand	Anodyne	DRD4	22	42
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853539933	GD	On-Demand	Anodyne	SLC6A1	100	33
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853539933	GD	On-Demand	Anodyne	SIGMAR1	21	42
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853539933	GD	On-Demand	Anodyne	CCR3	46	46
Cn1ncc2c(=O)n(CN3CC4(CCCC4)[C@@H]3c3ccco3)nnc21	ZINC000853540013	ED	On-Demand	Anodyne	Q9M629_MAIZE	47	32
Cn1ncc2c(=O)n(CN3CC4(CCCC4)[C@H]3c3ccco3)nnc21	ZINC000853540014	ED	On-Demand	Anodyne	Q9M629_MAIZE	47	32
Cn1ncc2c(=O)n(CN3CC[C@@H](N4CCOC4=O)C3)nnc21	ZINC000853540099	DB	On-Demand	Anodyne	Q9M629_MAIZE	59	37
Cn1ncc2c(=O)n(CN3CC[C@H](N4CCOC4=O)C3)nnc21	ZINC000853540100	DB	On-Demand	Anodyne	Q9M629_MAIZE	59	37
Cn1ccnc1[C@H]1CCCN(c2nc3ccccc3n3cccc23)C1	ZINC000853540271	EH	On-Demand	Anodyne	HTR3A	24	43
Cn1ccnc1[C@@H]1CCCN(c2nc3ccccc3n3cccc23)C1	ZINC000853540275	EH	On-Demand	Anodyne	HTR3A	24	43
CCc1noc([C@]2(O)CCN(c3nc4ccccc4n4cccc34)C2)n1	ZINC000853540608	EF	On-Demand	Anodyne	HTR3A	25	41
CCc1noc([C@@]2(O)CCN(c3nc4ccccc4n4cccc34)C2)n1	ZINC000853540609	EF	On-Demand	Anodyne	HTR3A	25	41
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000853540659	GE	On-Demand	Anodyne	DRD2	35	43
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000853540660	GE	On-Demand	Anodyne	DRD2	35	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853540698	GD	On-Demand	Clean	HTR1A	56	49
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853540698	GD	On-Demand	Clean	DRD2	46	42
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853540698	GD	On-Demand	Clean	DRD4	60	49
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853540698	GD	On-Demand	Clean	HTR2A	30	44
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853540698	GD	On-Demand	Clean	DRD3	69	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853540698	GD	On-Demand	Clean	HTR7	43	44
O=C1C(=O)N(CN2CC[C@H](N3CCOC3=O)C2)c2cc(OC(F)(F)F)ccc21	ZINC000853540730	GD	On-Demand	Anodyne	CHRM5	15	41
O=C1C(=O)N(CN2CC[C@@H](N3CCOC3=O)C2)c2cc(OC(F)(F)F)ccc21	ZINC000853540731	GD	On-Demand	Anodyne	CHRM5	15	41
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	DRD2	21	45
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	DRD4	24	45
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	ACHE	25	41
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	SLC6A1	103	35
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	DRD3	18	45
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	HTR4	38	41
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	SIGMAR1	27	41
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853540835	FF	On-Demand	Mild	CCR3	21	44
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	DRD2	21	45
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	DRD4	24	45
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	ACHE	25	41
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	SLC6A1	103	35
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	DRD3	18	45
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	HTR4	38	41
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	SIGMAR1	27	41
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853540837	FF	On-Demand	Mild	CCR3	21	44
COC(=O)c1nn(CN2CC[C@@H](N3CCOC3=O)C2)c2ccccc12	ZINC000853541119	ED	On-Demand	Anodyne	HTR4	49	34
COC(=O)c1nn(CN2CC[C@H](N3CCOC3=O)C2)c2ccccc12	ZINC000853541121	ED	On-Demand	Anodyne	HTR4	49	34
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	DRD2	23	48
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	DRD4	34	48
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	ACHE	39	43
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	HRH2	25	41
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	SLC6A1	74	33
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	DRD3	19	48
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	HTR4	36	41
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	SIGMAR1	44	46
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	CCR3	50	48
CON(C)CCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541139	ED	On-Demand	Anodyne	CCR5	18	41
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	DRD2	23	48
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	DRD4	34	48
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	ACHE	39	43
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	HRH2	25	41
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	SLC6A1	74	33
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	DRD3	19	48
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	HTR4	36	41
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	SIGMAR1	44	46
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	CCR3	50	48
CON(C)CCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541141	ED	On-Demand	Anodyne	CCR5	18	41
C#CCCCOc1cccnc1NC1CCN(S(=O)(=O)C(C)C)CC1	ZINC000853541405	FE	On-Demand	Mild	EHMT2	58	32
C#CCCCOc1cccnc1N[C@H]1CCCN(c2cc(C)nn2C)C1	ZINC000853541528	FF	On-Demand	Mild	EHMT2	59	32
C#CCCCOc1cccnc1N[C@@H]1CCCN(c2cc(C)nn2C)C1	ZINC000853541564	FF	On-Demand	Mild	EHMT2	59	32
O=C1OCCN1[C@@H]1CCN(Cn2nnc3ccccc3c2=S)C1	ZINC000853541721	ED	On-Demand	Anodyne	PDE11A	49	32
O=C1OCCN1[C@H]1CCN(Cn2nnc3ccccc3c2=S)C1	ZINC000853541722	ED	On-Demand	Anodyne	PDE11A	49	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541755	GF	On-Demand	Mild	DRD4	17	43
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541755	GF	On-Demand	Mild	ACHE	27	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541755	GF	On-Demand	Mild	SLC6A1	41	30
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541755	GF	On-Demand	Mild	HTR4	41	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541755	GF	On-Demand	Mild	SIGMAR1	23	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853541755	GF	On-Demand	Mild	CCR3	18	43
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541758	GF	On-Demand	Mild	DRD4	17	43
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541758	GF	On-Demand	Mild	ACHE	27	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541758	GF	On-Demand	Mild	SLC6A1	41	30
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541758	GF	On-Demand	Mild	HTR4	41	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541758	GF	On-Demand	Mild	SIGMAR1	23	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853541758	GF	On-Demand	Mild	CCR3	18	43
COCC1(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853541771	GE	On-Demand	Clean	HTR1A	49	48
COCC1(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853541771	GE	On-Demand	Clean	DRD2	38	41
COCC1(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853541771	GE	On-Demand	Clean	DRD4	57	48
COCC1(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853541771	GE	On-Demand	Clean	HTR2A	23	42
COCC1(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853541771	GE	On-Demand	Clean	DRD3	56	47
COCC1(NC(=O)NCCN2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853541771	GE	On-Demand	Clean	HTR7	47	42
CON(C)CCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000853541772	ED	On-Demand	Anodyne	DRD2	43	49
CON(C)CCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000853541772	ED	On-Demand	Anodyne	LTA4H	20	42
CON(C)CCNC(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000853541772	ED	On-Demand	Anodyne	SIGMAR1	29	50
CON(C)CCNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000853541776	ED	On-Demand	Anodyne	DRD2	43	49
CON(C)CCNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000853541776	ED	On-Demand	Anodyne	LTA4H	20	42
CON(C)CCNC(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000853541776	ED	On-Demand	Anodyne	SIGMAR1	29	50
CC[C@H](C)N(CC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853542117	FF	On-Demand	Clean	HTR1A	55	50
CC[C@H](C)N(CC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853542117	FF	On-Demand	Clean	DRD2	44	42
CC[C@H](C)N(CC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853542117	FF	On-Demand	Clean	DRD4	60	50
CC[C@H](C)N(CC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853542117	FF	On-Demand	Clean	HTR2A	33	44
CC[C@H](C)N(CC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853542117	FF	On-Demand	Clean	DRD3	68	43
CC[C@H](C)N(CC)C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853542117	FF	On-Demand	Clean	HTR7	55	45
O=C1C(=O)N(CN2CC[C@@H](N3CCOC3=O)C2)c2ccccc21	ZINC000853542211	DC	On-Demand	Anodyne	ALDH1A1	48	38
O=C1C(=O)N(CN2CC[C@@H](N3CCOC3=O)C2)c2ccccc21	ZINC000853542211	DC	On-Demand	Anodyne	ALDH3A1	40	48
O=C1C(=O)N(CN2CC[C@H](N3CCOC3=O)C2)c2ccccc21	ZINC000853542212	DC	On-Demand	Anodyne	ALDH1A1	48	38
O=C1C(=O)N(CN2CC[C@H](N3CCOC3=O)C2)c2ccccc21	ZINC000853542212	DC	On-Demand	Anodyne	ALDH3A1	40	48
CC(C)c1ccc2ncnc(N3CCC[C@H](c4nccn4C)C3)c2c1	ZINC000853542410	EH	On-Demand	Anodyne	PDE3A	43	47
CC(C)c1ccc2ncnc(N3CCC[C@H](c4nccn4C)C3)c2c1	ZINC000853542410	EH	On-Demand	Anodyne	PDE3B	47	41
CC(C)c1ccc2ncnc(N3CCC[C@@H](c4nccn4C)C3)c2c1	ZINC000853542411	EH	On-Demand	Anodyne	PDE3A	43	47
CC(C)c1ccc2ncnc(N3CCC[C@@H](c4nccn4C)C3)c2c1	ZINC000853542411	EH	On-Demand	Anodyne	PDE3B	47	41
CON(C)CCNC(=O)NCc1ccccc1OCCN1CCOCC1	ZINC000853542455	FC	On-Demand	Anodyne	EPHX2	23	40
C[C@@H](CCN(C)C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853542726	EF	On-Demand	Reactive	LCK	22	41
C[C@@H](CCN(C)C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853542726	EF	On-Demand	Reactive	CSNK1D	42	43
C[C@@H](CCN(C)C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853542726	EF	On-Demand	Reactive	UTS2	56	36
C[C@@H](CCN(C)C)NC(=O)NNc1ccc(Cl)cc1Br	ZINC000853542880	FG	On-Demand	Reactive	UTS2	58	39
CC[C@@H](O)CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853543033	FC	On-Demand	Clean	HTR1A	56	52
CC[C@@H](O)CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853543033	FC	On-Demand	Clean	DRD2	45	42
CC[C@@H](O)CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853543033	FC	On-Demand	Clean	DRD4	60	50
CC[C@@H](O)CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853543033	FC	On-Demand	Clean	HTR2A	38	47
CC[C@@H](O)CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853543033	FC	On-Demand	Clean	HTR2C	26	41
CC[C@@H](O)CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853543033	FC	On-Demand	Clean	DRD3	71	43
CC[C@@H](O)CNC(=O)NCCN1CCN(c2ccc(OC)cc2)CC1	ZINC000853543033	FC	On-Demand	Clean	HTR7	54	47
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)COC	ZINC000853543058	GE	On-Demand	Mild	HTR1A	32	45
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)COC	ZINC000853543058	GE	On-Demand	Mild	DRD4	54	45
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)COC	ZINC000853543058	GE	On-Demand	Mild	HTR2A	15	40
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)COC	ZINC000853543058	GE	On-Demand	Mild	DRD3	43	39
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@H](C)COC	ZINC000853543058	GE	On-Demand	Mild	HTR7	31	40
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)COC	ZINC000853543059	GE	On-Demand	Mild	HTR1A	32	45
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)COC	ZINC000853543059	GE	On-Demand	Mild	DRD4	54	45
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)COC	ZINC000853543059	GE	On-Demand	Mild	HTR2A	15	40
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)COC	ZINC000853543059	GE	On-Demand	Mild	DRD3	43	39
C=CCN(C(=O)NCCN1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)COC	ZINC000853543059	GE	On-Demand	Mild	HTR7	31	40
C[C@@H](CCN(C)C)NC(=O)NNc1cc(F)cc(Cl)c1	ZINC000853543236	DE	On-Demand	Reactive	UTS2	44	34
CON(C)CCNC(=O)NCCOc1ccc(Br)cc1	ZINC000853543318	ED	On-Demand	Anodyne	SHC	41	41
CON(C)CCNC(=O)NCCOc1ccc(Br)cc1	ZINC000853543318	ED	On-Demand	Anodyne	LSS	39	41
COC(=O)c1cccc(NNC(=O)N[C@@H](C)CCN(C)C)c1C	ZINC000853543349	DD	On-Demand	Reactive	UTS2	46	32
Cn1ncc2c(=O)n(CN3C[C@@]4(C)COC[C@@]4(C)C3)nnc21	ZINC000853543455	DB	On-Demand	Anodyne	Q9M629_MAIZE	55	37
COc1ccc(-c2nnn(CN3CC[C@H]3c3ccc(F)cc3)n2)cc1OC	ZINC000853543562	FF	On-Demand	Anodyne	SCARB1	32	44
COc1ccc(-c2nnn(CN3CC[C@@H]3c3ccc(F)cc3)n2)cc1OC	ZINC000853543563	FF	On-Demand	Anodyne	SCARB1	32	44
O=C(NCCCc1nc[nH]n1)NC1CCN(CC2CCCCC2)CC1	ZINC000853543654	EE	On-Demand	Anodyne	HRH2	24	45
O=C(NCCCc1nc[nH]n1)NC1CCN(CC2CCCCC2)CC1	ZINC000853543654	EE	On-Demand	Anodyne	EPHX2	15	43
O=C(NCc1ccc2c(=O)cc[nH]c2c1)NC1CCN(CC2CCCCC2)CC1	ZINC000853543696	GG	On-Demand	Anodyne	CCR3	25	41
O=C(NCc1ccc2c(=O)cc[nH]c2c1)NC1CCN(CC2CCCCC2)CC1	ZINC000853543696	GG	On-Demand	Anodyne	MCHR1	19	44
O=C(NC1CCN(CC2CCCCC2)CC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853543724	FG	On-Demand	Anodyne	CPT1A	70	36
O=C(NC1CCN(CC2CCCCC2)CC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853543725	FG	On-Demand	Anodyne	CPT1A	70	36
Cn1ncc2c(=O)n(CN3CC[C@@H]3c3ccc(F)cc3)nnc21	ZINC000853543765	DD	On-Demand	Anodyne	Q9M629_MAIZE	68	38
Cn1ncc2c(=O)n(CN3CC[C@H]3c3ccc(F)cc3)nnc21	ZINC000853543766	DD	On-Demand	Anodyne	Q9M629_MAIZE	68	38
CC(C)(O)CONc1ncnc2c1ncn2-c1ccccc1	ZINC000853543856	CD	On-Demand	Anodyne	GRM1	17	41
C#CCCCOc1cccnc1N1CCC(Oc2ncccc2F)CC1	ZINC000853543905	FG	On-Demand	Mild	DCK	42	37
CC(C)(C)N1C[C@@H](CNC(=O)NC2CCN(CC3CCCCC3)CC2)CC1=O	ZINC000853543989	GF	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)N1C[C@H](CNC(=O)NC2CCN(CC3CCCCC3)CC2)CC1=O	ZINC000853543992	GF	On-Demand	Anodyne	CACNA1I	42	34
COc1cc2c(cc1OC)N(CN1CC[C@H]1c1ccc(F)cc1)C(=O)C2=O	ZINC000853544019	FF	On-Demand	Anodyne	CASP7	52	38
COc1cc2c(cc1OC)N(CN1CC[C@@H]1c1ccc(F)cc1)C(=O)C2=O	ZINC000853544021	FF	On-Demand	Anodyne	CASP7	52	38
CON(C)CCNC(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000853544024	ED	On-Demand	Anodyne	EPHX2	18	45
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853544054	GG	On-Demand	Anodyne	CHRM1	18	49
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853544054	GG	On-Demand	Anodyne	SIGMAR1	39	41
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853544054	GG	On-Demand	Anodyne	CACNA1B	16	42
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853544054	GG	On-Demand	Anodyne	CCR5	50	38
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853544054	GG	On-Demand	Anodyne	C3AR1	40	39
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853544054	GG	On-Demand	Anodyne	REN	41	34
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853544055	GG	On-Demand	Anodyne	CHRM1	18	49
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853544055	GG	On-Demand	Anodyne	SIGMAR1	39	41
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853544055	GG	On-Demand	Anodyne	CACNA1B	16	42
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853544055	GG	On-Demand	Anodyne	CCR5	50	38
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853544055	GG	On-Demand	Anodyne	C3AR1	40	39
CN(C(=O)NC1CCN(CC2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853544055	GG	On-Demand	Anodyne	REN	41	34
CNC(=O)c1nn(CN2CC[C@H]2c2ccc(F)cc2)c(=O)c2ccccc12	ZINC000853544060	FE	On-Demand	Anodyne	HRH1	23	43
CNC(=O)c1nn(CN2CC[C@@H]2c2ccc(F)cc2)c(=O)c2ccccc12	ZINC000853544061	FE	On-Demand	Anodyne	HRH1	23	43
CC[C@@H](O)CNC(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000853544069	DE	On-Demand	Anodyne	EPHX2	24	45
O=C(NCC1(O)CCC(F)(F)CC1)NC1CCN(CC2CCCCC2)CC1	ZINC000853544118	GG	On-Demand	Anodyne	EPHX2	25	45
COC(=O)c1cccc(NNC(=O)NCCN2Cc3ccccc3C2)c1C	ZINC000853544132	FE	On-Demand	Reactive	DRD4	41	32
COC(=O)c1cccc(NNC(=O)NCCN2Cc3ccccc3C2)c1C	ZINC000853544132	FE	On-Demand	Reactive	DRD3	17	41
O=C(NC1CCN(CC2CCCCC2)CC1)NC1CC(CO)C1	ZINC000853544142	DE	On-Demand	Anodyne	EPHX2	18	49
Nc1nccc([C@@H]2CCCN(c3cc(F)ncn3)C2)n1	ZINC000853544290	CD	On-Demand	Anodyne	HRH4	32	41
Nc1nccc([C@H]2CCCN(c3cc(F)ncn3)C2)n1	ZINC000853544291	CD	On-Demand	Anodyne	HRH4	32	41
Fc1cnc(N2CCC(Oc3ncccc3F)CC2)cn1	ZINC000853544319	CE	On-Demand	Anodyne	DCK	51	38
Fc1cc(N2CCC[C@H](Oc3ncccc3F)C2)ncn1	ZINC000853544481	CE	On-Demand	Anodyne	DCK	48	38
Fc1cc(N2CCC[C@@H](Oc3ncccc3F)C2)ncn1	ZINC000853544482	CE	On-Demand	Anodyne	DCK	48	38
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544483	FE	On-Demand	Anodyne	ACE	36	40
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544483	FE	On-Demand	Anodyne	DRD4	15	40
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544483	FE	On-Demand	Anodyne	MME	23	40
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544483	FE	On-Demand	Anodyne	SIGMAR1	27	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544484	FE	On-Demand	Anodyne	ACE	36	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544484	FE	On-Demand	Anodyne	DRD4	15	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544484	FE	On-Demand	Anodyne	MME	23	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544484	FE	On-Demand	Anodyne	SIGMAR1	27	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544485	FE	On-Demand	Anodyne	ACE	36	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544485	FE	On-Demand	Anodyne	DRD4	15	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544485	FE	On-Demand	Anodyne	MME	23	40
O=C(N[C@@H]1CCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544485	FE	On-Demand	Anodyne	SIGMAR1	27	40
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544486	FE	On-Demand	Anodyne	ACE	36	40
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544486	FE	On-Demand	Anodyne	DRD4	15	40
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544486	FE	On-Demand	Anodyne	MME	23	40
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000853544486	FE	On-Demand	Anodyne	SIGMAR1	27	40
Fc1cc(N2CCC(Oc3ncccc3F)CC2)ncn1	ZINC000853544505	CE	On-Demand	Anodyne	DCK	65	47
Fc1cc(N2CCC(Oc3ncccc3F)CC2)ncn1	ZINC000853544505	CE	On-Demand	Anodyne	SCN5A	43	39
C[C@@H](CCNC(=O)NC1CCN(CC2CCCCC2)CC1)N(C)C	ZINC000853544571	EF	On-Demand	Anodyne	EPHX2	17	43
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1CC[C@H]1c1ccc(F)cc1	ZINC000853544589	FF	On-Demand	Anodyne	GHRL	66	33
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1CC[C@@H]1c1ccc(F)cc1	ZINC000853544590	FF	On-Demand	Anodyne	GHRL	66	33
COCC1(NC(=O)NC2CCN(CC3CCCCC3)CC2)CCCC1	ZINC000853544607	FG	On-Demand	Anodyne	EPHX2	23	41
O=C1C(=O)N(CN2CC[C@H]2c2ccc(F)cc2)C(=O)N1Cc1ccccc1	ZINC000853544635	FF	On-Demand	Anodyne	SIGMAR1	22	40
O=C1C(=O)N(CN2CC[C@@H]2c2ccc(F)cc2)C(=O)N1Cc1ccccc1	ZINC000853544636	FF	On-Demand	Anodyne	SIGMAR1	22	40
CC(C)c1ccc2ncnc(NOCC(C)(C)O)c2c1	ZINC000853544660	CF	On-Demand	Anodyne	CLK4	55	37
C[C@@H](CNC(=O)NC1CCN(CC2CCCCC2)CC1)c1ccccn1	ZINC000853544713	FH	On-Demand	Anodyne	SIGMAR1	17	40
C[C@@H](CNC(=O)NC1CCN(CC2CCCCC2)CC1)c1ccccn1	ZINC000853544713	FH	On-Demand	Anodyne	EPHX2	33	48
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853544756	FH	On-Demand	Anodyne	DRD4	16	44
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853544756	FH	On-Demand	Anodyne	OPRL1	15	40
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853544756	FH	On-Demand	Anodyne	SIGMAR1	28	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853544756	FH	On-Demand	Anodyne	EPHX2	30	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544757	FH	On-Demand	Anodyne	DRD4	16	44
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544757	FH	On-Demand	Anodyne	OPRL1	15	40
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544757	FH	On-Demand	Anodyne	SIGMAR1	28	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853544757	FH	On-Demand	Anodyne	EPHX2	30	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544758	FH	On-Demand	Anodyne	DRD4	16	44
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544758	FH	On-Demand	Anodyne	OPRL1	15	40
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544758	FH	On-Demand	Anodyne	SIGMAR1	28	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853544758	FH	On-Demand	Anodyne	EPHX2	30	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853544759	FH	On-Demand	Anodyne	DRD4	16	44
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853544759	FH	On-Demand	Anodyne	OPRL1	15	40
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853544759	FH	On-Demand	Anodyne	SIGMAR1	28	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853544759	FH	On-Demand	Anodyne	EPHX2	30	41
O=C1N(CN2CC[C@H]2c2ccc(F)cc2)[C@@H](c2ccccc2)C12CCC2	ZINC000853544789	FI	On-Demand	Anodyne	SLC6A9	22	40
O=C1N(CN2CC[C@@H]2c2ccc(F)cc2)[C@@H](c2ccccc2)C12CCC2	ZINC000853544790	FI	On-Demand	Anodyne	SLC6A9	22	40
O=C1N(CN2CC[C@H]2c2ccc(F)cc2)[C@H](c2ccccc2)C12CCC2	ZINC000853544791	FI	On-Demand	Anodyne	SLC6A9	22	40
O=C1N(CN2CC[C@@H]2c2ccc(F)cc2)[C@H](c2ccccc2)C12CCC2	ZINC000853544792	FI	On-Demand	Anodyne	SLC6A9	22	40
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]1c1ccc(F)cc1	ZINC000853544837	GF	On-Demand	Anodyne	SIGMAR1	45	43
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]1c1ccc(F)cc1	ZINC000853544838	GF	On-Demand	Anodyne	SIGMAR1	45	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(CC3CCCCC3)CC2)C1	ZINC000853544882	FE	On-Demand	Anodyne	EPHX2	28	50
Fc1ncnc(N2CCC(Oc3cnccn3)CC2)c1Br	ZINC000853544910	FE	On-Demand	Anodyne	DCK	43	40
N#Cc1ncc(Br)cc1N1CCC(Oc2ncccc2F)CC1	ZINC000853544938	GG	On-Demand	Mild	DCK	45	38
C#Cc1cccnc1N1CCC(Oc2ncccc2F)CC1	ZINC000853544962	CF	On-Demand	Mild	DCK	41	40
COc1ccccc1-c1csc([C@@H]2CCCN(c3cc(F)ncn3)C2)n1	ZINC000853544972	FI	On-Demand	Anodyne	PDE3A	17	40
COc1ccccc1-c1csc([C@@H]2CCCN(c3cc(F)ncn3)C2)n1	ZINC000853544972	FI	On-Demand	Anodyne	DCK	35	40
COc1ccccc1-c1csc([C@H]2CCCN(c3cc(F)ncn3)C2)n1	ZINC000853544973	FI	On-Demand	Anodyne	PDE3A	17	40
COc1ccccc1-c1csc([C@H]2CCCN(c3cc(F)ncn3)C2)n1	ZINC000853544973	FI	On-Demand	Anodyne	DCK	35	40
Fc1cccnc1OC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853544977	FF	On-Demand	Anodyne	DCK	50	44
Fc1cccnc1OC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853544977	FF	On-Demand	Anodyne	SCN5A	67	43
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853545012	DD	On-Demand	Anodyne	EPHX2	22	50
Fc1cccnc1O[C@@H]1CCCN(c2ncnc(F)c2Br)C1	ZINC000853545103	FF	On-Demand	Anodyne	PDE3B	43	36
Fc1cccnc1O[C@H]1CCCN(c2ncnc(F)c2Br)C1	ZINC000853545104	FF	On-Demand	Anodyne	PDE3B	43	36
C#CCCN(CCOC)C(=O)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000853545129	GF	On-Demand	Mild	LTA4H	23	41
COCCOC(=O)CSc1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl	ZINC000853545139	FE	On-Demand	Bother	GSTM2	41	38
COCCOC(=O)CSc1ccc([N+](=O)[O-])c(C(=O)OC)c1Cl	ZINC000853545139	FE	On-Demand	Bother	CACNA1D	44	39
COC(=O)c1cn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nn1	ZINC000853545140	EE	On-Demand	Anodyne	KCNH2	47	45
COC(=O)c1cn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nn1	ZINC000853545140	EE	On-Demand	Anodyne	GLRA1	43	33
N#CCCNc1nc(C(F)F)nc2ccc(F)cc12	ZINC000853545148	CG	On-Demand	Mild	PIK3CD	18	40
S=c1n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nc2ccccn12	ZINC000853545158	FH	On-Demand	Anodyne	KCNH2	40	39
Fc1cc(N[C@@H]2CCN(c3cccc(Br)c3)C2)ncn1	ZINC000853545164	EG	On-Demand	Anodyne	HRH4	26	45
Fc1cc(N[C@H]2CCN(c3cccc(Br)c3)C2)ncn1	ZINC000853545165	EG	On-Demand	Anodyne	HRH4	26	45
S=c1c2ccccc2nnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545169	GI	On-Demand	Anodyne	KCNH2	42	41
CCCC[C@@H]1NC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853545175	FG	On-Demand	Anodyne	KCNH2	41	40
CCCC[C@H]1NC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853545176	FG	On-Demand	Anodyne	KCNH2	41	40
S=C1OCCN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545179	DF	On-Demand	Anodyne	KCNH2	43	42
O=C1C[C@@]2(CCSC2)C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545209	GF	On-Demand	Anodyne	KCNH2	42	39
O=C1C[C@]2(CCSC2)C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545210	GF	On-Demand	Anodyne	KCNH2	42	39
Cc1ccc(N2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)nn1	ZINC000853545218	EH	On-Demand	Anodyne	OPRL1	17	45
O=[N+]([O-])c1ccnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545225	EF	On-Demand	Bother	KCNH2	42	40
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@H]1c1ccc(F)cc1	ZINC000853545276	EE	On-Demand	Anodyne	CHRNA7	19	53
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H]1c1ccc(F)cc1	ZINC000853545277	EE	On-Demand	Anodyne	CHRNA7	19	53
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@@H]1c1ccc(F)cc1	ZINC000853545278	EE	On-Demand	Anodyne	CHRNA7	19	53
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H]1c1ccc(F)cc1	ZINC000853545279	EE	On-Demand	Anodyne	CHRNA7	19	53
CON(C)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000853545280	CC	On-Demand	Anodyne	HTR1A	20	41
CON(C)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000853545280	CC	On-Demand	Anodyne	DRD2	17	42
CON(C)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000853545280	CC	On-Demand	Anodyne	DRD4	43	35
CON(C)CCNC(=O)NCCN1Cc2ccccc2C1	ZINC000853545280	CC	On-Demand	Anodyne	DRD3	30	42
COc1cc(N2CCC(Oc3ncccc3F)CC2)c([N+](=O)[O-])cc1C	ZINC000853545300	FG	On-Demand	Bother	DCK	43	34
C[C@H](C#N)N(CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21)C1CC1	ZINC000853545332	FE	On-Demand	Mild	CHRM5	15	41
C[C@@H](C#N)N(CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21)C1CC1	ZINC000853545333	FE	On-Demand	Mild	CHRM5	15	41
O=C1SCCN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545430	DG	On-Demand	Anodyne	KCNH2	44	42
O=c1oc(-c2ccccc2)nn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545432	GH	On-Demand	Anodyne	KCNH2	42	40
Brc1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853545439	FH	On-Demand	Anodyne	KCNH2	41	40
O=C1CCCN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545447	DF	On-Demand	Anodyne	KCNH2	44	43
Fc1cnc(N[C@@H]2CCN(c3cccc(Br)c3)C2)cn1	ZINC000853545460	EG	On-Demand	Anodyne	HRH4	25	42
Fc1cnc(N[C@H]2CCN(c3cccc(Br)c3)C2)cn1	ZINC000853545461	EG	On-Demand	Anodyne	HRH4	25	42
O=C1[C@H]2CC=CC[C@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545482	FF	On-Demand	Anodyne	KCNH2	44	43
O=C1[C@H]2CC=CC[C@@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545485	FF	On-Demand	Anodyne	KCNH2	44	43
O=C1[C@@H]2CC=CC[C@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545487	FF	On-Demand	Anodyne	KCNH2	44	43
CON(C)CCNC(=O)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000853545491	FE	On-Demand	Anodyne	LTA4H	18	42
COCCN(Cc1scnc1C)c1cc(Cl)nc2cc(C)nn12	ZINC000853545522	FG	On-Demand	Anodyne	CRHR1	15	41
Cn1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1=S	ZINC000853545544	EF	On-Demand	Anodyne	KCNH2	42	43
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1CCc2ccc(O)cc21	ZINC000853545564	FH	On-Demand	Anodyne	OPRK1	18	42
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853545565	FH	On-Demand	Anodyne	OPRK1	18	42
C[C@@H](C#N)N(CN1C(=O)C(=O)c2cc(-c3ccccc3)ccc21)C1CC1	ZINC000853545624	EG	On-Demand	Mild	ALDH1A1	49	35
C[C@H](C#N)N(CN1C(=O)C(=O)c2cc(-c3ccccc3)ccc21)C1CC1	ZINC000853545625	EG	On-Demand	Mild	ALDH1A1	49	35
Cn1c(=O)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c2cnccc21	ZINC000853545765	FF	On-Demand	Anodyne	KCNH2	41	42
O=C1CC2(CCC2)C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545796	FF	On-Demand	Anodyne	KCNH2	41	40
CC[C@]1(C)CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853545799	FG	On-Demand	Anodyne	KCNH2	42	41
Cn1cncc1[C@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853545819	GF	On-Demand	Anodyne	KCNH2	41	41
Cn1cncc1[C@@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853545821	GF	On-Demand	Anodyne	KCNH2	41	41
O=C1c2cc(F)ccc2CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545824	FH	On-Demand	Anodyne	KCNH2	41	40
CC(C)[C@H]1CCN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853545857	EH	On-Demand	Anodyne	KCNH2	43	42
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	GRIN2B	45	44
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	CTSB	26	41
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	CTSK	22	41
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	CAPN2	68	38
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	TGM2	32	46
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	NPR	46	32
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	F13A1	22	46
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	SIRT3	52	36
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	SIRT2	45	32
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	SIRT1	45	32
O=C(NCC1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853545865	EF	On-Demand	Anodyne	SLC12A5	51	34
O=C1[C@@H]2CCC[C@@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545911	EG	On-Demand	Anodyne	KCNH2	43	42
O=C1C(=O)N(C2CCCC2)C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545959	GF	On-Demand	Anodyne	KCNH2	42	41
S=C1SCCN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545964	EG	On-Demand	Anodyne	KCNH2	42	41
O=C1C[C@H](c2ccccc2F)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545987	GI	On-Demand	Anodyne	KCNH2	42	40
O=C1C[C@@H](c2ccccc2F)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853545990	GI	On-Demand	Anodyne	KCNH2	42	40
COC(=O)[C@@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853545996	FE	On-Demand	Anodyne	SLC6A3	35	43
COC(=O)[C@@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853545996	FE	On-Demand	Anodyne	KCNH2	46	45
Cc1ccn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c(=O)c1C#N	ZINC000853545999	EG	On-Demand	Mild	KCNH2	44	42
O=c1oc2ccccc2n1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546011	FH	On-Demand	Anodyne	KCNH2	45	43
O=c1c2ccccc2sn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546016	FI	On-Demand	Anodyne	KCNH2	43	41
O=C1[C@H]2CCCCC[C@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546026	FH	On-Demand	Anodyne	KCNH2	43	42
O=C1[C@@H]2CCCCC[C@@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546028	FH	On-Demand	Anodyne	KCNH2	43	42
O=C1[C@H]2CCCCC[C@@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546031	FH	On-Demand	Anodyne	KCNH2	43	42
C#CCCN(CCOC)C(=O)NCCN1Cc2ccccc2C1	ZINC000853546047	DD	On-Demand	Mild	HTR1A	20	40
C#CCCN(CCOC)C(=O)NCCN1Cc2ccccc2C1	ZINC000853546047	DD	On-Demand	Mild	DRD2	23	40
C#CCCN(CCOC)C(=O)NCCN1Cc2ccccc2C1	ZINC000853546047	DD	On-Demand	Mild	DRD4	44	36
C#CCCN(CCOC)C(=O)NCCN1Cc2ccccc2C1	ZINC000853546047	DD	On-Demand	Mild	DRD3	41	38
O=C1C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c2ccccc21	ZINC000853546061	FG	On-Demand	Anodyne	KCNH2	43	42
O=C1C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c2ccccc21	ZINC000853546061	FG	On-Demand	Anodyne	ALDH1A1	62	45
O=C1C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c2ccccc21	ZINC000853546061	FG	On-Demand	Anodyne	ALDH3A1	42	46
O=C1C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c2ccccc21	ZINC000853546061	FG	On-Demand	Anodyne	CES1	17	42
CN1C(=O)C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853546078	ED	On-Demand	Anodyne	KCNH2	45	46
CN1C(=O)C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853546078	ED	On-Demand	Anodyne	GLRA1	41	31
S=c1ncccn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546088	EH	On-Demand	Anodyne	KCNH2	40	39
O=C1C[C@H](c2ccccc2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546091	FH	On-Demand	Anodyne	KCNH2	44	42
O=C1C[C@@H](c2ccccc2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546093	FH	On-Demand	Anodyne	KCNH2	44	42
COCCN(CCF)C(=O)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000853546126	GF	On-Demand	Anodyne	LTA4H	27	45
O=[N+]([O-])c1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853546130	EF	On-Demand	Bother	KCNH2	40	39
O=C1[C@@H]2CCCCC[C@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546180	FH	On-Demand	Anodyne	KCNH2	43	42
O=C1[C@H]2CC[C@@H](C2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546203	EG	On-Demand	Anodyne	KCNH2	47	46
O=C(NCC(O)(C1CC1)C1CC1)NC1CCN(CC2CCCCC2)CC1	ZINC000853546213	FF	On-Demand	Anodyne	EPHX2	16	42
O=c1oc2ccc(F)cc2n1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546227	FH	On-Demand	Anodyne	KCNH2	41	39
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	GRIN2B	34	44
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	CAPNS1	56	32
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	GHSR	23	40
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	CAPN1	53	39
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	CAPN2	88	39
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	TGM2	22	43
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	NPR	57	32
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	SIRT3	88	41
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	SIRT2	73	39
Cn1nnc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)ncnc21	ZINC000853546231	GD	On-Demand	Anodyne	SIRT1	65	39
O=C1CC2(CCCC2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546306	FH	On-Demand	Anodyne	KCNH2	42	40
O=C(NCCc1nnc(S)n1C1CC1)NCCN1Cc2ccccc2C1	ZINC000853546315	FD	On-Demand	Anodyne	PLD1	56	37
O=C(NCCc1nnc(S)n1C1CC1)NCCN1Cc2ccccc2C1	ZINC000853546315	FD	On-Demand	Anodyne	PLD2	46	37
c1ccc(OC2C[C@@H]3CC[C@H](C2)N3Cn2cnnc2)cc1	ZINC000853546320	CE	On-Demand	Anodyne	KCNH2	46	44
c1ccc(OC2C[C@@H]3CC[C@H](C2)N3Cn2cnc(-c3ccccn3)n2)cc1	ZINC000853546338	FG	On-Demand	Anodyne	KCNH2	43	42
COC(=O)c1ccc(=O)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853546343	FE	On-Demand	Anodyne	SLC6A3	22	46
COC(=O)c1ccc(=O)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853546343	FE	On-Demand	Anodyne	KCNH2	45	45
COC(=O)c1ccc(=O)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853546343	FE	On-Demand	Anodyne	GLRA1	45	35
COC(=O)c1ccc(=O)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853546343	FE	On-Demand	Anodyne	ACHP_LYMST	24	42
COC(=O)c1ccc(=O)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853546343	FE	On-Demand	Anodyne	Q8WSF8_APLCA	31	42
c1ccc(OC2C[C@@H]3CC[C@H](C2)N3Cn2cnc(-c3ccccc3)n2)cc1	ZINC000853546355	FH	On-Demand	Anodyne	KCNH2	43	42
Fc1cc(N2CCC(Oc3cnccn3)CC2)ncn1	ZINC000853546356	CD	On-Demand	Anodyne	DCK	59	45
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21	ZINC000853546371	GH	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21	ZINC000853546371	GH	On-Demand	Anodyne	CCR3	44	49
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21	ZINC000853546371	GH	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853546373	GH	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853546373	GH	On-Demand	Anodyne	CCR3	44	49
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853546373	GH	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853546374	GH	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853546374	GH	On-Demand	Anodyne	CCR3	44	49
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853546374	GH	On-Demand	Anodyne	EPHX2	15	40
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21	ZINC000853546376	GH	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21	ZINC000853546376	GH	On-Demand	Anodyne	CCR3	44	49
O=C(NC1CCN(CC2CCCCC2)CC1)N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21	ZINC000853546376	GH	On-Demand	Anodyne	EPHX2	15	40
Nc1cccc2c1C(=O)N(CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)C2=O	ZINC000853546393	GF	On-Demand	Anodyne	KCNH2	45	44
Cn1ncc2c(=O)n(CN3[C@H]4CC[C@H]3CC(Oc3ccccc3)C4)nnc21	ZINC000853546419	FD	On-Demand	Anodyne	KCNH2	42	42
Cn1ncc2c(=O)n(CN3[C@H]4CC[C@H]3CC(Oc3ccccc3)C4)nnc21	ZINC000853546419	FD	On-Demand	Anodyne	Q9M629_MAIZE	53	33
O=c1cc2c(nn1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)-c1ccccc1C2	ZINC000853546422	GH	On-Demand	Anodyne	KCNH2	41	39
O=C1[C@@H]2[C@@H](C(=O)N1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)[C@H]1C=C[C@H]2CC1	ZINC000853546425	GG	On-Demand	Anodyne	KCNH2	46	45
O=C1[C@@H]2[C@@H](C(=O)N1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)[C@H]1C=C[C@H]2CC1	ZINC000853546425	GG	On-Demand	Anodyne	GLRA1	41	31
O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546426	GG	On-Demand	Anodyne	KCNH2	46	45
O=C1[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546426	GG	On-Demand	Anodyne	GLRA1	41	31
O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546427	GG	On-Demand	Anodyne	KCNH2	46	45
O=C1[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546427	GG	On-Demand	Anodyne	GLRA1	41	31
COCCOC(=O)CSc1c(Cl)cncc1[N+](=O)[O-]	ZINC000853546457	DD	On-Demand	Bother	USP7	48	41
COCCOC(=O)CSc1c(Cl)cncc1[N+](=O)[O-]	ZINC000853546457	DD	On-Demand	Bother	USP47	60	41
O=[N+]([O-])c1ccc2c(cnn2CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853546459	GH	On-Demand	Bother	F2RL3	47	33
CCN1CCC[C@H](CN(C)CN2C(=O)C(=O)c3ccccc32)[C@@H]1c1cnn(C)c1	ZINC000853546523	GE	On-Demand	Anodyne	ALDH1A1	38	40
CCN1CCC[C@H](CN(C)CN2C(=O)C(=O)c3ccccc32)[C@@H]1c1cnn(C)c1	ZINC000853546523	GE	On-Demand	Anodyne	ALDH3A1	33	40
CCN1CCC[C@H](CN(C)CN2C(=O)C(=O)c3ccccc32)[C@H]1c1cnn(C)c1	ZINC000853546524	GE	On-Demand	Anodyne	ALDH1A1	38	40
CCN1CCC[C@H](CN(C)CN2C(=O)C(=O)c3ccccc32)[C@H]1c1cnn(C)c1	ZINC000853546524	GE	On-Demand	Anodyne	ALDH3A1	33	40
O=c1c(Cl)c(Cl)cnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546543	GH	On-Demand	Anodyne	KCNH2	42	43
O=c1c(Cl)c(Cl)cnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546543	GH	On-Demand	Anodyne	NPBWR1	53	37
COC(=O)c1nccc(N2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1	ZINC000853546576	GG	On-Demand	Anodyne	SORD	71	37
COc1ccc(-c2nnn(CN(C3CC3)[C@H](C)C#N)n2)cc1OC	ZINC000853546629	ED	On-Demand	Mild	SCARB1	39	48
COc1ccc(-c2nnn(CN(C3CC3)[C@@H](C)C#N)n2)cc1OC	ZINC000853546630	ED	On-Demand	Mild	SCARB1	39	48
C=CCN1CCN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853546654	EF	On-Demand	Mild	KCNH2	42	41
OCc1nn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c(=S)n1C1CC1	ZINC000853546660	GG	On-Demand	Anodyne	KCNH2	41	40
O=C1C[C@@H](C(F)F)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546679	FG	On-Demand	Anodyne	KCNH2	41	40
O=C1C[C@H](C(F)F)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546680	FG	On-Demand	Anodyne	KCNH2	41	40
O=C1C[C@H](O)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546686	DD	On-Demand	Anodyne	KCNH2	45	44
O=C1C[C@@H](O)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546687	DD	On-Demand	Anodyne	KCNH2	45	44
Cc1cc(C(F)(F)F)c(=O)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853546692	GH	On-Demand	Anodyne	KCNH2	43	40
O=C1C[C@H](c2ccccn2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546717	GG	On-Demand	Anodyne	KCNH2	41	40
O=C1C[C@@H](c2ccccn2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546718	GG	On-Demand	Anodyne	KCNH2	41	40
COC(=O)c1c([N+](=O)[O-])ccc(SCCSCCO)c1Cl	ZINC000853546728	FF	On-Demand	Bother	GSTM2	61	41
O=c1ccc(C(F)(F)F)nn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546737	GG	On-Demand	Anodyne	KCNH2	41	40
C[C@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853546738	DF	On-Demand	Anodyne	KCNH2	44	43
C[C@@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853546740	DF	On-Demand	Anodyne	KCNH2	44	43
CCCn1c(CO)nn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1=S	ZINC000853546752	GG	On-Demand	Anodyne	KCNH2	36	40
O=C1CC(F)(F)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546755	EF	On-Demand	Anodyne	KCNH2	42	42
C[C@H]1CCc2c(sc(=O)n2CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853546891	GI	On-Demand	Anodyne	KCNH2	43	42
COC[C@@]1(C)CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853546909	FF	On-Demand	Anodyne	KCNH2	41	40
COC[C@]1(C)CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853546911	FF	On-Demand	Anodyne	KCNH2	41	40
O=C1c2nccnc2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546912	FE	On-Demand	Anodyne	KCNH2	43	42
CCC[C@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853546936	EH	On-Demand	Anodyne	KCNH2	42	40
CCC[C@@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853546938	EH	On-Demand	Anodyne	KCNH2	42	40
O=C1NC(C2CC2)(C2CC2)C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546945	GG	On-Demand	Anodyne	KCNH2	42	40
CCOc1ccc(-c2nnn(CN(C3CC3)[C@H](C)C#N)n2)cc1	ZINC000853546974	DE	On-Demand	Mild	CACNA2D2	50	31
CCOc1ccc(-c2nnn(CN(C3CC3)[C@@H](C)C#N)n2)cc1	ZINC000853546978	DE	On-Demand	Mild	CACNA2D2	50	31
O=C1c2cc(F)c(F)cc2CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853546980	GH	On-Demand	Anodyne	KCNH2	42	41
Cc1cc(C)c2c(=O)n(CN3[C@H]4CC[C@H]3CC(Oc3ccccc3)C4)sc2n1	ZINC000853546988	GI	On-Demand	Anodyne	KCNH2	44	41
O=C(NCc1ncccn1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000853547050	FF	On-Demand	Anodyne	LTA4H	26	41
S=c1scnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547056	EH	On-Demand	Anodyne	KCNH2	42	40
O=C1NC2(CCCCC2)C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547062	GG	On-Demand	Anodyne	KCNH2	42	40
Oc1ccc2ccncc2c1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547069	FJ	On-Demand	Clean	KCNH2	43	44
Cc1cc(C)n2c(=S)n(CN3[C@H]4CC[C@H]3CC(Oc3ccccc3)C4)nc2n1	ZINC000853547080	GH	On-Demand	Anodyne	KCNH2	40	38
O=C1c2ccccc2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547087	FG	On-Demand	Anodyne	KCNH2	46	45
O=C1c2ccccc2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547087	FG	On-Demand	Anodyne	ACHP_LYMST	27	40
O=C1c2ccccc2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547087	FG	On-Demand	Anodyne	Q8WSF8_APLCA	30	40
Oc1cc2c(cc1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)OCO2	ZINC000853547100	FH	On-Demand	Clean	KCNH2	51	54
O=c1c2ccccc2cnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547101	FG	On-Demand	Anodyne	KCNH2	41	40
OCc1cc(N2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)ncc1F	ZINC000853547108	GH	On-Demand	Anodyne	OPRL1	17	40
CC(=O)c1ccnc(N2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)c1	ZINC000853547111	FI	On-Demand	Anodyne	PRNP	60	33
CC(=O)c1ccnc(N2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)c1	ZINC000853547111	FI	On-Demand	Anodyne	SORD	48	34
O=c1sc2c(n1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)CCCC2	ZINC000853547130	FH	On-Demand	Anodyne	KCNH2	42	41
Cc1cc(CO)cc(N2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1	ZINC000853547134	FI	On-Demand	Anodyne	OPRL1	15	40
Cc1cc(CO)cc(N2CCC(O)(c3ccc(-c4ccccc4)cc3)CC2)n1	ZINC000853547134	FI	On-Demand	Anodyne	SORD	44	42
O=c1n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nnn1C1CC1	ZINC000853547162	ED	On-Demand	Anodyne	KCNH2	44	43
O=c1cc2c(nn1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)CCCC2	ZINC000853547172	FG	On-Demand	Anodyne	KCNH2	46	44
C[C@@H](C#N)N(CN1C[C@@]2(CN3CCC2CC3)OC1=O)C1CC1	ZINC000853547178	DD	On-Demand	Mild	CHRNA7	16	57
C[C@@H](C#N)N(CN1C[C@]2(CN3CCC2CC3)OC1=O)C1CC1	ZINC000853547183	DD	On-Demand	Mild	CHRNA7	16	57
C[C@H](C#N)N(CN1C[C@@]2(CN3CCC2CC3)OC1=O)C1CC1	ZINC000853547185	DD	On-Demand	Mild	CHRNA7	16	57
C[C@H](C#N)N(CN1C[C@]2(CN3CCC2CC3)OC1=O)C1CC1	ZINC000853547187	DD	On-Demand	Mild	CHRNA7	16	57
O=c1n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nc2n1CCCC2	ZINC000853547247	FE	On-Demand	Anodyne	KCNH2	41	38
N#Cc1c2c(cn(CN3[C@H]4CC[C@H]3CC(Oc3ccccc3)C4)c1=O)CCC2	ZINC000853547251	GG	On-Demand	Mild	KCNH2	43	41
O=C1[C@H]2CCC[C@H]2CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547303	EG	On-Demand	Anodyne	KCNH2	42	40
O=C1[C@@H]2CCC[C@@H]2CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547305	EG	On-Demand	Anodyne	KCNH2	42	40
O=C1[C@@H]2CCC[C@H]2CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547307	EG	On-Demand	Anodyne	KCNH2	42	40
O=C1[C@H]2CCC[C@@H]2CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547309	EG	On-Demand	Anodyne	KCNH2	42	40
Cc1nnc(-c2cccc(C#N)c2)n1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547338	GI	On-Demand	Mild	KCNH2	45	42
O=C1[C@@H](C2CC2)[C@H](C2CC2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547414	FH	On-Demand	Anodyne	KCNH2	43	42
O=C1[C@H](C2CC2)[C@H](C2CC2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547416	FH	On-Demand	Anodyne	KCNH2	43	42
O=C1[C@H](C2CC2)[C@@H](C2CC2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547418	FH	On-Demand	Anodyne	KCNH2	43	42
O=C1[C@@H](C2CC2)[C@@H](C2CC2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547421	FH	On-Demand	Anodyne	KCNH2	43	42
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCc2ccc3ccccc3n2)C1	ZINC000853547434	GG	On-Demand	Anodyne	CYSLTR1	24	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCc2ccc3ccccc3n2)C1	ZINC000853547440	GG	On-Demand	Anodyne	CYSLTR1	24	40
O=C1CC2(CCCC2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547455	EH	On-Demand	Anodyne	KCNH2	43	41
O=c1oc(-c2cccs2)nn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547471	GH	On-Demand	Anodyne	KCNH2	37	43
O=C(NCC1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000853547488	GF	On-Demand	Bother	GRIN2B	39	44
O=C(NCC1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000853547488	GF	On-Demand	Bother	TGM2	28	45
O=C(NCC1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000853547488	GF	On-Demand	Bother	F13A1	22	45
O=C(NCC1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1)OCc1ccccc1	ZINC000853547488	GF	On-Demand	Bother	SLC12A5	50	34
C[C@@H](C#N)N(CN1C(=O)C[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853547530	DD	On-Demand	Mild	GALR1	44	33
C[C@H](C#N)N(CN1C(=O)C[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853547532	DD	On-Demand	Mild	GALR1	44	33
C[C@H](C#N)N(CN1C(=O)C[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853547534	DD	On-Demand	Mild	GALR1	44	33
C[C@@H](C#N)N(CN1C(=O)C[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853547536	DD	On-Demand	Mild	GALR1	44	33
C[C@H](C#N)N(Cn1nnc2c(cnn2C)c1=O)C1CC1	ZINC000853547537	CB	On-Demand	Mild	Q9M629_MAIZE	54	36
C[C@@H](C#N)N(Cn1nnc2c(cnn2C)c1=O)C1CC1	ZINC000853547539	CB	On-Demand	Mild	Q9M629_MAIZE	54	36
Cn1ncnc1N1CCC(O)(c2ccc(-c3ccccc3)cc2)CC1	ZINC000853547547	EF	On-Demand	Anodyne	OPRL1	19	44
Cc1ccn(CN(C2CC2)[C@H](C)C#N)c(=O)c1C#N	ZINC000853547552	CD	On-Demand	Mild	GRM2	17	40
Cc1ccn(CN(C2CC2)[C@@H](C)C#N)c(=O)c1C#N	ZINC000853547553	CD	On-Demand	Mild	GRM2	17	40
O=c1ccc(-c2ccccc2)nn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547593	GH	On-Demand	Anodyne	KCNH2	42	41
CC(C)c1ccc2ncnc(NCCC#N)c2c1	ZINC000853547616	BG	On-Demand	Mild	CLK4	58	35
O=c1c2ccccc2nnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547623	FF	On-Demand	Anodyne	KCNH2	44	43
O=c1c2ccccc2nnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547623	FF	On-Demand	Anodyne	TNKS	49	35
O=C1CC2(CCCC2)C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547644	FG	On-Demand	Anodyne	KCNH2	41	40
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	GRIN2B	35	48
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	CTSB	22	41
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	CTSK	23	41
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	PREP	25	42
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	CAPN2	42	37
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	TGM2	31	45
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	NPR	47	31
C#Cc1cccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853547703	EG	On-Demand	Mild	F13A1	22	45
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	GRIN2B	29	42
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	KLK3	43	32
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	CTSB	40	38
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	CYSP_TRYCR	41	33
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	PREP	23	40
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	CAPNS1	53	35
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	CAPN1	60	41
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	CAPN2	100	41
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	TGM2	32	45
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	NPR	59	37
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	F13A1	20	45
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	SCD1	52	38
CCCc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nn1	ZINC000853547720	FH	On-Demand	Anodyne	SLC12A5	48	36
O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547728	FG	On-Demand	Anodyne	KCNH2	42	41
O=C1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547730	FG	On-Demand	Anodyne	KCNH2	42	41
O=C1[C@H]2[C@H]3CC[C@@H](C3)[C@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547732	FG	On-Demand	Anodyne	KCNH2	42	41
O=C1[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547735	FG	On-Demand	Anodyne	KCNH2	42	41
C[C@H]1C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)[C@@H]1c1ccccc1	ZINC000853547743	GI	On-Demand	Anodyne	KCNH2	43	42
C[C@H]1C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)[C@H]1c1ccccc1	ZINC000853547746	GI	On-Demand	Anodyne	KCNH2	43	42
N#Cc1c2c(cn(CN3[C@H]4CC[C@H]3CC(Oc3ccccc3)C4)c1=O)CCCC2	ZINC000853547779	GH	On-Demand	Mild	KCNH2	43	40
O=C1C[C@@H](c2cccc(F)c2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547782	GI	On-Demand	Anodyne	KCNH2	43	41
O=C1C[C@@H](c2cccc(F)c2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547782	GI	On-Demand	Anodyne	CCR5	43	35
O=C1C[C@H](c2cccc(F)c2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547783	GI	On-Demand	Anodyne	KCNH2	43	41
O=C1C[C@H](c2cccc(F)c2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547783	GI	On-Demand	Anodyne	CCR5	43	35
O=c1scc(C(F)(F)F)n1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547796	GH	On-Demand	Anodyne	KCNH2	41	39
O=C1C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c2c(F)cccc21	ZINC000853547809	GG	On-Demand	Anodyne	KCNH2	44	43
C[C@H](C#N)N(CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O)C1CC1	ZINC000853547810	FE	On-Demand	Mild	SIGMAR1	28	41
C[C@@H](C#N)N(CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O)C1CC1	ZINC000853547811	FE	On-Demand	Mild	SIGMAR1	28	41
O=C1C[C@H](C2CC2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547813	EG	On-Demand	Anodyne	KCNH2	43	42
O=C1C[C@@H](C2CC2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547814	EG	On-Demand	Anodyne	KCNH2	43	42
O=C1[C@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547844	GD	On-Demand	Anodyne	KCNH2	42	41
O=C1[C@H]2[C@H](C(=O)N1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)[C@H]1C=C[C@H]2O1	ZINC000853547846	GD	On-Demand	Anodyne	KCNH2	42	41
O=C1[C@@H]2[C@H]3C=C[C@@H](O3)[C@@H]2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547848	GD	On-Demand	Anodyne	KCNH2	42	41
CCOC(=O)c1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853547866	FG	On-Demand	Anodyne	KCNH2	50	47
CCOC(=O)c1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853547866	FG	On-Demand	Anodyne	GLRA1	44	37
CCOC(=O)c1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853547866	FG	On-Demand	Anodyne	ACHP_LYMST	27	41
CCOC(=O)c1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853547866	FG	On-Demand	Anodyne	Q8WSF8_APLCA	38	41
CON(C)CCNC(=O)NCCc1ccc2ccccc2n1	ZINC000853547882	DD	On-Demand	Anodyne	ALOX5	20	40
CON(C)CCNC(=O)NCCc1ccc2ccccc2n1	ZINC000853547882	DD	On-Demand	Anodyne	CYSLTR1	53	43
CON(C)CCNC(=O)NCCc1ccc2ccccc2n1	ZINC000853547882	DD	On-Demand	Anodyne	MTNR1A	48	42
N#Cc1cccn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1=O	ZINC000853547903	EF	On-Demand	Mild	KCNH2	46	44
O=C(NCC1SCCS1)NC1CCN(c2nc3ccccc3s2)CC1	ZINC000853547919	GG	On-Demand	Anodyne	LTA4H	15	40
COCCOC(=O)CSc1ncnc2c1ncn2-c1ccccc1	ZINC000853547920	EE	On-Demand	Anodyne	SLC29A1	50	35
S=c1n(C2CC2)cnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853547921	FH	On-Demand	Anodyne	KCNH2	41	40
O=c1n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nc2ccccn12	ZINC000853547933	FF	On-Demand	Anodyne	KCNH2	41	40
COC(=O)c1nn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c(C)c1Cl	ZINC000853547941	GH	On-Demand	Anodyne	KCNH2	45	43
COC(=O)c1nn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c(C)c1Cl	ZINC000853547941	GH	On-Demand	Anodyne	GLRA1	42	32
CO[C@@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853547955	EE	On-Demand	Anodyne	KCNH2	43	42
CC(C)CN1C(=O)C(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853548010	GE	On-Demand	Anodyne	KCNH2	43	42
COC(=O)c1ncn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853548021	EE	On-Demand	Anodyne	KCNH2	45	44
COC(=O)c1ncn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853548021	EE	On-Demand	Anodyne	GLRA1	44	33
COC(=O)c1ncn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853548021	EE	On-Demand	Anodyne	ACHP_LYMST	25	40
COC(=O)c1ncn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853548021	EE	On-Demand	Anodyne	Q8WSF8_APLCA	33	40
O=C1[C@H]2C=C[C@@H](C2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548032	DF	On-Demand	Anodyne	KCNH2	42	42
Sc1nccn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548101	DG	On-Demand	Anodyne	KCNH2	42	40
CC[C@]1(C)CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853548125	EH	On-Demand	Anodyne	KCNH2	42	41
CC1(C)CCN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853548140	EG	On-Demand	Anodyne	KCNH2	43	42
C[C@H](C#N)N(CN1CC[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548141	CE	On-Demand	Mild	GALR1	44	33
C[C@@H](C#N)N(CN1CC[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548142	CE	On-Demand	Mild	GALR1	44	33
C[C@@H](C#N)N(CN1CC[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548143	CE	On-Demand	Mild	GALR1	44	33
C[C@H](C#N)N(CN1CC[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548144	CE	On-Demand	Mild	GALR1	44	33
CC(C)c1nn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c(=S)n1C	ZINC000853548149	FI	On-Demand	Anodyne	KCNH2	37	42
O=C1N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)[C@@H]([C@@H]2CCCO2)C12CCC2	ZINC000853548167	GH	On-Demand	Anodyne	KCNH2	40	38
O=C1N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)[C@@H]([C@H]2CCCO2)C12CCC2	ZINC000853548168	GH	On-Demand	Anodyne	KCNH2	40	38
O=C1N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)[C@H]([C@H]2CCCO2)C12CCC2	ZINC000853548169	GH	On-Demand	Anodyne	KCNH2	40	38
O=C1N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)[C@H]([C@@H]2CCCO2)C12CCC2	ZINC000853548170	GH	On-Demand	Anodyne	KCNH2	40	38
Cn1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1=O	ZINC000853548185	DD	On-Demand	Anodyne	KCNH2	44	45
Cn1cnn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1=O	ZINC000853548185	DD	On-Demand	Anodyne	GLRA1	41	32
S=c1ccn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c2ccccc12	ZINC000853548189	GK	On-Demand	Anodyne	KCNH2	44	43
O=c1c2ccc(F)cc2nnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548192	GF	On-Demand	Anodyne	KCNH2	43	41
CC[C@H]1CC(=O)N(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1	ZINC000853548198	EG	On-Demand	Anodyne	KCNH2	43	41
COC(=O)[C@@H]1CN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C(=O)O1	ZINC000853548215	FE	On-Demand	Anodyne	SLC6A3	25	42
COC(=O)[C@@H]1CN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C(=O)O1	ZINC000853548215	FE	On-Demand	Anodyne	KCNH2	46	45
C[C@@H]1CN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C(=O)[C@@H]1C	ZINC000853548235	EG	On-Demand	Anodyne	KCNH2	44	43
C[C@@H]1CN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C(=O)[C@H]1C	ZINC000853548237	EG	On-Demand	Anodyne	KCNH2	44	43
O=c1sccn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548249	DF	On-Demand	Anodyne	KCNH2	44	42
Oc1cc2c(cc1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)[C@H](O)CO2	ZINC000853548260	FG	On-Demand	Clean	KCNH2	45	44
Oc1cc2c(cc1CN1[C@H]3CC[C@H]1CC(Oc1ccccc1)C3)[C@@H](O)CO2	ZINC000853548261	FG	On-Demand	Clean	KCNH2	45	44
O=C1CC2(CCC2)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548274	EG	On-Demand	Anodyne	KCNH2	43	41
O=C1c2ncccc2CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548295	EG	On-Demand	Anodyne	KCNH2	40	38
O=C1O[C@]2(CN3CCC2CC3)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548310	GF	On-Demand	Anodyne	KCNH2	40	39
O=C1O[C@]2(CN3CCC2CC3)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548310	GF	On-Demand	Anodyne	CHRNA7	19	50
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548311	GF	On-Demand	Anodyne	KCNH2	40	39
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548311	GF	On-Demand	Anodyne	CHRNA7	19	50
O=c1scc(-c2ccccn2)n1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548318	GI	On-Demand	Anodyne	KCNH2	40	39
Brc1ccn(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853548319	FH	On-Demand	Anodyne	KCNH2	41	41
O=C1C[C@@H](c2cccnc2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548328	GG	On-Demand	Anodyne	KCNH2	40	39
O=C1C[C@H](c2cccnc2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548329	GG	On-Demand	Anodyne	KCNH2	40	39
O=C1[C@@H](O)C2(CCOCC2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548337	GE	On-Demand	Anodyne	KCNH2	40	39
O=C1[C@H](O)C2(CCOCC2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548338	GE	On-Demand	Anodyne	KCNH2	40	39
C[C@H]1CCN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853548346	DF	On-Demand	Anodyne	KCNH2	44	43
C[C@@H]1CCN(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)C1=O	ZINC000853548347	DF	On-Demand	Anodyne	KCNH2	44	43
O=C1c2ccc(F)cc2C(=O)N1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548352	GG	On-Demand	Anodyne	KCNH2	43	42
O=C1N(Cc2cccnc2)CCN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548363	GG	On-Demand	Anodyne	KCNH2	39	44
COC(=O)c1cc(C(=O)OC)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853548366	GE	On-Demand	Anodyne	KCNH2	47	45
COC(=O)c1cc(C(=O)OC)n(CN2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853548366	GE	On-Demand	Anodyne	GLRA1	45	35
O=c1n(-c2ccccc2)cnn1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548367	GG	On-Demand	Anodyne	KCNH2	42	41
OCCSCCSc1ncnc2c1ncn2-c1ccccc1	ZINC000853548368	EF	On-Demand	Anodyne	SLC29A1	62	40
O=C1OC2(CCCC2)CN1CN1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853548377	FH	On-Demand	Anodyne	KCNH2	41	39
COCCN(CCF)Cn1ncc2ccccc2c1=O	ZINC000853548433	CD	On-Demand	Anodyne	NPBWR1	43	35
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	GRIN2B	55	46
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	CTRA_BOVIN	49	31
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	CTSB	47	40
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	CTSK	31	40
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	PREP	27	42
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	CAPNS1	58	34
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	CAPN1	63	41
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	CAPN2	111	41
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	TGM2	33	47
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	NPR	60	34
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	F13A1	24	47
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	SIRT3	44	35
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	SIRT2	43	31
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	SIRT1	43	32
Cn1ncnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548450	ED	On-Demand	Anodyne	SLC12A5	59	37
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	GRIN2B	34	42
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	CTSB	30	45
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	CTSK	33	45
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	PREP	25	44
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	CAPN2	67	38
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	TGM2	24	43
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	NPR	50	32
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	F13A1	15	43
Cn1ncc(C#N)c1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548464	FE	On-Demand	Mild	SLC12A5	40	34
C[C@H](C#N)N(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548465	DD	On-Demand	Mild	GALR1	52	40
C[C@H](C#N)N(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548465	DD	On-Demand	Mild	GALR2	24	40
C[C@H](C#N)N(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548465	DD	On-Demand	Mild	GHRL	48	34
C[C@H](C#N)N(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548466	DD	On-Demand	Mild	GALR1	52	40
C[C@H](C#N)N(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548466	DD	On-Demand	Mild	GALR2	24	40
C[C@H](C#N)N(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548466	DD	On-Demand	Mild	GHRL	48	34
C[C@@H](C#N)N(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548467	DD	On-Demand	Mild	GALR1	52	40
C[C@@H](C#N)N(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548467	DD	On-Demand	Mild	GALR2	24	40
C[C@@H](C#N)N(CN1C(=O)N[C@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548467	DD	On-Demand	Mild	GHRL	48	34
C[C@@H](C#N)N(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548468	DD	On-Demand	Mild	GALR1	52	40
C[C@@H](C#N)N(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548468	DD	On-Demand	Mild	GALR2	24	40
C[C@@H](C#N)N(CN1C(=O)N[C@@H](Cc2ccccc2)C1=O)C1CC1	ZINC000853548468	DD	On-Demand	Mild	GHRL	48	34
COCCN(CCF)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853548485	FD	On-Demand	Bother	SLC27A4	49	32
COCCN(CCF)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853548486	FD	On-Demand	Bother	SLC27A4	49	32
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	GRIN2B	36	45
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	CAPNS1	47	31
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	CAPN1	57	39
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	CAPN2	93	39
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	TGM2	30	44
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	NPR	54	32
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	F13A1	18	44
COC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853548493	GE	On-Demand	Anodyne	SLC12A5	46	37
N#Cc1nc(N2CCC(CNC(=O)OCc3ccccc3)CC2)sc1Cl	ZINC000853548502	GH	On-Demand	Mild	CTSK	22	42
N#Cc1nc(N2CCC(CNC(=O)OCc3ccccc3)CC2)sc1Cl	ZINC000853548502	GH	On-Demand	Mild	CTSL	21	42
N#Cc1nc(N2CCC(CNC(=O)OCc3ccccc3)CC2)sc1Cl	ZINC000853548502	GH	On-Demand	Mild	PDE6D	44	35
N#Cc1nc(N2CCC(CNC(=O)OCc3ccccc3)CC2)sc1Cl	ZINC000853548502	GH	On-Demand	Mild	PREP	20	43
N#Cc1nc(N2CCC(CNC(=O)OCc3ccccc3)CC2)sc1Cl	ZINC000853548502	GH	On-Demand	Mild	TGM2	16	43
N#Cc1nc(N2CCC(CNC(=O)OCc3ccccc3)CC2)sc1Cl	ZINC000853548502	GH	On-Demand	Mild	SLC12A5	43	34
COCCN(CCF)CN1C(=O)C(=O)c2cc(-c3ccccc3)ccc21	ZINC000853548535	FF	On-Demand	Anodyne	ALDH1A1	52	37
COCCN(CCF)CN1C(=O)C(=O)c2cc(-c3ccccc3)ccc21	ZINC000853548535	FF	On-Demand	Anodyne	CASP7	44	38
COCCN(CCF)Cn1c(=O)oc2ccc(C)cc21	ZINC000853548565	CD	On-Demand	Anodyne	MIF	18	47
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	GRIN2B	38	45
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	CTSB	27	40
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	CTSK	25	40
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	CTSL	28	40
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	PREP	29	41
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	CAPN2	68	38
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	TGM2	32	46
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	NPR	51	32
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	F13A1	24	46
O=C(NCC1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853548573	EF	On-Demand	Anodyne	SLC12A5	48	35
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	GRIN2B	37	50
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	CAPNS1	51	34
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	CAPN1	51	41
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	CAPN2	97	41
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	TGM2	37	46
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	NPR	55	35
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	F13A1	26	46
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	SIRT3	51	32
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	SIRT2	52	33
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	SIRT1	51	32
CCNc1nccnc1N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853548598	FG	On-Demand	Anodyne	SLC12A5	48	35
C[C@@H](C#N)N(CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1	ZINC000853548604	FD	On-Demand	Mild	SLC27A4	51	32
C[C@H](C#N)N(CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1	ZINC000853548605	FD	On-Demand	Mild	SLC27A4	51	32
C[C@@H](C#N)N(CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1	ZINC000853548606	FD	On-Demand	Mild	SLC27A4	51	32
C[C@H](C#N)N(CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O)C1CC1	ZINC000853548607	FD	On-Demand	Mild	SLC27A4	51	32
CS(=O)(=O)C1CN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853548611	FC	On-Demand	Anodyne	SCN10A	15	45
O=C(NCC1CCN(c2cc(O)nc3cccnc23)CC1)OCc1ccccc1	ZINC000853548618	GG	On-Demand	Anodyne	GRIN2B	51	45
O=C(NCC1CCN(c2cc(O)nc3cccnc23)CC1)OCc1ccccc1	ZINC000853548618	GG	On-Demand	Anodyne	PDE6D	43	35
O=C(NCC1CCN(c2cc(O)nc3cccnc23)CC1)OCc1ccccc1	ZINC000853548618	GG	On-Demand	Anodyne	ACACB	15	41
O=C(NCC1CCN(c2cc(O)nc3cccnc23)CC1)OCc1ccccc1	ZINC000853548618	GG	On-Demand	Anodyne	TGM2	20	42
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	GRIN2B	40	45
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	ACACB	15	42
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	CAPNS1	51	32
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	CAPN1	47	39
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	CAPN2	86	39
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	TGM2	31	44
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	NPR	53	32
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	CACNA1I	52	34
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	F13A1	22	44
CC(=O)c1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548649	FG	On-Demand	Anodyne	SLC12A5	65	37
O=C(NCc1ccccc1N1CCOCC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853548685	EF	On-Demand	Anodyne	SCN10A	15	45
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000853548689	ED	On-Demand	Anodyne	SCN10A	15	46
C[C@@H](C#N)N(CN1C(=O)C(=O)c2ccccc21)C1CC1	ZINC000853548704	CD	On-Demand	Mild	ALDH1A1	58	41
C[C@@H](C#N)N(CN1C(=O)C(=O)c2ccccc21)C1CC1	ZINC000853548704	CD	On-Demand	Mild	ALDH3A1	38	41
C[C@@H](C#N)N(CN1C(=O)C(=O)c2ccccc21)C1CC1	ZINC000853548704	CD	On-Demand	Mild	CES1	16	41
C[C@H](C#N)N(CN1C(=O)C(=O)c2ccccc21)C1CC1	ZINC000853548705	CD	On-Demand	Mild	ALDH1A1	58	41
C[C@H](C#N)N(CN1C(=O)C(=O)c2ccccc21)C1CC1	ZINC000853548705	CD	On-Demand	Mild	ALDH3A1	38	41
C[C@H](C#N)N(CN1C(=O)C(=O)c2ccccc21)C1CC1	ZINC000853548705	CD	On-Demand	Mild	CES1	16	41
COCCN(CCF)CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21	ZINC000853548808	FD	On-Demand	Anodyne	CHRM5	16	46
COCCN(CCF)Cn1c(=O)oc2ccc(Cl)cc21	ZINC000853548815	DE	On-Demand	Anodyne	TSPO	16	45
O=C(NCc1ccccc1N1CCOCC1)N1CCn2c(O)nnc2C1	ZINC000853548866	FC	On-Demand	Anodyne	SCN10A	15	45
N#Cc1cnnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548935	FE	On-Demand	Mild	GRIN2B	28	41
N#Cc1cnnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548935	FE	On-Demand	Mild	CTSK	28	45
N#Cc1cnnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548935	FE	On-Demand	Mild	CTSL	28	45
N#Cc1cnnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548935	FE	On-Demand	Mild	PREP	27	44
N#Cc1cnnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548935	FE	On-Demand	Mild	TGM2	29	43
N#Cc1cnnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548935	FE	On-Demand	Mild	F13A1	18	43
Nc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nc1[N+](=O)[O-]	ZINC000853548978	GF	On-Demand	Bother	GRIN2B	30	40
Nc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nc1[N+](=O)[O-]	ZINC000853548978	GF	On-Demand	Bother	TGM2	25	45
Nc1ccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)nc1[N+](=O)[O-]	ZINC000853548978	GF	On-Demand	Bother	F13A1	21	45
Nc1cccc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)nccc12	ZINC000853548979	GH	On-Demand	Anodyne	GRIN2B	48	48
Nc1cccc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)nccc12	ZINC000853548979	GH	On-Demand	Anodyne	CTSB	19	40
Nc1cccc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)nccc12	ZINC000853548979	GH	On-Demand	Anodyne	CTSK	18	40
Nc1cccc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)nccc12	ZINC000853548979	GH	On-Demand	Anodyne	CTSL	22	40
Nc1cccc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)nccc12	ZINC000853548979	GH	On-Demand	Anodyne	CAPN2	49	37
Nc1cccc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)nccc12	ZINC000853548979	GH	On-Demand	Anodyne	TGM2	28	44
Nc1cccc2c(N3CCC(CNC(=O)OCc4ccccc4)CC3)nccc12	ZINC000853548979	GH	On-Demand	Anodyne	F13A1	20	44
COC(=O)Cc1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548993	GF	On-Demand	Anodyne	GRIN2B	31	44
COC(=O)Cc1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548993	GF	On-Demand	Anodyne	ELANE	22	40
COC(=O)Cc1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548993	GF	On-Demand	Anodyne	CAPN2	70	38
COC(=O)Cc1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548993	GF	On-Demand	Anodyne	TGM2	24	43
COC(=O)Cc1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548993	GF	On-Demand	Anodyne	NPR	50	32
COC(=O)Cc1ccnc(N2CCC(CNC(=O)OCc3ccccc3)CC2)c1	ZINC000853548993	GF	On-Demand	Anodyne	SLC12A5	48	34
O=C(NCC1CCN(c2cc(CO)c(F)cn2)CC1)OCc1ccccc1	ZINC000853549000	FF	On-Demand	Anodyne	GRIN2B	33	42
O=C(NCC1CCN(c2cc(CO)c(F)cn2)CC1)OCc1ccccc1	ZINC000853549000	FF	On-Demand	Anodyne	TGM2	28	44
O=C(NCC1CCN(c2cc(CO)c(F)cn2)CC1)OCc1ccccc1	ZINC000853549000	FF	On-Demand	Anodyne	F13A1	16	44
O=C(NCC1CCN(c2cc(CO)c(F)cn2)CC1)OCc1ccccc1	ZINC000853549000	FF	On-Demand	Anodyne	DGAT1	18	40
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	GRIN2B	40	41
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	KLK3	48	31
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	PDE6D	45	35
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	ACACB	15	45
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	CAPNS1	46	31
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	CAPN1	46	39
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	CAPN2	82	39
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	TGM2	34	44
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	NPR	57	32
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	F13A1	21	44
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	VCP	40	33
Cc1cc(CO)cc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549012	FG	On-Demand	Anodyne	SLC12A5	57	35
Nc1ccc2nc(N3CCC(CNC(=O)OCc4ccccc4)CC3)sc2c1	ZINC000853549024	GI	On-Demand	Anodyne	GRIN2B	42	40
Nc1ccc2nc(N3CCC(CNC(=O)OCc4ccccc4)CC3)sc2c1	ZINC000853549024	GI	On-Demand	Anodyne	PDE6D	43	34
Nc1ccc2nc(N3CCC(CNC(=O)OCc4ccccc4)CC3)sc2c1	ZINC000853549024	GI	On-Demand	Anodyne	TGM2	21	43
Nc1ccc2nc(N3CCC(CNC(=O)OCc4ccccc4)CC3)sc2c1	ZINC000853549024	GI	On-Demand	Anodyne	F13A1	18	43
Nc1ccc2nc(N3CCC(CNC(=O)OCc4ccccc4)CC3)sc2c1	ZINC000853549024	GI	On-Demand	Anodyne	VCP	41	36
CCOC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549031	GF	On-Demand	Anodyne	GRIN2B	31	44
CCOC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549031	GF	On-Demand	Anodyne	CTSB	40	37
CCOC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549031	GF	On-Demand	Anodyne	CAPNS1	57	33
CCOC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549031	GF	On-Demand	Anodyne	CAPN1	61	41
CCOC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549031	GF	On-Demand	Anodyne	CAPN2	108	41
CCOC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549031	GF	On-Demand	Anodyne	TGM2	26	43
CCOC(=O)c1nccc(N2CCC(CNC(=O)OCc3ccccc3)CC2)n1	ZINC000853549031	GF	On-Demand	Anodyne	NPR	58	34
COCCN(CCF)CN1C(=O)C(=O)c2cc(Br)ccc21	ZINC000853549043	FD	On-Demand	Anodyne	ALDH1A1	19	45
COCCN(CCF)CN1C(=O)C(=O)c2ccccc21	ZINC000853549056	CD	On-Demand	Anodyne	ALDH1A1	60	43
COCCN(CCF)CN1C(=O)C(=O)c2ccccc21	ZINC000853549056	CD	On-Demand	Anodyne	ALDH3A1	40	43
COCCN(CCF)CN1C(=O)C(=O)c2ccccc21	ZINC000853549056	CD	On-Demand	Anodyne	CES1	17	49
COCCN(CCF)Cc1c(O)ccc2ccc(OC)cc12	ZINC000853549061	DF	On-Demand	Clean	MTNR1A	18	43
COCc1csc(CNC(=O)NCc2ccccc2N2CCOCC2)c1	ZINC000853549089	GF	On-Demand	Anodyne	SCN10A	15	44
CCC(C)(C)[C@@H](C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549106	EG	On-Demand	Anodyne	KCNQ2	50	34
CCC(C)(C)[C@@H](C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549106	EG	On-Demand	Anodyne	SCN10A	15	44
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549108	GE	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1cnc(C(F)(F)F)nc1)NCc1ccccc1N1CCOCC1	ZINC000853549128	GE	On-Demand	Anodyne	SCN10A	22	48
O=C(NCc1cnc(C(F)(F)F)nc1)NCc1ccccc1N1CCOCC1	ZINC000853549128	GE	On-Demand	Anodyne	STAT6	53	35
CN(CC1=CCCOC1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853549136	EE	On-Demand	Anodyne	SCN10A	15	45
CCSC1(CNC(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000853549137	EF	On-Demand	Anodyne	KCNQ2	44	32
CCSC1(CNC(=O)NCc2ccccc2N2CCOCC2)CC1	ZINC000853549137	EF	On-Demand	Anodyne	SCN10A	15	47
COCCN(CCF)Cn1ccc(-c2ccc(F)cc2)n1	ZINC000853549138	CF	On-Demand	Anodyne	SCN4A	31	41
O=C(NCc1ccccc1N1CCOCC1)N1CCCC2(CCCC2)CC1	ZINC000853549139	FH	On-Demand	Anodyne	SCN10A	15	45
Cc1cc(F)ccc1C[C@H](C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549144	GG	On-Demand	Anodyne	P2RX7	43	40
Cc1cc(F)ccc1C[C@@H](C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549145	GG	On-Demand	Anodyne	P2RX7	43	40
O=C(NCc1ccccc1N1CCOCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853549147	FE	On-Demand	Anodyne	CPT1A	103	41
O=C(NCc1ccccc1N1CCOCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853549147	FE	On-Demand	Anodyne	SCN10A	15	41
O=C(NCc1ccccc1N1CCOCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853549148	FE	On-Demand	Anodyne	CPT1A	103	41
O=C(NCc1ccccc1N1CCOCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853549148	FE	On-Demand	Anodyne	SCN10A	15	41
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853549152	FC	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2COC[C@H]2C1	ZINC000853549158	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853549159	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853549160	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853549161	ED	On-Demand	Anodyne	SCN10A	15	45
C[C@@H](CCNC(=O)NCc1ccccc1N1CCOCC1)N(C)C	ZINC000853549176	ED	On-Demand	Anodyne	KCNQ2	47	33
C=CCCC(C)(C)NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549199	EG	On-Demand	Mild	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@H](C2CCC2)C1	ZINC000853549254	FG	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853549255	FG	On-Demand	Anodyne	SCN10A	15	45
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853549264	ED	On-Demand	Anodyne	KCNQ2	42	34
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853549264	ED	On-Demand	Anodyne	SCN10A	15	44
O=C(NCC[S@@](=O)CC(F)(F)F)NCc1ccccc1N1CCOCC1	ZINC000853549283	GD	On-Demand	Anodyne	SCN10A	15	43
O=C(NCC[S@@](=O)CC(F)(F)F)NCc1ccccc1N1CCOCC1	ZINC000853549283	GD	On-Demand	Anodyne	STAT6	43	34
O=C(NCC[S@](=O)CC(F)(F)F)NCc1ccccc1N1CCOCC1	ZINC000853549284	GD	On-Demand	Anodyne	SCN10A	15	43
O=C(NCC[S@](=O)CC(F)(F)F)NCc1ccccc1N1CCOCC1	ZINC000853549284	GD	On-Demand	Anodyne	STAT6	43	34
O=C(NCc1ccccc1N1CCOCC1)NCC1CCC(O)CC1	ZINC000853549290	ED	On-Demand	Anodyne	SCN10A	15	48
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1C=CCC1	ZINC000853549304	DE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C=CCC1	ZINC000853549305	DE	On-Demand	Anodyne	SCN10A	15	45
C[C@@]1(CNC(=O)NCc2ccccc2N2CCOCC2)CC1(F)F	ZINC000853549308	EE	On-Demand	Anodyne	KCNQ2	44	33
C[C@@]1(CNC(=O)NCc2ccccc2N2CCOCC2)CC1(F)F	ZINC000853549308	EE	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)NNc1cc(F)cc(Cl)c1	ZINC000853549310	GG	On-Demand	Reactive	P2RX7	21	40
O=C(NCc1ccccc1N1CCOCC1)NNc1cc(F)cc(Cl)c1	ZINC000853549310	GG	On-Demand	Reactive	SCN10A	21	51
O=C(NCc1ccccc1N1CCOCC1)NNc1cc(F)cc(Cl)c1	ZINC000853549310	GG	On-Demand	Reactive	STAT6	40	34
O=C(NCCc1ccoc1)NCc1ccccc1N1CCOCC1	ZINC000853549316	EE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H](CO)C1CCC1	ZINC000853549329	ED	On-Demand	Anodyne	KCNQ2	49	33
O=C(NCc1ccccc1N1CCOCC1)N[C@H](CO)C1CCC1	ZINC000853549330	ED	On-Demand	Anodyne	KCNQ2	49	33
C[C@@H]1CN(C(=O)NCc2ccccc2N2CCOCC2)C[C@@H](C)C1O	ZINC000853549334	ED	On-Demand	Anodyne	SCN10A	15	45
N#Cc1ccc(CCNC(=O)NCc2ccccc2N2CCOCC2)cc1	ZINC000853549348	FE	On-Demand	Mild	SCN10A	15	43
O=C(NCc1ccccc1N1CCOCC1)N1CCC(O)(CO)CC1	ZINC000853549353	EC	On-Demand	Anodyne	SCN10A	15	45
CC[C@H](C)N(CC)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853549369	DF	On-Demand	Anodyne	KCNQ2	65	38
CC[C@H](C)N(CC)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853549369	DF	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853549442	GF	On-Demand	Anodyne	KCNQ2	42	36
O=C(NCc1ccccc1N1CCOCC1)N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853549442	GF	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853549443	GF	On-Demand	Anodyne	KCNQ2	42	36
O=C(NCc1ccccc1N1CCOCC1)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853549443	GF	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853549444	GF	On-Demand	Anodyne	KCNQ2	42	36
O=C(NCc1ccccc1N1CCOCC1)N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853549444	GF	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)NCc1cnccc1C(F)(F)F	ZINC000853549453	GF	On-Demand	Anodyne	SCN2A	17	40
O=C(NCc1ccccc1N1CCOCC1)NCc1cnccc1C(F)(F)F	ZINC000853549453	GF	On-Demand	Anodyne	SCN10A	25	49
O=C(NCc1ccccc1N1CCOCC1)NCc1cnccc1C(F)(F)F	ZINC000853549453	GF	On-Demand	Anodyne	STAT6	43	34
Cc1ccc(CC2CN(C(=O)NCc3ccccc3N3CCOCC3)C2)cc1	ZINC000853549476	GG	On-Demand	Anodyne	SCN10A	15	44
COCCN(CCF)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853549486	ED	On-Demand	Anodyne	SCN10A	15	45
NC(=O)c1csc(CNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000853549490	GD	On-Demand	Anodyne	PIK3CD	20	40
NC(=O)c1csc(CNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000853549490	GD	On-Demand	Anodyne	SCN10A	15	45
NC(=O)c1csc(CNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000853549490	GD	On-Demand	Anodyne	PIK3CB	31	40
NC(=O)c1csc(CNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000853549490	GD	On-Demand	Anodyne	STAT6	55	36
O=C(NCc1ccc2occc2c1)NCc1ccccc1N1CCOCC1	ZINC000853549494	FG	On-Demand	Anodyne	SCN10A	15	45
C=CCOCCCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549496	ED	On-Demand	Mild	SCN10A	15	45
CC[C@@H](O)CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549505	DD	On-Demand	Anodyne	KCNQ2	69	37
CC[C@@H](O)CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549505	DD	On-Demand	Anodyne	NPY2R	41	33
CC[C@@H](O)CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549505	DD	On-Demand	Anodyne	SCN10A	15	47
N#CC1(CNC(=O)NCc2ccccc2N2CCOCC2)CCCCC1	ZINC000853549525	FF	On-Demand	Mild	SCN10A	15	44
COCCN(CCF)Cn1nnc2c(cnn2C)c1=O	ZINC000853549567	CB	On-Demand	Anodyne	Q9M629_MAIZE	60	41
C=CCCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549569	CD	On-Demand	Mild	SCN10A	15	49
COCc1n[nH]c(CNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000853549574	FC	On-Demand	Anodyne	SCN10A	15	42
Cn1ncc2c(=O)n(CN3CC4(CCOCC4)[C@@H]3c3ccco3)nnc21	ZINC000853549602	FC	On-Demand	Anodyne	Q9M629_MAIZE	46	32
Cn1ncc2c(=O)n(CN3CC4(CCOCC4)[C@H]3c3ccco3)nnc21	ZINC000853549603	FC	On-Demand	Anodyne	Q9M629_MAIZE	46	32
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	AVPR2	21	43
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	KCNQ2	32	40
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	P2RX7	36	46
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	SCN10A	32	56
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	PIK3CB	48	40
O=C(NCc1ccc(Cl)c(Cl)c1)NCc1ccccc1N1CCOCC1	ZINC000853549696	GH	On-Demand	Anodyne	RPA1	52	35
Cn1ncc(C2CC2)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549697	FE	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)N1CCC(CO)(CO)C1	ZINC000853549700	EC	On-Demand	Anodyne	SCN10A	15	45
CC(C)(C)N1CC[C@H]1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549713	FE	On-Demand	Anodyne	SCN10A	15	45
CC(C)(C)N1CC[C@@H]1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549714	FE	On-Demand	Anodyne	SCN10A	15	45
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	HTR1A	81	46
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	DRD2	59	48
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	DRD4	38	42
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	ADRA1D	59	39
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	HTR2A	19	46
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	ADRA1A	54	39
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	ADRA1B	46	38
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	DRD3	67	48
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	HTR7	54	46
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	KCNQ2	44	33
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	PIK3CD	17	41
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	SOAT1	15	40
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	SCN10A	15	46
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	PIK3CB	31	41
COc1cccc(OC)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549717	GF	On-Demand	Anodyne	STAT6	25	41
CC[C@@H](C)CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549722	DF	On-Demand	Anodyne	KCNQ2	55	35
CC[C@@H](C)CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549722	DF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H](C2CCCCC2)C1	ZINC000853549730	FH	On-Demand	Anodyne	PGA5	40	30
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H](C2CCCCC2)C1	ZINC000853549730	FH	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H](C2CCCCC2)C1	ZINC000853549731	FH	On-Demand	Anodyne	PGA5	40	30
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H](C2CCCCC2)C1	ZINC000853549731	FH	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853549749	FF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853549751	FF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853549753	FF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853549754	FF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NCC(O)(C1CC1)C1CC1	ZINC000853549771	FD	On-Demand	Anodyne	SCN10A	15	46
O=C(NCc1ccccc1N1CCOCC1)NNC(=O)c1cccc(F)n1	ZINC000853549773	FD	On-Demand	Reactive	SCN10A	16	46
N#CC[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853549778	EE	On-Demand	Mild	CTSS	24	41
N#CC[C@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853549779	EE	On-Demand	Mild	CTSS	24	41
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)CC1	ZINC000853549844	GD	On-Demand	Anodyne	CACNA1H	16	40
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)CC1	ZINC000853549845	GD	On-Demand	Anodyne	CACNA1H	16	40
O=C(NCc1ccccc1N1CCOCC1)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853549852	GF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)NC[C@H]1CCN1Cc1ccccc1	ZINC000853549853	GF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21	ZINC000853549862	GF	On-Demand	Anodyne	P2RX7	18	41
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853549863	GF	On-Demand	Anodyne	P2RX7	18	41
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21	ZINC000853549864	GF	On-Demand	Anodyne	P2RX7	18	41
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853549865	GF	On-Demand	Anodyne	P2RX7	18	41
Cn1ncc(C2CCC2)c1CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853549886	GF	On-Demand	Anodyne	SCN10A	15	44
COC[C@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549902	GF	On-Demand	Anodyne	DRD4	46	37
COC[C@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549902	GF	On-Demand	Anodyne	CASR	32	43
COC[C@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549902	GF	On-Demand	Anodyne	HTR7	17	41
COC[C@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549902	GF	On-Demand	Anodyne	KCNQ2	36	45
COC[C@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549902	GF	On-Demand	Anodyne	SOAT1	18	40
COC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549903	GF	On-Demand	Anodyne	DRD4	46	37
COC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549903	GF	On-Demand	Anodyne	CASR	32	43
COC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549903	GF	On-Demand	Anodyne	HTR7	17	41
COC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549903	GF	On-Demand	Anodyne	KCNQ2	36	45
COC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)c1cccc(OC)c1	ZINC000853549903	GF	On-Demand	Anodyne	SOAT1	18	40
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853549905	ED	On-Demand	Anodyne	SCN10A	15	43
O=C(NCCc1ccnc2ccccc12)NCc1ccccc1N1CCOCC1	ZINC000853549906	GG	On-Demand	Anodyne	SCN10A	15	44
COCCN(CCF)CN1Cc2ccc(OC)cc2C1=O	ZINC000853549907	CD	On-Demand	Anodyne	ADAM17	39	45
O=C(NC/C=C\CO)NCc1ccccc1N1CCOCC1	ZINC000853549927	DC	On-Demand	Anodyne	SCN10A	15	47
O=C(NC/C=C/CO)NCc1ccccc1N1CCOCC1	ZINC000853549928	DC	On-Demand	Anodyne	SCN10A	15	47
Cc1cncc(CCNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000853549938	FD	On-Demand	Anodyne	SCN2A	18	49
Cc1cncc(CCNC(=O)NCc2ccccc2N2CCOCC2)n1	ZINC000853549938	FD	On-Demand	Anodyne	SCN10A	30	49
O=C(c1ccc(F)cc1)C1CCN(c2ncnc(F)c2Br)CC1	ZINC000853549992	GH	On-Demand	Anodyne	SLC18A3	32	44
O=C(c1ccc(F)cc1)C1CCN(c2ncnc(F)c2Br)CC1	ZINC000853549992	GH	On-Demand	Anodyne	WNT3A	47	34
O=C1CC2(CCC2)C(=O)N1CN1CCN(c2ccc(Br)cc2)CC1	ZINC000853549995	GE	On-Demand	Anodyne	ADRA1D	20	44
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000853550000	EF	On-Demand	Mild	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NCC(F)(F)c1cccc(F)c1	ZINC000853550002	GG	On-Demand	Anodyne	KCNQ2	28	40
C=CCC1(NC(=O)NCc2ccccc2N2CCOCC2)CCCC1	ZINC000853550006	EG	On-Demand	Mild	SCN10A	18	48
O=C(c1ccc(F)cc1)C1CCN(c2cc(F)ncn2)CC1	ZINC000853550029	DF	On-Demand	Anodyne	SLC18A3	47	45
O=C(c1ccc(F)cc1)C1CCN(c2cc(F)ncn2)CC1	ZINC000853550029	DF	On-Demand	Anodyne	SCD1	16	45
O=C(c1ccc(F)cc1)C1CCN(c2cc(F)ncn2)CC1	ZINC000853550029	DF	On-Demand	Anodyne	WNT3A	49	37
COc1cc(N2CC[C@@H](Oc3ccncc3)C2)c([N+](=O)[O-])cc1C	ZINC000853550083	EF	On-Demand	Bother	PDE3A	42	49
COc1cc(N2CC[C@@H](Oc3ccncc3)C2)c([N+](=O)[O-])cc1C	ZINC000853550083	EF	On-Demand	Bother	PDE3B	49	49
O=C(NCc1ccccc1N1CCOCC1)N1CCC(c2ccon2)CC1	ZINC000853550099	FF	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CCC(c2ccon2)CC1	ZINC000853550099	FF	On-Demand	Anodyne	SMO	34	41
N#Cc1ncc(Br)cc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853550112	EF	On-Demand	Mild	PDE3A	28	43
N#Cc1ncc(Br)cc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853550112	EF	On-Demand	Mild	PDE3B	34	43
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000853550177	GH	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@H]1c1ccccc1Cl	ZINC000853550177	GH	On-Demand	Anodyne	SCN10A	15	46
O=C(NCCCc1nc[nH]n1)NCc1ccccc1N1CCOCC1	ZINC000853550189	ED	On-Demand	Anodyne	SCN10A	15	44
COCC1(NC(=O)NCc2ccccc2N2CCOCC2)CCCC1	ZINC000853550193	EE	On-Demand	Anodyne	KCNQ2	42	36
COCC1(NC(=O)NCc2ccccc2N2CCOCC2)CCCC1	ZINC000853550193	EE	On-Demand	Anodyne	SCN10A	15	44
COCCN(CCF)Cn1c(=O)oc2ccc(Br)cc21	ZINC000853550208	EE	On-Demand	Anodyne	TSPO	16	45
CN(Cc1cnc[nH]1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853550210	ED	On-Demand	Anodyne	SCN10A	21	49
O=C(NCc1ccccc1N1CCOCC1)NC1CCC2(CC1)CC2(F)F	ZINC000853550223	GG	On-Demand	Anodyne	EPHX2	17	41
CON(C)CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550269	DC	On-Demand	Anodyne	DRD2	15	40
CON(C)CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550269	DC	On-Demand	Anodyne	SCN10A	15	45
CCO[C@@H]1C[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550322	ED	On-Demand	Anodyne	TIMP3	46	32
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853550335	DE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853550337	DE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@H]2C[C@H]2C1	ZINC000853550338	DE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853550340	DE	On-Demand	Anodyne	SCN10A	15	45
CN1CCN(C(=O)NCc2ccccc2N2CCOCC2)CCC1=O	ZINC000853550370	EC	On-Demand	Anodyne	SCN10A	15	44
COCCN(CCF)CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O	ZINC000853550400	FD	On-Demand	Anodyne	SIGMAR1	34	40
O=C(NCc1ccccc1N1CCOCC1)NCC(F)(F)c1ccc(F)cc1	ZINC000853550407	GG	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCOCC1)NCC1(O)CCC(F)(F)CC1	ZINC000853550408	GE	On-Demand	Anodyne	SCN10A	15	45
NC(=O)c1cccc2c1CCN(C(=O)NCc1ccccc1N1CCOCC1)C2	ZINC000853550424	GD	On-Demand	Anodyne	STAT6	49	34
CCOc1cc(NCc2noc3ccccc23)nc(C)n1	ZINC000853550463	CF	On-Demand	Anodyne	METG	51	35
Brc1ccc(N2CCN(Cn3cnc(-c4ccccn4)n3)CC2)cc1	ZINC000853550501	GF	On-Demand	Anodyne	PRNP	31	41
O=C1C(=O)N(CN2CCN([C@@H]3CCOC3)CC2)c2ccccc21	ZINC000853550509	DC	On-Demand	Anodyne	ALDH1A1	50	40
O=C1C(=O)N(CN2CCN([C@@H]3CCOC3)CC2)c2ccccc21	ZINC000853550509	DC	On-Demand	Anodyne	ALDH3A1	43	56
O=C1C(=O)N(CN2CCN([C@@H]3CCOC3)CC2)c2ccccc21	ZINC000853550509	DC	On-Demand	Anodyne	CES1	15	40
O=C(NCc1ccccc1N1CCOCC1)N1CCC(C2CCC2)CC1	ZINC000853550510	FG	On-Demand	Anodyne	EPHX2	29	41
O=C(NCc1ccccc1N1CCOCC1)N1CCC(C2CCC2)CC1	ZINC000853550510	FG	On-Demand	Anodyne	SCN10A	15	46
O=C1C(=O)N(CN2CCN([C@H]3CCOC3)CC2)c2ccccc21	ZINC000853550511	DC	On-Demand	Anodyne	ALDH1A1	50	40
O=C1C(=O)N(CN2CCN([C@H]3CCOC3)CC2)c2ccccc21	ZINC000853550511	DC	On-Demand	Anodyne	ALDH3A1	43	56
O=C1C(=O)N(CN2CCN([C@H]3CCOC3)CC2)c2ccccc21	ZINC000853550511	DC	On-Demand	Anodyne	CES1	15	40
O=C(NCc1ncccn1)NCc1ccccc1N1CCOCC1	ZINC000853550518	ED	On-Demand	Anodyne	SCN10A	24	51
CC[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)C1CC1	ZINC000853550523	DF	On-Demand	Anodyne	KCNQ2	52	34
COC(=O)c1cccc(NNC(=O)NCc2ccccc2N2CCOCC2)c1C	ZINC000853550526	GE	On-Demand	Reactive	KCNQ2	42	33
O=C(NCC1=CCCC1)NCc1ccccc1N1CCOCC1	ZINC000853550550	DE	On-Demand	Anodyne	SCN10A	15	46
C[C@@H]1[C@@H](C(F)(F)F)OCCN1C(=O)NCc1ccccc1N1CCOCC1	ZINC000853550557	GE	On-Demand	Anodyne	SCN10A	15	44
C[C@H]1[C@H](C(F)(F)F)OCCN1C(=O)NCc1ccccc1N1CCOCC1	ZINC000853550560	GE	On-Demand	Anodyne	SCN10A	15	44
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550564	GF	On-Demand	Anodyne	HTR1A	47	39
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550564	GF	On-Demand	Anodyne	DRD2	35	42
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550564	GF	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550564	GF	On-Demand	Anodyne	DRD3	41	42
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550564	GF	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccccc1N1CCOCC1)NCc1cccnc1N1CCCC1	ZINC000853550569	GF	On-Demand	Anodyne	KCNQ2	71	40
O=C(NCc1ccccc1N1CCOCC1)NCc1cccnc1N1CCCC1	ZINC000853550569	GF	On-Demand	Anodyne	SCN2A	22	47
O=C(NCc1ccccc1N1CCOCC1)NCc1cccnc1N1CCCC1	ZINC000853550569	GF	On-Demand	Anodyne	SCN10A	28	52
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1CCNC1=O	ZINC000853550583	DC	On-Demand	Anodyne	SCN10A	15	43
Cn1cnn(CN2CCN(c3ccc(Br)cc3)CC2)c1=O	ZINC000853550584	FD	On-Demand	Anodyne	HTR1A	16	40
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1CCNC1=O	ZINC000853550585	DC	On-Demand	Anodyne	SCN10A	15	43
C#CCCCOc1cccnc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853550586	DF	On-Demand	Mild	PDE3A	40	46
C#CCCCOc1cccnc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853550586	DF	On-Demand	Mild	PDE3B	47	46
CCN1CC[C@@H](N(CC)C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550591	FE	On-Demand	Anodyne	CCR5	24	48
CCN1CC[C@H](N(CC)C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550592	FE	On-Demand	Anodyne	CCR5	24	48
O=C1CC2(CCC2)N1CN1CCN(c2ccc(Br)cc2)CC1	ZINC000853550610	FF	On-Demand	Anodyne	ADRA1D	18	40
O=C(NCCCC1CCC1)NCc1ccccc1N1CCOCC1	ZINC000853550618	EF	On-Demand	Anodyne	DRD2	20	40
O=C(NCCCC1CCC1)NCc1ccccc1N1CCOCC1	ZINC000853550618	EF	On-Demand	Anodyne	SCN10A	15	44
O=C1CCCN1CN1CCN(c2ccc(Br)cc2)CC1	ZINC000853550636	EE	On-Demand	Anodyne	Q9FYV8_MAIZE	18	40
C#C[C@@H](NC(=O)NCc1ccccc1N1CCOCC1)C1CCOCC1	ZINC000853550638	FD	On-Demand	Mild	KCNQ2	46	33
C#C[C@H](NC(=O)NCc1ccccc1N1CCOCC1)C1CCOCC1	ZINC000853550639	FD	On-Demand	Mild	KCNQ2	46	33
O=C(NCc1ccccc1N1CCOCC1)N[C@@H]1C[C@@H](Oc2ccccc2)C1	ZINC000853550649	GF	On-Demand	Anodyne	EPHX2	34	40
C#Cc1cccnc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853550652	CE	On-Demand	Mild	PDE3A	41	48
C#Cc1cccnc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853550652	CE	On-Demand	Mild	PDE3B	48	48
C=CC[C@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550675	EG	On-Demand	Mild	PGA5	42	31
O=C(NCc1ccccc1N1CCOCC1)N1CCc2nccnc2C1	ZINC000853550698	FD	On-Demand	Anodyne	SCN10A	19	46
O=C(NCc1ccccc1N1CCOCC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853550703	GE	On-Demand	Anodyne	MC4R	36	41
O=C(NCc1ccccc1N1CCOCC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853550703	GE	On-Demand	Anodyne	KCNQ2	43	35
O=C(NCc1ccccc1N1CCOCC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853550703	GE	On-Demand	Anodyne	P2RX7	15	41
O=C(NCc1ccccc1N1CCOCC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853550703	GE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853550704	GE	On-Demand	Anodyne	MC4R	36	41
O=C(NCc1ccccc1N1CCOCC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853550704	GE	On-Demand	Anodyne	KCNQ2	43	35
O=C(NCc1ccccc1N1CCOCC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853550704	GE	On-Demand	Anodyne	P2RX7	15	41
O=C(NCc1ccccc1N1CCOCC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853550704	GE	On-Demand	Anodyne	SCN10A	15	45
C[C@@]1(C#N)CCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550710	ED	On-Demand	Mild	SCN10A	15	44
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NC(C)(C2CC2)C2CC2)CC1	ZINC000853550722	GE	On-Demand	Anodyne	CACNA1H	25	42
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC2(CCOCC2)[C@@H]1c1ccco1	ZINC000853550738	GE	On-Demand	Anodyne	CHRNA7	17	47
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC2(CCOCC2)[C@H]1c1ccco1	ZINC000853550739	GE	On-Demand	Anodyne	CHRNA7	17	47
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC2(CCOCC2)[C@@H]1c1ccco1	ZINC000853550740	GE	On-Demand	Anodyne	CHRNA7	17	47
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC2(CCOCC2)[C@H]1c1ccco1	ZINC000853550741	GE	On-Demand	Anodyne	CHRNA7	17	47
C=CC[C@@H]1CCCN(C(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550748	EG	On-Demand	Mild	PGA5	42	31
O=C(NCc1ccc2c(=O)cc[nH]c2c1)NCc1ccccc1N1CCOCC1	ZINC000853550753	GE	On-Demand	Anodyne	SCN10A	18	46
Cc1ccncc1CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550755	FE	On-Demand	Anodyne	SCN2A	16	48
Cc1ccncc1CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550755	FE	On-Demand	Anodyne	SCN10A	27	48
Cc1ccncc1CCNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550755	FE	On-Demand	Anodyne	NAMPT	15	42
CC(C)(C)C(F)(F)CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550773	FG	On-Demand	Anodyne	KCNQ2	52	33
CC(C)(C)C(F)(F)CNC(=O)NCc1ccccc1N1CCOCC1	ZINC000853550773	FG	On-Demand	Anodyne	SCN10A	15	45
COCCN(CCF)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853550777	DC	On-Demand	Anodyne	CHRNA7	15	55
COCCN(CCF)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853550779	DC	On-Demand	Anodyne	CHRNA7	15	55
C=CCN(C(=O)NCc1ccccc1N1CCOCC1)[C@@H](C)COC	ZINC000853550782	EE	On-Demand	Mild	KCNQ2	42	32
C=CCN(C(=O)NCc1ccccc1N1CCOCC1)[C@H](C)COC	ZINC000853550784	EE	On-Demand	Mild	KCNQ2	42	32
CC(C)(C)N1CC[C@H](NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550791	FE	On-Demand	Anodyne	SCN10A	15	45
CC(C)(C)N1CC[C@@H](NC(=O)NCc2ccccc2N2CCOCC2)C1	ZINC000853550793	FE	On-Demand	Anodyne	SCN10A	15	45
COCCN(CCF)Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000853550798	DE	On-Demand	Bother	F2RL3	47	36
C#CCCCOc1cccnc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853550808	FI	On-Demand	Mild	HTR2A	17	45
C#CCCCOc1cccnc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853550808	FI	On-Demand	Mild	SLC18A3	47	42
C#CCCCOc1cccnc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853550808	FI	On-Demand	Mild	SCD	15	40
C#CCCCOc1cccnc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853550808	FI	On-Demand	Mild	WNT3A	47	35
C#Cc1cccnc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853550816	DG	On-Demand	Mild	SLC18A3	48	45
C#Cc1cccnc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853550816	DG	On-Demand	Mild	WNT3A	48	35
C#CCCN(CCOC)C(=O)N[C@@H](C)c1cccc(OCC)c1	ZINC000853550855	DF	On-Demand	Mild	ACACB	15	45
C#CCCN(CCOC)C(=O)N[C@H](C)c1cccc(OCC)c1	ZINC000853550856	DF	On-Demand	Mild	ACACB	15	45
CCOc1cccc([C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853550937	EH	On-Demand	Anodyne	PDS	45	43
NC(=O)CC1(CNC(=O)NCc2ccccc2N2CCOCC2)CCCCC1	ZINC000853550942	GE	On-Demand	Anodyne	SCN10A	15	44
CN(CC(=O)N1CCCC1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853550947	FD	On-Demand	Anodyne	KCNQ2	64	36
CN(CC(=O)N1CCCC1)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853550947	FD	On-Demand	Anodyne	SCN10A	15	44
O=C(NCc1ccccc1N1CCOCC1)N[C@H]1C[C@H](O)C1	ZINC000853550971	DC	On-Demand	Anodyne	SCN10A	15	47
CCC(CC)CCCN(C)C(=O)NCc1ccccc1N1CCOCC1	ZINC000853550972	FH	On-Demand	Anodyne	KCNQ2	45	33
COc1cccc(C2(NC(=O)NCc3ccccc3N3CCOCC3)CCC2)c1	ZINC000853551001	GG	On-Demand	Anodyne	DRD4	46	37
COc1cccc(C2(NC(=O)NCc3ccccc3N3CCOCC3)CCC2)c1	ZINC000853551001	GG	On-Demand	Anodyne	HTR7	15	40
COc1cccc(C2(NC(=O)NCc3ccccc3N3CCOCC3)CCC2)c1	ZINC000853551001	GG	On-Demand	Anodyne	SOAT1	18	45
O=C(NCc1ccccc1N1CCOCC1)NCC1CCN(CC2CC2)CC1	ZINC000853551004	GE	On-Demand	Anodyne	HTR4	41	41
O=C(NCc1ccccc1N1CCOCC1)NCC1CCN(CC2CC2)CC1	ZINC000853551004	GE	On-Demand	Anodyne	CCR3	24	43
O=C(NCc1ccccc1N1CCOCC1)NCC1CCN(CC2CC2)CC1	ZINC000853551004	GE	On-Demand	Anodyne	CACNA1I	46	35
CCOc1cccc([C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853551005	EH	On-Demand	Anodyne	PDS	45	43
CCOc1cccc([C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853551006	EH	On-Demand	Anodyne	PDS	45	43
CCOc1cccc([C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853551007	EH	On-Demand	Anodyne	PDS	45	43
N#Cc1ncc(Br)cc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853551016	GH	On-Demand	Mild	SLC18A3	36	42
N#Cc1ncc(Br)cc1N1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000853551016	GH	On-Demand	Mild	WNT3A	45	32
O=c1c2ccccc2cnn1CN1CCN(c2ccc(Br)cc2)CC1	ZINC000853551035	GF	On-Demand	Anodyne	HTR1A	22	48
O=C(c1ccc(F)cc1)C1CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1	ZINC000853551050	GJ	On-Demand	Bother	SLC18A3	25	42
Fc1ncnc(N2CC[C@@H](Oc3ccncc3)C2)c1Br	ZINC000853551070	EE	On-Demand	Anodyne	PDE3A	46	56
Fc1ncnc(N2CC[C@@H](Oc3ccncc3)C2)c1Br	ZINC000853551070	EE	On-Demand	Anodyne	DCK	47	38
Fc1ncnc(N2CC[C@@H](Oc3ccncc3)C2)c1Br	ZINC000853551070	EE	On-Demand	Anodyne	PDE3B	53	56
Fc1cnc(N2CC[C@@H](Oc3ccncc3)C2)cn1	ZINC000853551104	CD	On-Demand	Anodyne	PDE3A	30	46
Fc1cnc(N2CC[C@@H](Oc3ccncc3)C2)cn1	ZINC000853551104	CD	On-Demand	Anodyne	PDE3B	34	46
O=C1CCCN1c1cnc(N2CCC(COc3ccc(Cl)nc3)CC2)cn1	ZINC000853551111	GF	On-Demand	Anodyne	CHRNA4	19	41
CC(C)(C)OC(=O)CCC1CCN(Cn2cc(Br)cn2)CC1	ZINC000853551126	FG	On-Demand	Anodyne	CACNA1I	44	31
Cc1cc(CO)cc(N2CCC(COc3ccc(Cl)nc3)CC2)n1	ZINC000853551153	EG	On-Demand	Anodyne	CHRNA4	23	40
Fc1cnc(N2CCC(COc3ccc(Cl)nc3)CC2)cn1	ZINC000853551159	DF	On-Demand	Anodyne	CHRNA2	41	34
Fc1cnc(N2CCC(COc3ccc(Cl)nc3)CC2)cn1	ZINC000853551159	DF	On-Demand	Anodyne	CHRNA3	47	34
Fc1cnc(N2CCC(COc3ccc(Cl)nc3)CC2)cn1	ZINC000853551159	DF	On-Demand	Anodyne	CHRNA4	37	46
O=C(NCc1ccccc1N1CCOCC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853551185	EE	On-Demand	Anodyne	SCN10A	15	46
O=C(NCCC1SCCS1)NCc1ccccc1N1CCOCC1	ZINC000853551219	FF	On-Demand	Anodyne	SCN10A	15	45
Cn1ncc(C#N)c1N1CCC(COc2ccc(Cl)nc2)CC1	ZINC000853551227	EF	On-Demand	Mild	CHRNA4	23	43
N#Cc1cnnc(N2CCC(COc3ccc(Cl)nc3)CC2)c1	ZINC000853551232	EF	On-Demand	Mild	CHRNA4	20	44
C[C@@H](CCNC(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1)N(C)C	ZINC000853551283	FD	On-Demand	Anodyne	CHRNA3	24	41
C[C@@H](CCNC(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1)N(C)C	ZINC000853551283	FD	On-Demand	Anodyne	CHRNA4	20	41
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccccc1N1CCOCC1	ZINC000853551287	EF	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NC1CC(CO)C1	ZINC000853551290	DD	On-Demand	Anodyne	SCN10A	15	45
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NCC2CCC(O)CC2)CC1	ZINC000853551301	GD	On-Demand	Anodyne	CACNA1H	19	41
CC(C)(C)OC(=O)N1CCN(CCNC(=O)NCC2CCC(O)CC2)CC1	ZINC000853551301	GD	On-Demand	Anodyne	CACNA1I	46	38
O=S1(=O)N=C(Cl)c2ccc(N3CC[C@@H](Oc4ccncc4)C3)cc21	ZINC000853551321	FE	On-Demand	Anodyne	PDE3B	15	40
CCOc1cccc([C@@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853551325	CD	On-Demand	Anodyne	PDS	66	43
CCOc1cccc([C@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853551326	CD	On-Demand	Anodyne	PDS	66	43
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853551338	GD	On-Demand	Anodyne	PDE3A	15	41
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853551338	GD	On-Demand	Anodyne	PDE3B	19	41
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@@H](Oc2ccncc2)C1	ZINC000853551338	GD	On-Demand	Anodyne	LIPG	42	39
Cn1ncc2c(=O)n(CN3C[C@@H]4COC[C@]4(C(=O)OC(C)(C)C)C3)nnc21	ZINC000853551350	GB	On-Demand	Anodyne	Q9M629_MAIZE	50	33
Fc1cc(N2CC[C@@H](Oc3ccncc3)C2)ncn1	ZINC000853551375	CD	On-Demand	Anodyne	PDE3A	46	55
Fc1cc(N2CC[C@@H](Oc3ccncc3)C2)ncn1	ZINC000853551375	CD	On-Demand	Anodyne	DCK	49	41
Fc1cc(N2CC[C@@H](Oc3ccncc3)C2)ncn1	ZINC000853551375	CD	On-Demand	Anodyne	PDE3B	52	55
O=[N+]([O-])c1cncc(Cl)c1N1CCC(COc2ccc(Cl)nc2)CC1	ZINC000853551408	GH	On-Demand	Bother	CHRNA3	19	40
O=[N+]([O-])c1cncc(Cl)c1N1CCC(COc2ccc(Cl)nc2)CC1	ZINC000853551408	GH	On-Demand	Bother	CHRNA4	18	40
CC(C)(C)OC(=O)CCC1CCN(Cn2c(=O)oc3ccc(F)cc32)CC1	ZINC000853551410	GH	On-Demand	Anodyne	MIF	15	40
OCc1cc(N2CCC(COc3ccc(Cl)nc3)CC2)ncc1F	ZINC000853551438	FG	On-Demand	Anodyne	CHRNA4	27	42
CC(C)(C)OC(=O)CCC1CCN(Cc2cc3c(cc2O)OCO3)CC1	ZINC000853551455	FG	On-Demand	Clean	ACHE	17	46
CC(C)(C)OC(=O)CCC1CCN(Cc2cc3c(cc2O)OCO3)CC1	ZINC000853551455	FG	On-Demand	Clean	CACNA1I	41	32
C#Cc1cccnc1N1CCC(COc2ccc(Cl)nc2)CC1	ZINC000853551460	EG	On-Demand	Mild	CHRNA4	19	43
CC(C)(C)OC(=O)CCC1CCN(Cn2cnc(-c3ccccn3)n2)CC1	ZINC000853551463	FG	On-Demand	Anodyne	ACHE	25	40
CON(C)CCNC(=O)NCc1cccc2cccnc12	ZINC000853551513	CD	On-Demand	Anodyne	MTNR1A	28	40
Cc1ccc(N2CCC(COc3ccc(Cl)nc3)CC2)nn1	ZINC000853551515	DG	On-Demand	Anodyne	CHRNA4	29	46
CN1C(=O)C(=O)N(CN2CCN(c3ccc(Br)cc3)CC2)C1=O	ZINC000853551558	GC	On-Demand	Anodyne	HTR1A	17	41
Cc1cccc2c1CCC[C@@H]2NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853551602	GH	On-Demand	Anodyne	AVPR2	31	40
Cc1cccc2c1CCC[C@@H]2NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853551602	GH	On-Demand	Anodyne	HTR7	15	44
Cc1cccc2c1CCC[C@H]2NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853551605	GH	On-Demand	Anodyne	AVPR2	31	40
Cc1cccc2c1CCC[C@H]2NC(=O)NCc1ccccc1N1CCOCC1	ZINC000853551605	GH	On-Demand	Anodyne	HTR7	15	44
O=C(NCc1ccccc1N1CCOCC1)N1CC2(CCC2)[C@@H]1c1ccncc1	ZINC000853551608	GG	On-Demand	Anodyne	SCN10A	15	44
O=C1CC2(CCCC2)N1CN1CCN(c2ccc(Br)cc2)CC1	ZINC000853551610	GG	On-Demand	Anodyne	ADRA1D	23	42
O=C(NCc1ccccc1N1CCOCC1)N1CC2(CCC2)[C@H]1c1ccncc1	ZINC000853551611	GG	On-Demand	Anodyne	SCN10A	15	44
O=C(c1ccc(F)cc1)C1CCN(c2cnc(F)cn2)CC1	ZINC000853551613	DF	On-Demand	Anodyne	SLC18A3	42	46
O=C(c1ccc(F)cc1)C1CCN(c2cnc(F)cn2)CC1	ZINC000853551613	DF	On-Demand	Anodyne	WNT3A	49	36
COCCN(CCF)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853551632	ED	On-Demand	Bother	SLC27A4	51	35
COCCN(CCF)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853551635	ED	On-Demand	Bother	SLC27A4	51	35
Cc1nnc(CN(C)C(=O)NCc2ccccc2N2CCOCC2)s1	ZINC000853551697	FE	On-Demand	Anodyne	SCN10A	15	45
O=C(NCCOCCF)NCc1ccccc1N1CCOCC1	ZINC000853551704	ED	On-Demand	Anodyne	SCN10A	15	45
O=C(NCc1ccccc1N1CCOCC1)NCC1SCCS1	ZINC000853551705	FE	On-Demand	Anodyne	SCN10A	15	46
CC(C)(C)OC(=O)CCC1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853551726	FG	On-Demand	Anodyne	CASP3	20	43
CC(C)(C)OC(=O)CCC1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853551726	FG	On-Demand	Anodyne	ALDH1A1	41	39
CC(C)(C)OC(=O)CCC1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853551726	FG	On-Demand	Anodyne	ALDH3A1	39	48
N#Cc1nc(N2CCC(COc3ccc(Cl)nc3)CC2)sc1Cl	ZINC000853551757	FI	On-Demand	Mild	CHRNA4	18	42
CCNc1nccnc1N1CCC(COc2ccc(Cl)nc2)CC1	ZINC000853551808	EG	On-Demand	Anodyne	CHRNA4	23	43
O=C(NCc1ccccc1N1CCOCC1)N1CCC2(COC2)C1	ZINC000853551834	ED	On-Demand	Anodyne	SCN10A	15	45
Cn1ncc2c(=O)n(CN3CCC(CCC(=O)OC(C)(C)C)CC3)nnc21	ZINC000853551839	GD	On-Demand	Anodyne	Q9M629_MAIZE	52	33
CC(C)(C)OC(=O)CCC1CCN(CN2C(=O)c3ccccc3C2=O)CC1	ZINC000853551857	FG	On-Demand	Anodyne	ACHE	30	48
CC(C)(C)OC(=O)CCC1CCN(Cn2cnc(-c3ccccc3)n2)CC1	ZINC000853551865	FH	On-Demand	Anodyne	ACHE	41	42
Nc1cccc2c(N3CCC(COc4ccc(Cl)nc4)CC3)nccc12	ZINC000853551910	FI	On-Demand	Anodyne	CHRNA4	23	44
CC(C)(C)OC(=O)CCC1CCN(Cn2nc(-c3ccccc3)ccc2=O)CC1	ZINC000853551915	GH	On-Demand	Anodyne	ACHE	22	40
CC(C)(C)OC(=O)CCC1CCN(Cn2nc(-c3ccccc3)ccc2=O)CC1	ZINC000853551915	GH	On-Demand	Anodyne	P2RY12	48	40
CON(C)CCNC(=O)NCc1ccccc1Oc1ccccc1	ZINC000853551940	EF	On-Demand	Anodyne	TSPO	45	37
Fc1cc(N2CCC(COc3ccc(Cl)nc3)CC2)ncn1	ZINC000853551941	DF	On-Demand	Anodyne	DCK	37	40
Fc1cc(N2CCC(COc3ccc(Cl)nc3)CC2)ncn1	ZINC000853551941	DF	On-Demand	Anodyne	CHRNA3	43	35
Fc1cc(N2CCC(COc3ccc(Cl)nc3)CC2)ncn1	ZINC000853551941	DF	On-Demand	Anodyne	CHRNA4	30	44
Cn1nnc2c(N3CCC(COc4ccc(Cl)nc4)CC3)ncnc21	ZINC000853551946	FE	On-Demand	Anodyne	CHRNA4	19	44
CC(C)(C)OC(=O)CCC1CCN(Cn2c(=O)oc3ccccc32)CC1	ZINC000853551976	FG	On-Demand	Anodyne	HTR4	50	43
CC(C)(C)OC(=O)CCC1CCN(Cn2ccc(=S)c3ccccc32)CC1	ZINC000853552079	GK	On-Demand	Anodyne	HTR4	50	42
CC(C)(C)OC(=O)CCC1CCN(Cn2cc(Cl)cn2)CC1	ZINC000853552092	EG	On-Demand	Anodyne	CACNA1I	62	38
CCCc1ccc(N2CCC(COc3ccc(Cl)nc3)CC2)nn1	ZINC000853552129	EH	On-Demand	Anodyne	CHRNA4	19	42
CC(=O)c1ccnc(N2CCC(COc3ccc(Cl)nc3)CC2)c1	ZINC000853552147	EH	On-Demand	Anodyne	CHRNA4	27	40
Cn1ncnc1N1CCC(COc2ccc(Cl)nc2)CC1	ZINC000853552220	DE	On-Demand	Anodyne	CHRNA4	28	45
COc1cccc([C@H]2CC(=O)N(CN3CCN([C@H]4CCOC4)CC3)C2)c1	ZINC000853552268	FD	On-Demand	Anodyne	HTR1A	15	44
COc1cccc([C@H]2CC(=O)N(CN3CCN([C@@H]4CCOC4)CC3)C2)c1	ZINC000853552269	FD	On-Demand	Anodyne	HTR1A	15	44
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000853552402	GF	On-Demand	Mild	ACHE	28	47
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000853552402	GF	On-Demand	Mild	SIGMAR1	30	48
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000853552402	GF	On-Demand	Mild	CHEK2	22	43
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000853552402	GF	On-Demand	Mild	PDK1	40	36
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000853552402	GF	On-Demand	Mild	MCHR1	29	47
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000853552402	GF	On-Demand	Mild	CACNA1G	15	41
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000853552402	GF	On-Demand	Mild	CACNA1I	60	43
Cc1onc2c(=O)n(CN(C)CC3CN(C)C3)nc(-c3ccccc3)c12	ZINC000853552587	FD	On-Demand	Anodyne	GRM7	71	35
COCCN(CCF)C(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000853552668	EF	On-Demand	Anodyne	MPO	51	33
CC[C@@H](NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1ccccc1	ZINC000853553040	FE	On-Demand	Anodyne	TACR3	48	39
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](CC)c1ccccc1	ZINC000853553046	EG	On-Demand	Mild	TACR3	46	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](CC)c1ccccc1	ZINC000853553047	EG	On-Demand	Mild	TACR3	46	38
COC(=O)c1c([N+](=O)[O-])ccc(SCCCOC(C)=O)c1Cl	ZINC000853553084	EG	On-Demand	Bother	GSTM2	51	40
CC[C@@H](NC(=O)N1CCC[C@H](c2nnc(S)n2C(C)C)C1)c1ccccc1	ZINC000853553109	GI	On-Demand	Anodyne	TACR3	43	37
CC[C@@H](NC(=O)N1CCC[C@@H](c2nnc(S)n2C(C)C)C1)c1ccccc1	ZINC000853553112	GI	On-Demand	Anodyne	TACR3	43	37
CC[C@@H](NC(=O)N1CCC[C@H](c2nnc(S)n2C2CC2)C1)c1ccccc1	ZINC000853553179	GH	On-Demand	Anodyne	CCR5	25	41
CC[C@@H](NC(=O)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1)c1ccccc1	ZINC000853553182	GH	On-Demand	Anodyne	CCR5	25	41
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CCN([C@@H]2CCOC2)CC1	ZINC000853553208	GD	On-Demand	Anodyne	SIGMAR1	33	42
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CCN([C@H]2CCOC2)CC1	ZINC000853553209	GD	On-Demand	Anodyne	SIGMAR1	33	42
COC(=O)c1nn(CN2CCN([C@H]3CCOC3)CC2)c2ccccc12	ZINC000853553237	ED	On-Demand	Anodyne	HTR4	49	42
COC(=O)c1nn(CN2CCN([C@@H]3CCOC3)CC2)c2ccccc12	ZINC000853553238	ED	On-Demand	Anodyne	HTR4	49	42
CC[C@@H](NC(=O)NCCc1nnc(S)n1C1CC1)c1ccccc1	ZINC000853553260	EF	On-Demand	Anodyne	CCR5	20	41
CC[C@@H](NC(=O)NCCc1nnc(S)n1C1CC1)c1ccccc1	ZINC000853553260	EF	On-Demand	Anodyne	TACR3	45	36
COc1ccc(-c2nn(CN(C)CC3CN(C)C3)c(=O)c3ccccc23)cc1	ZINC000853553263	GF	On-Demand	Anodyne	HRH1	15	41
COc1ccc(-c2nn(CN(C)CC3CN(C)C3)c(=O)c3ccccc23)cc1	ZINC000853553263	GF	On-Demand	Anodyne	AXL	20	40
COc1ccc(-c2nn(CN(C)CC3CN(C)C3)c(=O)c3ccccc23)cc1	ZINC000853553263	GF	On-Demand	Anodyne	MERTK	19	40
CC[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553435	DE	On-Demand	Anodyne	CCR5	35	46
CC[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553435	DE	On-Demand	Anodyne	TACR3	41	37
CC[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553435	DE	On-Demand	Anodyne	XIAP	46	36
CC[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553435	DE	On-Demand	Anodyne	BIRC8	48	36
CC[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553436	DE	On-Demand	Anodyne	CCR5	35	46
CC[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553436	DE	On-Demand	Anodyne	TACR3	41	37
CC[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553436	DE	On-Demand	Anodyne	XIAP	46	36
CC[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853553436	DE	On-Demand	Anodyne	BIRC8	48	36
CC[C@@H](NC(=O)NCCc1nnc(S)n1CC)c1ccccc1	ZINC000853553463	EF	On-Demand	Anodyne	TACR3	48	38
CC[C@@H](NC(=O)NCCc1nnc(S)n1C)c1ccccc1	ZINC000853553557	DE	On-Demand	Anodyne	TACR3	48	38
CC[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1ccccc1	ZINC000853553618	GG	On-Demand	Anodyne	MAPK1	44	39
O=C1C(=O)N(CN2CCN([C@@H]3CCOC3)CC2)c2cc(OC(F)(F)F)ccc21	ZINC000853553686	GD	On-Demand	Anodyne	CHRM5	15	40
O=C1C(=O)N(CN2CCN([C@H]3CCOC3)CC2)c2cc(OC(F)(F)F)ccc21	ZINC000853553689	GD	On-Demand	Anodyne	CHRM5	15	40
CC(=O)OCCCSc1ncnc2c1ncn2-c1ccccc1	ZINC000853553746	EF	On-Demand	Anodyne	SLC29A1	42	34
CC[C@@H](NC(=O)N(CCF)CCOC)c1ccccc1	ZINC000853553773	CF	On-Demand	Anodyne	TACR3	50	42
Fc1cc(N2CCC(Nc3cccc(Br)c3)CC2)ncn1	ZINC000853553797	FG	On-Demand	Anodyne	EGFR	33	41
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)c1ccccc1	ZINC000853553803	DF	On-Demand	Anodyne	CACNA1H	20	42
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)c1ccccc1	ZINC000853553803	DF	On-Demand	Anodyne	CCR5	29	45
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)c1ccccc1	ZINC000853553803	DF	On-Demand	Anodyne	TACR3	44	38
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)c1ccccc1	ZINC000853553803	DF	On-Demand	Anodyne	EPHX2	38	43
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CC[C@H](C3CCCCC3)C2)C1	ZINC000853554038	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CC[C@@H](C3CCCCC3)C2)C1	ZINC000853554040	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CC[C@@H](C3CCCCC3)C2)C1	ZINC000853554043	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CC[C@H](C3CCCCC3)C2)C1	ZINC000853554045	GG	On-Demand	Anodyne	CACNA1I	41	32
O=C(NCCCc1nc[nH]n1)NC1CCN(CC2CCCC2)CC1	ZINC000853554089	ED	On-Demand	Anodyne	HRH2	18	43
O=C(NCCCc1nc[nH]n1)NC1CCN(CC2CCCC2)CC1	ZINC000853554089	ED	On-Demand	Anodyne	CCR3	16	49
Cc1onc2c(=O)n(CN3CCN([C@H]4CCOC4)CC3)nc(-c3ccccc3)c12	ZINC000853554092	GD	On-Demand	Anodyne	GRM7	40	32
Cc1onc2c(=O)n(CN3CCN([C@@H]4CCOC4)CC3)nc(-c3ccccc3)c12	ZINC000853554093	GD	On-Demand	Anodyne	GRM7	40	32
CON(C)CCNC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000853554120	DE	On-Demand	Anodyne	HTR1D	20	42
CON(C)CCNC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000853554120	DE	On-Demand	Anodyne	NQO2	28	44
CON(C)CCNC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000853554120	DE	On-Demand	Anodyne	MTNR1A	29	50
CON(C)CCNC(=O)NCCc1c[nH]c2cc(Cl)ccc12	ZINC000853554120	DE	On-Demand	Anodyne	MTNR1B	15	47
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000853554183	DE	On-Demand	Mild	ACACA	25	45
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(OC)cc1	ZINC000853554183	DE	On-Demand	Mild	ACACB	25	41
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000853554184	DE	On-Demand	Mild	ACACA	25	45
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(OC)cc1	ZINC000853554184	DE	On-Demand	Mild	ACACB	25	41
Cn1ncc2c(=O)n(CN3CC[C@@H](C4CCCCC4)C3)nnc21	ZINC000853554274	DD	On-Demand	Anodyne	Q9M629_MAIZE	53	35
Cn1ncc2c(=O)n(CN3CC[C@H](C4CCCCC4)C3)nnc21	ZINC000853554275	DD	On-Demand	Anodyne	Q9M629_MAIZE	53	35
CC[C@@H](NC(=O)N1CCC[C@@H](c2nnc(S)n2CC)C1)c1ccccc1	ZINC000853554286	FH	On-Demand	Anodyne	TACR3	42	36
CC[C@@H](NC(=O)N1CCC[C@H](c2nnc(S)n2CC)C1)c1ccccc1	ZINC000853554287	FH	On-Demand	Anodyne	TACR3	42	36
C#CCCN(CCOC)C(=O)N[C@@H](CC)c1ccccc1	ZINC000853554299	CF	On-Demand	Mild	TACR3	47	39
C#CCCN(CCOC)C(=O)N[C@H](CC)c1ccccc1	ZINC000853554300	CF	On-Demand	Mild	TACR3	47	39
O=C(NCCc1c[nH]c2cc(Cl)ccc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853554371	FH	On-Demand	Anodyne	ACHE	29	40
O=C(NCCc1c[nH]c2cc(Cl)ccc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853554372	FH	On-Demand	Anodyne	ACHE	29	40
O=C(NCCc1c[nH]c2cc(Cl)ccc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853554373	FH	On-Demand	Anodyne	ACHE	29	40
O=C(NCCc1c[nH]c2cc(Cl)ccc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853554374	FH	On-Demand	Anodyne	ACHE	29	40
O=C1C(=O)N(CN2CCN([C@H]3CCOC3)CC2)c2ccc(-c3ccccc3)cc21	ZINC000853554389	GE	On-Demand	Anodyne	ALDH1A1	42	34
O=C1C(=O)N(CN2CCN([C@H]3CCOC3)CC2)c2ccc(-c3ccccc3)cc21	ZINC000853554389	GE	On-Demand	Anodyne	ALDH3A1	29	44
O=C1C(=O)N(CN2CCN([C@@H]3CCOC3)CC2)c2ccc(-c3ccccc3)cc21	ZINC000853554390	GE	On-Demand	Anodyne	ALDH1A1	42	34
O=C1C(=O)N(CN2CCN([C@@H]3CCOC3)CC2)c2ccc(-c3ccccc3)cc21	ZINC000853554390	GE	On-Demand	Anodyne	ALDH3A1	29	44
O=C(NCc1ccccc1C(F)(F)F)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853554502	FH	On-Demand	Anodyne	P2RX7	40	37
O=C(NCc1ccccc1C(F)(F)F)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853554502	FH	On-Demand	Anodyne	RBP4	78	40
O=C(NCc1ccccc1C(F)(F)F)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853554504	FH	On-Demand	Anodyne	P2RX7	40	37
O=C(NCc1ccccc1C(F)(F)F)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853554504	FH	On-Demand	Anodyne	RBP4	78	40
O=C(NCc1ccccc1C(F)(F)F)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853554506	FH	On-Demand	Anodyne	P2RX7	40	37
O=C(NCc1ccccc1C(F)(F)F)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853554506	FH	On-Demand	Anodyne	RBP4	78	40
O=C(NCc1ccccc1C(F)(F)F)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853554508	FH	On-Demand	Anodyne	P2RX7	40	37
O=C(NCc1ccccc1C(F)(F)F)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853554508	FH	On-Demand	Anodyne	RBP4	78	40
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853554547	EF	On-Demand	Anodyne	CCR5	27	46
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853554547	EF	On-Demand	Anodyne	CXCR2	15	40
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853554547	EF	On-Demand	Anodyne	TACR3	43	38
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853554547	EF	On-Demand	Anodyne	CALCRL	40	36
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853554547	EF	On-Demand	Anodyne	XIAP	53	36
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853554547	EF	On-Demand	Anodyne	BIRC2	40	35
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853554547	EF	On-Demand	Anodyne	BIRC8	56	35
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H](C2CCCCC2)C1	ZINC000853554549	EF	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@H](C2CCCCC2)C1	ZINC000853554551	EF	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@@H](C2CCCCC2)C1	ZINC000853554560	EF	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H](C2CCCCC2)C1	ZINC000853554563	EF	On-Demand	Anodyne	CHRNA7	17	56
O=C(NCCc1nnc(S)n1C1CC1)NCc1ccccc1C(F)(F)F	ZINC000853554659	GF	On-Demand	Anodyne	P2RX7	40	39
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCN([C@@H]2CCOC2)CC1	ZINC000853554701	FC	On-Demand	Anodyne	CHRNA7	15	54
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCN([C@H]2CCOC2)CC1	ZINC000853554702	FC	On-Demand	Anodyne	CHRNA7	15	54
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCN([C@@H]2CCOC2)CC1	ZINC000853554703	FC	On-Demand	Anodyne	CHRNA7	15	54
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCN([C@H]2CCOC2)CC1	ZINC000853554704	FC	On-Demand	Anodyne	CHRNA7	15	54
C#CCCN(CCOC)C(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000853554750	DG	On-Demand	Mild	TRPV1	22	42
C#CCCN(CCOC)C(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000853554750	DG	On-Demand	Mild	MT-ND1	27	40
COc1ccc(-c2nnn(CN(C)CC3CN(C)C3)n2)cc1OC	ZINC000853554763	EC	On-Demand	Anodyne	SCARB1	20	42
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)N(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853554767	FC	On-Demand	Anodyne	SIGMAR1	28	41
O=C1CC[C@H]2CN(CN3C(=O)C(=O)N(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853554768	FC	On-Demand	Anodyne	SIGMAR1	28	41
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)N(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853554769	FC	On-Demand	Anodyne	SIGMAR1	28	41
O=C1CC[C@H]2CN(CN3C(=O)C(=O)N(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853554770	FC	On-Demand	Anodyne	SIGMAR1	28	41
O=[N+]([O-])c1c(SCCCCSc2ccnc(O)c2[N+](=O)[O-])ccnc1O	ZINC000853554771	GG	On-Demand	Bother	GSTM2	40	43
CC[C@@H](NC(=O)N1CCn2ncc(Br)c2C1)c1ccccc1	ZINC000853554915	FG	On-Demand	Anodyne	TACR3	44	38
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000853554991	GG	On-Demand	Anodyne	P2RX7	43	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000853554991	GG	On-Demand	Anodyne	RBP4	83	37
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000853554993	GG	On-Demand	Anodyne	P2RX7	43	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2ccccc2C(F)(F)F)C1	ZINC000853554993	GG	On-Demand	Anodyne	RBP4	83	37
CC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)c1ccccc1	ZINC000853555029	DE	On-Demand	Anodyne	TACR3	50	44
CC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)c1ccccc1	ZINC000853555029	DE	On-Demand	Anodyne	UTS2	54	40
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	OPRK1	15	41
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	ANPEP	15	41
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	KCNQ2	19	42
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	CCR5	23	41
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	TIMP3	68	39
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	TACR3	48	39
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	XIAP	43	38
CC[C@@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853555040	FH	On-Demand	Clean	PDS	43	34
CC[C@@H](NC(=O)NC[C@H](O)c1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000853555096	FH	On-Demand	Anodyne	TACR3	50	44
CC[C@@H](NC(=O)NC[C@H](O)c1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000853555096	FH	On-Demand	Anodyne	PDS	51	35
CC[C@@H](NC(=O)NC[C@@H](O)c1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000853555099	FH	On-Demand	Anodyne	TACR3	50	44
CC[C@@H](NC(=O)NC[C@@H](O)c1cc(F)c(F)c(F)c1)c1ccccc1	ZINC000853555099	FH	On-Demand	Anodyne	PDS	51	35
COc1ccccc1-c1nn(CN2CC[C@H]3NC(=O)CC[C@H]3C2)c(=S)n1C	ZINC000853555212	GE	On-Demand	Anodyne	CARM1	45	37
COc1ccccc1-c1nn(CN2CC[C@@H]3NC(=O)CC[C@@H]3C2)c(=S)n1C	ZINC000853555214	GE	On-Demand	Anodyne	CARM1	45	37
COc1ccccc1-c1nn(CN2CC[C@H]3NC(=O)CC[C@@H]3C2)c(=S)n1C	ZINC000853555216	GE	On-Demand	Anodyne	CARM1	45	37
COc1ccccc1-c1nn(CN2CC[C@@H]3NC(=O)CC[C@H]3C2)c(=S)n1C	ZINC000853555218	GE	On-Demand	Anodyne	CARM1	45	37
CC[C@@H](NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1)c1ccccc1	ZINC000853555314	FG	On-Demand	Anodyne	TACR3	43	37
CC[C@@H](NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1)c1ccccc1	ZINC000853555315	FG	On-Demand	Anodyne	TACR3	43	37
CC[C@@H](NC(=O)NCCc1nnc(S)n1C(C)C)c1ccccc1	ZINC000853555477	EG	On-Demand	Anodyne	TACR3	46	37
CC[C@@H](NC(=O)NCCN(C)OC)c1ccccc1	ZINC000853555526	CD	On-Demand	Anodyne	TACR3	52	43
CC[C@@H](NC(=O)NCCN(C)OC)c1ccccc1	ZINC000853555526	CD	On-Demand	Anodyne	UTS2	53	40
CC[C@@H](NC(=O)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1)c1ccccc1	ZINC000853555593	GI	On-Demand	Anodyne	NPY2R	54	35
O=C1CC[C@@H]2CN(Cn3c(=O)oc4ccccc43)CC[C@@H]2N1	ZINC000853555674	DD	On-Demand	Anodyne	SIGMAR1	15	46
O=C1CC[C@H]2CN(Cn3c(=O)oc4ccccc43)CC[C@H]2N1	ZINC000853555675	DD	On-Demand	Anodyne	SIGMAR1	15	46
O=C1CC[C@H]2CN(Cn3c(=O)oc4ccccc43)CC[C@@H]2N1	ZINC000853555676	DD	On-Demand	Anodyne	SIGMAR1	15	46
O=C1CC[C@@H]2CN(Cn3c(=O)oc4ccccc43)CC[C@H]2N1	ZINC000853555677	DD	On-Demand	Anodyne	SIGMAR1	15	46
Cn1c(S)nnc1CCNC(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000853555790	EE	On-Demand	Anodyne	TRPV1	24	45
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1ccccc1Br	ZINC000853556008	GF	On-Demand	Mild	PAPA1_CARPA	18	44
CON(C)CCNC(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000853556175	CE	On-Demand	Anodyne	TRPV1	40	52
CON(C)CCNC(=O)NCc1ccc(C(C)(C)C)cc1	ZINC000853556175	CE	On-Demand	Anodyne	MT-ND1	28	40
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@@H]2N1	ZINC000853556194	DC	On-Demand	Anodyne	ALDH1A1	49	39
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@@H]2N1	ZINC000853556194	DC	On-Demand	Anodyne	ALDH3A1	40	49
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@H]2N1	ZINC000853556195	DC	On-Demand	Anodyne	ALDH1A1	49	39
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@H]2N1	ZINC000853556195	DC	On-Demand	Anodyne	ALDH3A1	40	49
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@H]2N1	ZINC000853556196	DC	On-Demand	Anodyne	ALDH1A1	49	39
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@H]2N1	ZINC000853556196	DC	On-Demand	Anodyne	ALDH3A1	40	49
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@@H]2N1	ZINC000853556197	DC	On-Demand	Anodyne	ALDH1A1	49	39
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4ccccc43)CC[C@@H]2N1	ZINC000853556197	DC	On-Demand	Anodyne	ALDH3A1	40	49
Cn1c(S)nnc1CCNC(=O)NCc1c(F)cccc1Cl	ZINC000853556237	ED	On-Demand	Anodyne	P2RX7	18	43
O=C1CC[C@H]2CN(Cn3ncc4cc(OCc5ccccc5)ccc43)CC[C@H]2N1	ZINC000853556316	GG	On-Demand	Anodyne	MCHR1	15	51
O=C1CC[C@@H]2CN(Cn3ncc4cc(OCc5ccccc5)ccc43)CC[C@@H]2N1	ZINC000853556317	GG	On-Demand	Anodyne	MCHR1	15	51
O=C1CC[C@H]2CN(Cn3ncc4cc(OCc5ccccc5)ccc43)CC[C@@H]2N1	ZINC000853556318	GG	On-Demand	Anodyne	MCHR1	15	51
O=C1CC[C@@H]2CN(Cn3ncc4cc(OCc5ccccc5)ccc43)CC[C@H]2N1	ZINC000853556319	GG	On-Demand	Anodyne	MCHR1	15	51
O=C1CC[C@@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853556434	GD	On-Demand	Anodyne	ACHE	17	42
O=C1CC[C@@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853556434	GD	On-Demand	Anodyne	SIGMAR1	41	48
O=C1CC[C@@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@H]2N1	ZINC000853556435	GD	On-Demand	Anodyne	ACHE	17	42
O=C1CC[C@@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@H]2N1	ZINC000853556435	GD	On-Demand	Anodyne	SIGMAR1	41	48
O=C1CC[C@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853556436	GD	On-Demand	Anodyne	ACHE	17	42
O=C1CC[C@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853556436	GD	On-Demand	Anodyne	SIGMAR1	41	48
O=C1CC[C@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@H]2N1	ZINC000853556437	GD	On-Demand	Anodyne	ACHE	17	42
O=C1CC[C@H]2CN(CN3C[C@@H]4CN(Cc5ccccc5)CC[C@@H]4C3=O)CC[C@H]2N1	ZINC000853556437	GD	On-Demand	Anodyne	SIGMAR1	41	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2ccc(F)cc2F)C1	ZINC000853556458	FG	On-Demand	Anodyne	P2RX7	44	39
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2ccc(F)cc2F)C1	ZINC000853556458	FG	On-Demand	Anodyne	GPR119	20	46
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2ccc(F)cc2F)C1	ZINC000853556459	FG	On-Demand	Anodyne	P2RX7	44	39
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2ccc(F)cc2F)C1	ZINC000853556459	FG	On-Demand	Anodyne	GPR119	20	46
CN(C[C@@H]1COCCO1)Cn1nnc2c(cnn2C)c1=O	ZINC000853556782	CA	On-Demand	Anodyne	Q9M629_MAIZE	65	38
CN(C[C@@H]1COCCO1)CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O	ZINC000853556928	FD	On-Demand	Anodyne	SIGMAR1	21	41
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4ccc(OC(F)(F)F)cc43)CC[C@@H]2N1	ZINC000853557039	GD	On-Demand	Anodyne	CHRM5	15	42
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4ccc(OC(F)(F)F)cc43)CC[C@H]2N1	ZINC000853557040	GD	On-Demand	Anodyne	CHRM5	15	42
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4ccc(OC(F)(F)F)cc43)CC[C@@H]2N1	ZINC000853557041	GD	On-Demand	Anodyne	CHRM5	15	42
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4ccc(OC(F)(F)F)cc43)CC[C@H]2N1	ZINC000853557042	GD	On-Demand	Anodyne	CHRM5	15	42
CON(C)CCNC(=O)NCc1cccc(Cl)c1Cl	ZINC000853557100	DE	On-Demand	Anodyne	P2RX7	31	43
Cn1c(S)nnc1CCNC(=O)NCc1ccc(F)cc1F	ZINC000853557168	ED	On-Demand	Anodyne	P2RX7	52	40
CN(C[C@@H]1COCCO1)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853557190	EC	On-Demand	Anodyne	CHRNA7	15	54
CN(C[C@@H]1COCCO1)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853557193	EC	On-Demand	Anodyne	CHRNA7	15	54
CN(C[C@@H]1COCCO1)Cn1nc(-c2ccccc2)cc(C(F)(F)F)c1=O	ZINC000853557353	GE	On-Demand	Anodyne	GRM7	44	32
Cc1onc2c(=O)n(CN(C)C[C@H]3COCCO3)nc(-c3ccccc3)c12	ZINC000853557368	FD	On-Demand	Anodyne	GRM7	46	33
Cc1onc2c(=O)n(CN(C)C[C@@H]3COCCO3)nc(-c3ccccc3)c12	ZINC000853557369	FD	On-Demand	Anodyne	GRM7	46	33
CN(C[C@@H]1COCCO1)Cn1nc(-c2ccccc2)c2ccccc2c1=O	ZINC000853557383	FE	On-Demand	Anodyne	GRM7	44	32
O=C1CC[C@H]2CN(Cn3ccn(Cc4ccccc4)c3=S)CC[C@H]2N1	ZINC000853557501	FF	On-Demand	Anodyne	SIGMAR1	28	41
O=C1CC[C@@H]2CN(Cn3ccn(Cc4ccccc4)c3=S)CC[C@H]2N1	ZINC000853557502	FF	On-Demand	Anodyne	SIGMAR1	28	41
O=C1CC[C@H]2CN(Cn3ccn(Cc4ccccc4)c3=S)CC[C@@H]2N1	ZINC000853557503	FF	On-Demand	Anodyne	SIGMAR1	28	41
O=C1CC[C@@H]2CN(Cn3ccn(Cc4ccccc4)c3=S)CC[C@@H]2N1	ZINC000853557504	FF	On-Demand	Anodyne	SIGMAR1	28	41
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NCCc1nnc(S)n1C	ZINC000853557625	GD	On-Demand	Anodyne	BMP1	40	36
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)NCCc1nnc(S)n1C	ZINC000853557625	GD	On-Demand	Anodyne	NOS2	88	37
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NCCc1nnc(S)n1C	ZINC000853557626	GD	On-Demand	Anodyne	BMP1	40	36
C[C@@H](CCc1ccc2c(c1)OCO2)NC(=O)NCCc1nnc(S)n1C	ZINC000853557626	GD	On-Demand	Anodyne	NOS2	88	37
O=S1(=O)N=C(Cl)c2ccc(NC[C@@H]3CCN(Cc4ccccc4)C3)cc21	ZINC000853557639	GG	On-Demand	Anodyne	DRD4	28	46
O=S1(=O)N=C(Cl)c2ccc(NC[C@@H]3CCN(Cc4ccccc4)C3)cc21	ZINC000853557639	GG	On-Demand	Anodyne	ACHE	43	44
O=S1(=O)N=C(Cl)c2ccc(NC[C@H]3CCN(Cc4ccccc4)C3)cc21	ZINC000853557640	GG	On-Demand	Anodyne	DRD4	28	46
O=S1(=O)N=C(Cl)c2ccc(NC[C@H]3CCN(Cc4ccccc4)C3)cc21	ZINC000853557640	GG	On-Demand	Anodyne	ACHE	43	44
Cn1c(SCC(=O)OCc2ccccc2)cc(=O)n(C)c1=O	ZINC000853557666	DC	On-Demand	Anodyne	SLC12A5	51	32
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853557677	GG	On-Demand	Anodyne	HCN1	47	33
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853557677	GG	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853557678	GG	On-Demand	Anodyne	HCN1	47	33
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853557678	GG	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853557679	GG	On-Demand	Anodyne	HCN1	47	33
CCOc1ccccc1[C@H](C)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853557679	GG	On-Demand	Anodyne	HCN4	41	33
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853557680	GG	On-Demand	Anodyne	HCN1	47	33
CCOc1ccccc1[C@@H](C)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853557680	GG	On-Demand	Anodyne	HCN4	41	33
Cn1c(S)nnc1CCNC(=O)NCc1cccc(Cl)c1Cl	ZINC000853557761	FE	On-Demand	Anodyne	P2RX7	48	43
CCOc1ccccc1[C@@H](C)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853557950	GF	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@@H](C)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853557950	GF	On-Demand	Anodyne	HCN4	43	35
CCOc1ccccc1[C@H](C)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853557951	GF	On-Demand	Anodyne	HCN1	50	35
CCOc1ccccc1[C@H](C)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853557951	GF	On-Demand	Anodyne	HCN4	43	35
C[C@@H](CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1)NC(=O)OC(C)(C)C	ZINC000853558018	FD	On-Demand	Anodyne	CA2	22	41
C[C@@H](CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1)NC(=O)OC(C)(C)C	ZINC000853558018	FD	On-Demand	Anodyne	CA1	18	41
C[C@@H](CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1)NC(=O)OC(C)(C)C	ZINC000853558018	FD	On-Demand	Anodyne	NCE103	46	31
C[C@@H](CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1)NC(=O)OC(C)(C)C	ZINC000853558018	FD	On-Demand	Anodyne	MTCA1	42	31
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000853558030	FE	On-Demand	Anodyne	P2RX7	47	39
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2ccc(F)cc2F)C1	ZINC000853558031	FE	On-Demand	Anodyne	P2RX7	47	39
CON(C)CCNC(=O)NCc1cccc2ccccc12	ZINC000853558129	CE	On-Demand	Anodyne	NQO2	39	40
CON(C)CCNC(=O)NCc1cccc2ccccc12	ZINC000853558129	CE	On-Demand	Anodyne	MTNR1A	51	57
CON(C)CCNC(=O)NCc1cccc2ccccc12	ZINC000853558129	CE	On-Demand	Anodyne	AMP1_PLAFQ	15	45
C#CCCN(CCOC)C(=O)NCc1ccc(F)cc1F	ZINC000853558188	CE	On-Demand	Mild	P2RX7	24	40
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(c2cc(F)ncn2)C1	ZINC000853558227	EF	On-Demand	Anodyne	RBP4	63	32
O[C@H]1C[C@@H](c2ccccc2C(F)(F)F)N(c2cc(F)ncn2)C1	ZINC000853558229	EF	On-Demand	Anodyne	RBP4	63	32
O[C@H]1C[C@H](c2ccccc2C(F)(F)F)N(c2cc(F)ncn2)C1	ZINC000853558231	EF	On-Demand	Anodyne	RBP4	63	32
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(c2cc(F)ncn2)C1	ZINC000853558233	EF	On-Demand	Anodyne	RBP4	63	32
O=C1CCCN1CN1CC[C@@H](c2cccc(F)c2)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853558298	GE	On-Demand	Anodyne	CCR5	87	37
CON(C)CCNC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558327	DD	On-Demand	Anodyne	EDNRB	40	34
CON(C)CCNC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558327	DD	On-Demand	Anodyne	EDNRA	42	34
CON(C)CCNC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558327	DD	On-Demand	Anodyne	BMP1	69	41
CON(C)CCNC(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558327	DD	On-Demand	Anodyne	NOS2	81	34
CON(C)CCNC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558328	DD	On-Demand	Anodyne	EDNRB	40	34
CON(C)CCNC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558328	DD	On-Demand	Anodyne	EDNRA	42	34
CON(C)CCNC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558328	DD	On-Demand	Anodyne	BMP1	69	41
CON(C)CCNC(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000853558328	DD	On-Demand	Anodyne	NOS2	81	34
CON(C)CCNC(=O)NCc1ccc(F)cc1F	ZINC000853558364	CD	On-Demand	Anodyne	P2RX7	44	43
C#Cc1cccnc1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853558410	CF	On-Demand	Mild	DRD4	26	44
C#Cc1cccnc1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853558410	CF	On-Demand	Mild	ACHE	39	50
C#Cc1cccnc1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853558410	CF	On-Demand	Mild	GRIN2B	24	44
C#Cc1cccnc1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853558410	CF	On-Demand	Mild	SIGMAR1	33	42
C#Cc1cccnc1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000853558415	CF	On-Demand	Mild	DRD4	26	44
C#Cc1cccnc1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000853558415	CF	On-Demand	Mild	ACHE	39	50
C#Cc1cccnc1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000853558415	CF	On-Demand	Mild	GRIN2B	24	44
C#Cc1cccnc1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000853558415	CF	On-Demand	Mild	SIGMAR1	33	42
C[C@@H](CNc1ccccc1S(=O)(=O)N(C)C)NC(=O)OC(C)(C)C	ZINC000853558428	FE	On-Demand	Anodyne	FPR1	48	38
O[C@@H]1C[C@H](c2ccccc2C(F)(F)F)N(c2cnc(F)cn2)C1	ZINC000853558458	EF	On-Demand	Anodyne	RBP4	61	33
O[C@H]1C[C@@H](c2ccccc2C(F)(F)F)N(c2cnc(F)cn2)C1	ZINC000853558463	EF	On-Demand	Anodyne	RBP4	61	33
O[C@H]1C[C@H](c2ccccc2C(F)(F)F)N(c2cnc(F)cn2)C1	ZINC000853558471	EF	On-Demand	Anodyne	RBP4	61	33
O[C@@H]1C[C@@H](c2ccccc2C(F)(F)F)N(c2cnc(F)cn2)C1	ZINC000853558479	EF	On-Demand	Anodyne	RBP4	61	33
CCCOc1ccc([C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853558542	FI	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853558542	FI	On-Demand	Anodyne	ACACB	27	50
CCCOc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853558546	FI	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853558546	FI	On-Demand	Anodyne	ACACB	27	50
CCCOc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853558549	FI	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853558549	FI	On-Demand	Anodyne	ACACB	27	50
CCCOc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853558553	FI	On-Demand	Anodyne	ACACA	26	50
CCCOc1ccc([C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853558553	FI	On-Demand	Anodyne	ACACB	27	50
C[C@@H](CNc1nc2ncccc2cc1C#N)NC(=O)OC(C)(C)C	ZINC000853558684	EF	On-Demand	Mild	PAPA1_CARPA	33	40
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	ACE	32	40
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	MME	114	42
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	ANPEP	65	37
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	FCER2	41	32
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	PAPA1_CARPA	61	40
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	CPA1	47	36
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	CAPNS1	58	33
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	CAPN1	61	40
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	CAPN2	45	32
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	ACE2	42	36
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	FPR1	45	40
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	NPR	51	41
CON(C)CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853558754	EF	On-Demand	Anodyne	AMP1_PLAFQ	42	39
O=C(N[C@H]1CN(Cn2cnnc2)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853558762	FD	On-Demand	Anodyne	CCR5	96	38
CN(C[C@@H]1COCCO1)CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853558847	EC	On-Demand	Anodyne	GHRL	45	36
CN(C[C@@H]1COCCO1)CN1C(=O)C(=O)c2cc(-c3ccccc3)ccc21	ZINC000853558850	FE	On-Demand	Anodyne	ALDH1A1	41	34
CN(C[C@@H]1COCCO1)CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853558851	EC	On-Demand	Anodyne	GHRL	45	36
Cc1ccc([C@H](C)NC(=O)N2CCc3nnc(-c4cnn(C)c4)cc3C2)cc1C	ZINC000853558923	GG	On-Demand	Anodyne	MAPK1	45	47
CCOc1ccccc1[C@@H](C)NC(=O)NCCc1nnc(S)n1C	ZINC000853558944	EE	On-Demand	Anodyne	HCN1	41	34
CCOc1ccccc1[C@H](C)NC(=O)NCCc1nnc(S)n1C	ZINC000853558947	EE	On-Demand	Anodyne	HCN1	41	34
Cn1nnc2c(N(CCCNC(=O)OC(C)(C)C)Cc3ccccc3)ncnc21	ZINC000853558999	GF	On-Demand	Anodyne	FPR1	43	37
O=C1CC[C@@H]2CN(CN3C[C@@]4(CN5CCC4CC5)OC3=O)CC[C@H]2N1	ZINC000853559064	EC	On-Demand	Anodyne	CHRNA7	15	52
O=C1CC[C@@H]2CN(CN3C[C@@]4(CN5CCC4CC5)OC3=O)CC[C@@H]2N1	ZINC000853559066	EC	On-Demand	Anodyne	CHRNA7	15	52
COCCN(CCF)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000853559067	DF	On-Demand	Anodyne	BDKRB1	59	46
O=C1CC[C@@H]2CN(CN3C[C@]4(CN5CCC4CC5)OC3=O)CC[C@H]2N1	ZINC000853559068	EC	On-Demand	Anodyne	CHRNA7	15	52
O=C1CC[C@@H]2CN(CN3C[C@]4(CN5CCC4CC5)OC3=O)CC[C@@H]2N1	ZINC000853559071	EC	On-Demand	Anodyne	CHRNA7	15	52
CN(C[C@@H]1COCCO1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853559180	ED	On-Demand	Bother	SLC27A4	42	32
CN(C[C@@H]1COCCO1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853559184	ED	On-Demand	Bother	SLC27A4	42	32
C[C@@H](CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000853559187	FD	On-Demand	Bother	CA2	16	40
C[C@@H](CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)NC(=O)OC(C)(C)C	ZINC000853559187	FD	On-Demand	Bother	COLA	44	42
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853559189	FG	On-Demand	Anodyne	BMP1	55	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853559189	FG	On-Demand	Anodyne	NOS2	88	33
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853559191	FG	On-Demand	Anodyne	BMP1	55	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853559191	FG	On-Demand	Anodyne	NOS2	88	33
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853559193	FG	On-Demand	Anodyne	BMP1	55	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853559193	FG	On-Demand	Anodyne	NOS2	88	33
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853559194	FG	On-Demand	Anodyne	BMP1	55	35
C[C@H](CCc1ccc2c(c1)OCO2)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853559194	FG	On-Demand	Anodyne	NOS2	88	33
CN(C[C@@H]1COCCO1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853559260	GC	On-Demand	Bother	SLC27A4	48	31
CN(C[C@@H]1COCCO1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853559261	GC	On-Demand	Bother	SLC27A4	48	31
CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)c1cc(C#N)cnn1	ZINC000853559321	FG	On-Demand	Mild	CTSB	15	42
CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)c1cc(C#N)cnn1	ZINC000853559321	FG	On-Demand	Mild	PAPA1_CARPA	41	40
CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)c1cc(C#N)cnn1	ZINC000853559321	FG	On-Demand	Mild	CTRB_BOVIN	52	32
C[C@@H]1CCN(CN2CC[C@H](N(C)CCc3ccccc3)C2)C1=O	ZINC000853559325	DE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@H]1CCN(CN2CC[C@@H](N(C)CCc3ccccc3)C2)C1=O	ZINC000853559328	DE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@@H]1CCN(CN2CC[C@@H](N(C)CCc3ccccc3)C2)C1=O	ZINC000853559330	DE	On-Demand	Anodyne	SIGMAR1	25	40
C[C@H]1CCN(CN2CC[C@H](N(C)CCc3ccccc3)C2)C1=O	ZINC000853559332	DE	On-Demand	Anodyne	SIGMAR1	25	40
C#CCCN(CCOC)C(=O)NCc1cccc(Cl)c1Cl	ZINC000853559385	EG	On-Demand	Mild	P2RX7	29	41
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853559388	GH	On-Demand	Anodyne	ACACA	21	45
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853559388	GH	On-Demand	Anodyne	ACACB	21	45
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853559391	GH	On-Demand	Anodyne	ACACA	21	45
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853559391	GH	On-Demand	Anodyne	ACACB	21	45
Fc1cnc(N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000853559434	DH	On-Demand	Anodyne	PRCP	18	42
Fc1cnc(N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)cn1	ZINC000853559436	DH	On-Demand	Anodyne	PRCP	18	42
CCOC(=O)c1cnn(CN2CC[C@H](N(C)CCc3ccccc3)C2)c1	ZINC000853559502	FE	On-Demand	Anodyne	MBTPS1	59	33
CCOC(=O)c1cnn(CN2CC[C@@H](N(C)CCc3ccccc3)C2)c1	ZINC000853559504	FE	On-Demand	Anodyne	MBTPS1	59	33
C[C@@H]1CC(=O)N(CN2CC[C@H](N(C)CCc3ccccc3)C2)C1	ZINC000853559512	DE	On-Demand	Anodyne	SIGMAR1	23	42
C[C@H]1CC(=O)N(CN2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853559514	DE	On-Demand	Anodyne	SIGMAR1	23	42
C[C@@H]1CC(=O)N(CN2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853559516	DE	On-Demand	Anodyne	SIGMAR1	23	42
C[C@H]1CC(=O)N(CN2CC[C@H](N(C)CCc3ccccc3)C2)C1	ZINC000853559518	DE	On-Demand	Anodyne	SIGMAR1	23	42
CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)c1cnccn1	ZINC000853559520	EG	On-Demand	Anodyne	SSTR4	19	40
C#CCCN(CCOC)C(=O)N[C@@H](C)CCc1ccc2c(c1)OCO2	ZINC000853559714	EE	On-Demand	Mild	BMP1	60	37
C#CCCN(CCOC)C(=O)N[C@H](C)CCc1ccc2c(c1)OCO2	ZINC000853559716	EE	On-Demand	Mild	BMP1	60	37
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2C2CC2)cc1	ZINC000853559726	GG	On-Demand	Anodyne	ACACA	17	46
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2C2CC2)cc1	ZINC000853559726	GG	On-Demand	Anodyne	ACACB	17	46
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2C2CC2)cc1	ZINC000853559727	GG	On-Demand	Anodyne	ACACA	17	46
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2C2CC2)cc1	ZINC000853559727	GG	On-Demand	Anodyne	ACACB	17	46
CCCOc1ccc([C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853559745	DE	On-Demand	Anodyne	ACACA	26	53
CCCOc1ccc([C@@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853559745	DE	On-Demand	Anodyne	ACACB	27	53
CCCOc1ccc([C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853559748	DE	On-Demand	Anodyne	ACACA	26	53
CCCOc1ccc([C@H](C)NC(=O)NCCN(C)OC)cc1	ZINC000853559748	DE	On-Demand	Anodyne	ACACB	27	53
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2c(F)cccc2Cl)C1	ZINC000853559798	GF	On-Demand	Anodyne	P2RX7	19	43
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2c(F)cccc2Cl)C1	ZINC000853559799	GF	On-Demand	Anodyne	P2RX7	19	43
COC(=O)c1ncn(CN2CC[C@H](N(C)CCc3ccccc3)C2)n1	ZINC000853559992	ED	On-Demand	Anodyne	SIGMAR1	30	41
COC(=O)c1ncn(CN2CC[C@@H](N(C)CCc3ccccc3)C2)n1	ZINC000853559994	ED	On-Demand	Anodyne	SIGMAR1	30	41
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(OCCC)cc1	ZINC000853560062	EG	On-Demand	Mild	ACACA	31	54
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(OCCC)cc1	ZINC000853560062	EG	On-Demand	Mild	ACACB	31	54
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(OCCC)cc1	ZINC000853560063	EG	On-Demand	Mild	ACACA	31	54
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(OCCC)cc1	ZINC000853560063	EG	On-Demand	Mild	ACACB	31	54
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853560070	FE	On-Demand	Anodyne	ACACA	21	46
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853560070	FE	On-Demand	Anodyne	ACACB	21	46
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853560072	FE	On-Demand	Anodyne	ACACA	21	46
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853560072	FE	On-Demand	Anodyne	ACACB	21	46
Cc1ccn(CN2CC[C@H](N(C)CCc3ccccc3)C2)c(=O)c1C#N	ZINC000853560123	FE	On-Demand	Mild	GRM2	15	42
Cc1ccn(CN2CC[C@@H](N(C)CCc3ccccc3)C2)c(=O)c1C#N	ZINC000853560126	FE	On-Demand	Mild	GRM2	15	42
O=C(NCCc1nnc(S)n1C1CC1)NCc1cccc(Cl)c1Cl	ZINC000853560148	GG	On-Demand	Anodyne	P2RX7	38	42
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2CC)cc1	ZINC000853560277	GF	On-Demand	Anodyne	ACACA	21	45
CCCOc1ccc([C@@H](C)NC(=O)NCCc2nnc(S)n2CC)cc1	ZINC000853560277	GF	On-Demand	Anodyne	ACACB	21	45
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2CC)cc1	ZINC000853560279	GF	On-Demand	Anodyne	ACACA	21	45
CCCOc1ccc([C@H](C)NC(=O)NCCc2nnc(S)n2CC)cc1	ZINC000853560279	GF	On-Demand	Anodyne	ACACB	21	45
CCOC(=O)c1nccc(SCC(=O)OCc2ccccc2)n1	ZINC000853560356	EE	On-Demand	Anodyne	PPIA	31	42
CCNc1nccnc1NC[C@H](C)NC(=O)OC(C)(C)C	ZINC000853560373	CE	On-Demand	Anodyne	CTSK	17	41
CCNc1nccnc1NC[C@@H](C)NC(=O)OC(C)(C)C	ZINC000853560375	CE	On-Demand	Anodyne	CTSK	17	41
C[C@@H](CNc1ncnc2c1ncn2-c1ccccc1)NC(=O)OC(C)(C)C	ZINC000853560386	FG	On-Demand	Anodyne	ADORA1	23	42
C[C@@H](CNc1ncnc2c1ncn2-c1ccccc1)NC(=O)OC(C)(C)C	ZINC000853560386	FG	On-Demand	Anodyne	ADORA3	51	39
O=C1CC[C@@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@H]2N1	ZINC000853560479	GC	On-Demand	Anodyne	ACHE	21	42
O=C1CC[C@@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@H]2N1	ZINC000853560479	GC	On-Demand	Anodyne	SIGMAR1	41	44
O=C1CC[C@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@H]2N1	ZINC000853560480	GC	On-Demand	Anodyne	ACHE	21	42
O=C1CC[C@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@H]2N1	ZINC000853560480	GC	On-Demand	Anodyne	SIGMAR1	41	44
O=C1CC[C@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853560481	GC	On-Demand	Anodyne	ACHE	21	42
O=C1CC[C@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853560481	GC	On-Demand	Anodyne	SIGMAR1	41	44
O=C1CC[C@@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853560482	GC	On-Demand	Anodyne	ACHE	21	42
O=C1CC[C@@H]2CN(CN3C(=O)[C@@H]4CN(Cc5ccccc5)C[C@@H]4C3=O)CC[C@@H]2N1	ZINC000853560482	GC	On-Demand	Anodyne	SIGMAR1	41	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(F)cc1F	ZINC000853560487	GG	On-Demand	Anodyne	P2RX7	63	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(F)cc1F	ZINC000853560487	GG	On-Demand	Anodyne	GPR119	39	49
N#Cc1ncc(Br)cc1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853560559	FH	On-Demand	Mild	DRD4	25	44
N#Cc1ncc(Br)cc1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853560559	FH	On-Demand	Mild	ACHE	36	42
N#Cc1ncc(Br)cc1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853560559	FH	On-Demand	Mild	SIGMAR1	32	40
N#Cc1ncc(Br)cc1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000853560560	FH	On-Demand	Mild	DRD4	25	44
N#Cc1ncc(Br)cc1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000853560560	FH	On-Demand	Mild	ACHE	36	42
N#Cc1ncc(Br)cc1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000853560560	FH	On-Demand	Mild	SIGMAR1	32	40
COC(=O)Cc1ccnc(NC[C@@H](C)NC(=O)OC(C)(C)C)c1	ZINC000853560622	DE	On-Demand	Anodyne	FPR1	41	35
COC(=O)Cc1ccnc(NC[C@H](C)NC(=O)OC(C)(C)C)c1	ZINC000853560624	DE	On-Demand	Anodyne	FPR1	41	35
CC(C)(C)OC(=O)NCCCN(Cc1ccccc1)c1cc(F)ncn1	ZINC000853560674	FH	On-Demand	Anodyne	FPR1	40	36
C[C@@H](CNc1noc2ccc(S(N)(=O)=O)cc12)NC(=O)OC(C)(C)C	ZINC000853560825	FD	On-Demand	Anodyne	CA2	22	43
C[C@@H](CNc1noc2ccc(S(N)(=O)=O)cc12)NC(=O)OC(C)(C)C	ZINC000853560825	FD	On-Demand	Anodyne	CA1	15	43
Fc1cnc(NC[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560849	CF	On-Demand	Anodyne	DRD4	34	47
Fc1cnc(NC[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560849	CF	On-Demand	Anodyne	ACHE	42	47
Fc1cnc(NC[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560849	CF	On-Demand	Anodyne	GRIN2B	26	41
Fc1cnc(NC[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560849	CF	On-Demand	Anodyne	SIGMAR1	52	44
Fc1cnc(NC[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560850	CF	On-Demand	Anodyne	DRD4	34	47
Fc1cnc(NC[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560850	CF	On-Demand	Anodyne	ACHE	42	47
Fc1cnc(NC[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560850	CF	On-Demand	Anodyne	GRIN2B	26	41
Fc1cnc(NC[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000853560850	CF	On-Demand	Anodyne	SIGMAR1	52	44
Cn1c(S)nnc1CCNC(=O)NC(Cc1ccccc1)Cc1ccccc1	ZINC000853560851	GF	On-Demand	Anodyne	MME	79	39
CCOc1ccccc1[C@@H](C)NC(=O)NCCc1nnc(S)n1CC	ZINC000853560861	FF	On-Demand	Anodyne	HCN1	40	34
CCOc1ccccc1[C@H](C)NC(=O)NCCc1nnc(S)n1CC	ZINC000853560862	FF	On-Demand	Anodyne	HCN1	40	34
CN(C[C@@H]1COCCO1)CN1C(=O)C(=O)c2ccccc21	ZINC000853560900	CC	On-Demand	Anodyne	ALDH1A1	49	40
CN(C[C@@H]1COCCO1)CN1C(=O)C(=O)c2ccccc21	ZINC000853560900	CC	On-Demand	Anodyne	ALDH3A1	37	40
Fc1cc(N2CCCC[C@H]2c2ncc(-c3ccccc3)[nH]2)ncn1	ZINC000853560967	DH	On-Demand	Anodyne	PRCP	23	42
Fc1cc(N2CCCC[C@@H]2c2ncc(-c3ccccc3)[nH]2)ncn1	ZINC000853560968	DH	On-Demand	Anodyne	PRCP	23	42
CN1C(=O)C(=O)N(CN2CC[C@H](N(C)CCc3ccccc3)C2)C1=O	ZINC000853561001	EC	On-Demand	Anodyne	SIGMAR1	30	40
CN1C(=O)C(=O)N(CN2CC[C@@H](N(C)CCc3ccccc3)C2)C1=O	ZINC000853561003	EC	On-Demand	Anodyne	SIGMAR1	30	40
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4cc(-c5ccccc5)ccc43)CC[C@@H]2N1	ZINC000853561075	GE	On-Demand	Anodyne	CASP7	41	33
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4cc(-c5ccccc5)ccc43)CC[C@H]2N1	ZINC000853561076	GE	On-Demand	Anodyne	CASP7	41	33
O=C1CC[C@@H]2CN(CN3C(=O)C(=O)c4cc(-c5ccccc5)ccc43)CC[C@@H]2N1	ZINC000853561077	GE	On-Demand	Anodyne	CASP7	41	33
O=C1CC[C@H]2CN(CN3C(=O)C(=O)c4cc(-c5ccccc5)ccc43)CC[C@H]2N1	ZINC000853561078	GE	On-Demand	Anodyne	CASP7	41	33
COc1ccccc1-n1cnn(CN2CC[C@@H]3NC(=O)CC[C@H]3C2)c1=S	ZINC000853561095	FD	On-Demand	Anodyne	HTR1A	50	38
COc1ccccc1-n1cnn(CN2CC[C@@H]3NC(=O)CC[C@H]3C2)c1=S	ZINC000853561095	FD	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1-n1cnn(CN2CC[C@@H]3NC(=O)CC[C@@H]3C2)c1=S	ZINC000853561096	FD	On-Demand	Anodyne	HTR1A	50	38
COc1ccccc1-n1cnn(CN2CC[C@@H]3NC(=O)CC[C@@H]3C2)c1=S	ZINC000853561096	FD	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1-n1cnn(CN2CC[C@H]3NC(=O)CC[C@H]3C2)c1=S	ZINC000853561097	FD	On-Demand	Anodyne	HTR1A	50	38
COc1ccccc1-n1cnn(CN2CC[C@H]3NC(=O)CC[C@H]3C2)c1=S	ZINC000853561097	FD	On-Demand	Anodyne	ADRA1D	40	36
COc1ccccc1-n1cnn(CN2CC[C@H]3NC(=O)CC[C@@H]3C2)c1=S	ZINC000853561098	FD	On-Demand	Anodyne	HTR1A	50	38
COc1ccccc1-n1cnn(CN2CC[C@H]3NC(=O)CC[C@@H]3C2)c1=S	ZINC000853561098	FD	On-Demand	Anodyne	ADRA1D	40	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000853561222	FG	On-Demand	Mild	BDKRB1	46	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000853561223	FG	On-Demand	Mild	BDKRB1	46	42
CCOc1ccccc1[C@@H](C)NC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853561288	GF	On-Demand	Anodyne	HCN1	53	34
CCOc1ccccc1[C@@H](C)NC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853561288	GF	On-Demand	Anodyne	HCN4	48	34
CCOc1ccccc1[C@H](C)NC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853561289	GF	On-Demand	Anodyne	HCN1	53	34
CCOc1ccccc1[C@H](C)NC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853561289	GF	On-Demand	Anodyne	HCN4	48	34
C#CCCN(CCOC)C(=O)N[C@@H]1CCCc2cc(OC)ccc21	ZINC000853561330	EF	On-Demand	Mild	BDKRB1	49	44
C#CCCN(CCOC)C(=O)N[C@H]1CCCc2cc(OC)ccc21	ZINC000853561331	EF	On-Demand	Mild	BDKRB1	49	44
Nc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nc1[N+](=O)[O-]	ZINC000853561362	GF	On-Demand	Bother	TGM2	20	41
Nc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nc1[N+](=O)[O-]	ZINC000853561363	GF	On-Demand	Bother	TGM2	20	41
C#Cc1cccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561410	EG	On-Demand	Mild	GRIN2B	22	42
C#Cc1cccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561410	EG	On-Demand	Mild	PREP	36	42
C#Cc1cccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561410	EG	On-Demand	Mild	TGM2	23	40
C#Cc1cccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561411	EG	On-Demand	Mild	GRIN2B	22	42
C#Cc1cccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561411	EG	On-Demand	Mild	PREP	36	42
C#Cc1cccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561411	EG	On-Demand	Mild	TGM2	23	40
C#CCCN(CCOC)C(=O)NCCc1ccc(OC)cc1OC	ZINC000853561438	ED	On-Demand	Mild	MTNR1A	72	40
C#CCCN(CCOC)C(=O)NCCc1ccc(OC)cc1OC	ZINC000853561438	ED	On-Demand	Mild	MTNR1B	55	38
CCOC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561447	GF	On-Demand	Anodyne	CTRA_BOVIN	46	30
CCOC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561447	GF	On-Demand	Anodyne	PREP	30	40
CCOC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561447	GF	On-Demand	Anodyne	CAPNS1	47	32
CCOC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561447	GF	On-Demand	Anodyne	CAPN1	54	43
CCOC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561447	GF	On-Demand	Anodyne	CAPN2	93	43
CCOC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561447	GF	On-Demand	Anodyne	NPR	58	34
CCOC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561448	GF	On-Demand	Anodyne	CTRA_BOVIN	46	30
CCOC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561448	GF	On-Demand	Anodyne	PREP	30	40
CCOC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561448	GF	On-Demand	Anodyne	CAPNS1	47	32
CCOC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561448	GF	On-Demand	Anodyne	CAPN1	54	43
CCOC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561448	GF	On-Demand	Anodyne	CAPN2	93	43
CCOC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561448	GF	On-Demand	Anodyne	NPR	58	34
COC(=O)c1cccc(NNC(=O)NCCc2ccc(OC)cc2OC)c1C	ZINC000853561490	GF	On-Demand	Reactive	NQO2	33	41
COC(=O)c1cccc(NNC(=O)NCCc2ccc(OC)cc2OC)c1C	ZINC000853561490	GF	On-Demand	Reactive	MTNR1A	95	44
COC(=O)c1cccc(NNC(=O)NCCc2ccc(OC)cc2OC)c1C	ZINC000853561490	GF	On-Demand	Reactive	MTNR1B	73	41
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	ACE	24	41
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	GRIN2B	25	40
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	CTRA_BOVIN	63	33
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	CTSG	43	33
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	PREP	38	42
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	CAPNS1	41	32
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	CELA2A	51	33
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	CAPN1	46	41
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	CAPN2	82	41
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	TGM2	29	41
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	NPR	59	33
Cn1ncnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561508	ED	On-Demand	Anodyne	SLC12A5	55	38
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	ACE	24	41
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	GRIN2B	25	40
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	CTRA_BOVIN	63	33
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	CTSG	43	33
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	PREP	38	42
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	CAPNS1	41	32
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	CELA2A	51	33
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	CAPN1	46	41
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	CAPN2	82	41
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	TGM2	29	41
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	NPR	59	33
Cn1ncnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561509	ED	On-Demand	Anodyne	SLC12A5	55	38
N#Cc1nc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561511	GH	On-Demand	Mild	CTSK	23	41
N#Cc1nc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561511	GH	On-Demand	Mild	DPP4	22	43
N#Cc1nc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561511	GH	On-Demand	Mild	PREP	30	44
N#Cc1nc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561511	GH	On-Demand	Mild	CAPN1	15	40
N#Cc1nc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561511	GH	On-Demand	Mild	CAPN2	35	40
N#Cc1nc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561511	GH	On-Demand	Mild	SLC12A5	42	33
N#Cc1nc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561512	GH	On-Demand	Mild	CTSK	23	41
N#Cc1nc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561512	GH	On-Demand	Mild	DPP4	22	43
N#Cc1nc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561512	GH	On-Demand	Mild	PREP	30	44
N#Cc1nc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561512	GH	On-Demand	Mild	CAPN1	15	40
N#Cc1nc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561512	GH	On-Demand	Mild	CAPN2	35	40
N#Cc1nc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)sc1Cl	ZINC000853561512	GH	On-Demand	Mild	SLC12A5	42	33
CON(C)CCNC(=O)NCCCOc1ccc(F)cc1	ZINC000853561513	CD	On-Demand	Anodyne	FDPS	17	43
CON(C)CCNC(=O)NCCCOc1ccc(F)cc1	ZINC000853561513	CD	On-Demand	Anodyne	LTA4H	23	52
CON(C)CCNC(=O)NCCCOc1ccc(F)cc1	ZINC000853561513	CD	On-Demand	Anodyne	LSS	25	43
CC(=O)N1CCC[C@H](CNc2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853561528	FI	On-Demand	Anodyne	CACNA1I	46	32
CC(=O)N1CCC[C@@H](CNc2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853561529	FI	On-Demand	Anodyne	CACNA1I	46	32
CN(CC1=CCCOC1)CN1C(=O)C(=O)c2ccccc21	ZINC000853561554	CD	On-Demand	Anodyne	ALDH1A1	50	42
CN(CC1=CCCOC1)CN1C(=O)C(=O)c2ccccc21	ZINC000853561554	CD	On-Demand	Anodyne	ALDH3A1	38	42
CN(CC1=CCCOC1)CN1C(=O)C(=O)c2ccccc21	ZINC000853561554	CD	On-Demand	Anodyne	CES1	16	42
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	GRIN2B	24	42
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	CTRA_BOVIN	47	31
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	CTSK	27	40
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	PREP	33	40
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	CELA2A	40	31
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	CAPN1	36	42
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	CAPN2	76	42
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	TGM2	32	42
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	NPR	55	34
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	F13A1	16	42
CCNc1nccnc1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561600	FG	On-Demand	Anodyne	SLC12A5	48	36
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	GRIN2B	24	42
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	CTRA_BOVIN	47	31
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	CTSK	27	40
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	PREP	33	40
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	CELA2A	40	31
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	CAPN1	36	42
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	CAPN2	76	42
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	TGM2	32	42
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	NPR	55	34
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	F13A1	16	42
CCNc1nccnc1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853561601	FG	On-Demand	Anodyne	SLC12A5	48	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1ccc(OC)cc1OC	ZINC000853561604	GE	On-Demand	Mild	MTNR1A	56	37
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1ccc(OC)cc1OC	ZINC000853561604	GE	On-Demand	Mild	MTNR1B	43	36
Cn1nnc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561613	GD	On-Demand	Anodyne	CTRA_BOVIN	53	31
Cn1nnc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561613	GD	On-Demand	Anodyne	CTSG	40	31
Cn1nnc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561613	GD	On-Demand	Anodyne	CELA2A	40	31
Cn1nnc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561613	GD	On-Demand	Anodyne	CAPN1	41	41
Cn1nnc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561613	GD	On-Demand	Anodyne	CAPN2	68	41
Cn1nnc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561613	GD	On-Demand	Anodyne	NPR	56	33
Cn1nnc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561614	GD	On-Demand	Anodyne	CTRA_BOVIN	53	31
Cn1nnc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561614	GD	On-Demand	Anodyne	CTSG	40	31
Cn1nnc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561614	GD	On-Demand	Anodyne	CELA2A	40	31
Cn1nnc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561614	GD	On-Demand	Anodyne	CAPN1	41	41
Cn1nnc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561614	GD	On-Demand	Anodyne	CAPN2	68	41
Cn1nnc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)ncnc21	ZINC000853561614	GD	On-Demand	Anodyne	NPR	56	33
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	GRIN2B	25	40
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	CTRA_BOVIN	60	31
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	TRY1_BOVIN	40	31
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	CTSG	41	31
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	PREP	44	36
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	CELA2A	48	31
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	TGM2	29	41
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	NPR	50	32
O=C(NC[C@H]1CCCN(c2cnc(F)cn2)C1)OCc1ccccc1	ZINC000853561622	EF	On-Demand	Anodyne	SLC12A5	48	36
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	F2	28	42
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	ACE	27	42
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CTRA_BOVIN	52	31
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	KLK3	49	33
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CTSB	35	40
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CTSK	30	40
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CTSL	34	40
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	DPP4	16	40
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	PREP	39	43
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CAPNS1	51	32
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CELA2A	40	31
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CAPN1	52	42
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	CAPN2	88	42
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	TGM2	31	42
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	NPR	62	34
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	F13A1	16	42
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	SCD1	43	38
Cc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561627	EF	On-Demand	Anodyne	SLC12A5	60	39
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	F2	28	42
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	ACE	27	42
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CTRA_BOVIN	52	31
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	KLK3	49	33
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CTSB	35	40
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CTSK	30	40
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CTSL	34	40
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	DPP4	16	40
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	PREP	39	43
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CAPNS1	51	32
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CELA2A	40	31
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CAPN1	52	42
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	CAPN2	88	42
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	TGM2	31	42
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	NPR	62	34
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	F13A1	16	42
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	SCD1	43	38
Cc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561628	EF	On-Demand	Anodyne	SLC12A5	60	39
COC(=O)Cc1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561655	GF	On-Demand	Anodyne	ELANE	18	40
COC(=O)Cc1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561655	GF	On-Demand	Anodyne	NPR	46	31
COC(=O)Cc1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561655	GF	On-Demand	Anodyne	SLC12A5	47	36
COC(=O)Cc1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561656	GF	On-Demand	Anodyne	ELANE	18	40
COC(=O)Cc1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561656	GF	On-Demand	Anodyne	NPR	46	31
COC(=O)Cc1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561656	GF	On-Demand	Anodyne	SLC12A5	47	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCOc2ccc(F)cc2)C1	ZINC000853561668	GF	On-Demand	Anodyne	HRH2	19	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCOc2ccc(F)cc2)C1	ZINC000853561669	GF	On-Demand	Anodyne	HRH2	19	41
COc1ccc(-c2nnn(CN(C)CC3=CCCOC3)n2)cc1OC	ZINC000853561673	ED	On-Demand	Anodyne	SCARB1	23	41
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	CTRA_BOVIN	51	30
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	CTSB	16	40
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	CTSK	22	40
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	CTSL	19	40
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	DPP4	17	40
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	PREP	27	41
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	CELA2A	46	30
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	TGM2	28	41
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	NPR	46	31
O=C(NC[C@H]1CCCN(c2cc(F)ncn2)C1)OCc1ccccc1	ZINC000853561682	EF	On-Demand	Anodyne	SLC12A5	51	36
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	ACE	15	40
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	GRIN2B	22	40
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	CTRA_BOVIN	46	30
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	DPP4	15	41
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	PREP	34	40
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	CAPN1	40	40
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	CAPN2	57	40
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	TGM2	25	40
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	NPR	53	32
COC(=O)c1nccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561741	GE	On-Demand	Anodyne	SLC12A5	45	38
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	ACE	15	40
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	GRIN2B	22	40
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	CTRA_BOVIN	46	30
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	DPP4	15	41
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	PREP	34	40
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	CAPN1	40	40
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	CAPN2	57	40
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	TGM2	25	40
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	NPR	53	32
COC(=O)c1nccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561742	GE	On-Demand	Anodyne	SLC12A5	45	38
CN(CC1=CCCOC1)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853561775	FD	On-Demand	Bother	SLC27A4	48	32
CN(CC1=CCCOC1)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853561776	FD	On-Demand	Bother	SLC27A4	48	32
CON(C)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000853561781	EE	On-Demand	Anodyne	HRH2	29	51
CON(C)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000853561781	EE	On-Demand	Anodyne	HRH3	31	44
CON(C)CCNC(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000853561781	EE	On-Demand	Anodyne	SIGMAR1	20	41
C#CCCN(CCOC)C(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000853561812	FG	On-Demand	Mild	HRH2	26	40
C#CCCN(CCOC)C(=O)NCc1ccc(CN2CCCCCC2)cc1	ZINC000853561812	FG	On-Demand	Mild	HRH3	23	43
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	F2	22	40
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	ACE	28	40
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	CTRA_BOVIN	41	31
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	PREP	34	41
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	CAPN1	47	42
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	CAPN2	82	42
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	TGM2	27	40
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	NPR	60	35
CCCc1ccc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561877	FH	On-Demand	Anodyne	SLC12A5	48	37
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	F2	22	40
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	ACE	28	40
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	CTRA_BOVIN	41	31
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	PREP	34	41
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	CAPN1	47	42
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	CAPN2	82	42
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	TGM2	27	40
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	NPR	60	35
CCCc1ccc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)nn1	ZINC000853561878	FH	On-Demand	Anodyne	SLC12A5	48	37
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	CTRA_BOVIN	58	30
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	PREP	30	40
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	CELA2A	47	30
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	CAPN1	27	40
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	CAPN2	50	40
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	TGM2	27	40
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	NPR	57	32
Cc1cc(CO)cc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561895	FG	On-Demand	Anodyne	SLC12A5	54	36
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	CTRA_BOVIN	58	30
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	PREP	30	40
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	CELA2A	47	30
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	CAPN1	27	40
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	CAPN2	50	40
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	TGM2	27	40
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	NPR	57	32
Cc1cc(CO)cc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)n1	ZINC000853561896	FG	On-Demand	Anodyne	SLC12A5	54	36
N#Cc1cnnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561909	FE	On-Demand	Mild	CTSK	27	43
N#Cc1cnnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561909	FE	On-Demand	Mild	DPP4	22	42
N#Cc1cnnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561909	FE	On-Demand	Mild	PREP	36	46
N#Cc1cnnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561909	FE	On-Demand	Mild	LGMN	59	37
N#Cc1cnnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561910	FE	On-Demand	Mild	CTSK	27	43
N#Cc1cnnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561910	FE	On-Demand	Mild	DPP4	22	42
N#Cc1cnnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561910	FE	On-Demand	Mild	PREP	36	46
N#Cc1cnnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853561910	FE	On-Demand	Mild	LGMN	59	37
O=C(NC[C@H]1CCCN(c2cc(CO)c(F)cn2)C1)OCc1ccccc1	ZINC000853561937	FF	On-Demand	Anodyne	CTRA_BOVIN	58	30
O=C(NC[C@H]1CCCN(c2cc(CO)c(F)cn2)C1)OCc1ccccc1	ZINC000853561937	FF	On-Demand	Anodyne	PREP	35	40
O=C(NC[C@H]1CCCN(c2cc(CO)c(F)cn2)C1)OCc1ccccc1	ZINC000853561937	FF	On-Demand	Anodyne	CELA2A	47	30
O=C(NC[C@H]1CCCN(c2cc(CO)c(F)cn2)C1)OCc1ccccc1	ZINC000853561937	FF	On-Demand	Anodyne	TGM2	27	40
COc1ccc([C@@H]2CCCN2CN2C(=O)C(=O)c3ccccc32)cc1F	ZINC000853561988	FG	On-Demand	Anodyne	CASP3	60	35
COc1ccc([C@@H]2CCCN2CN2C(=O)C(=O)c3ccccc32)cc1F	ZINC000853561988	FG	On-Demand	Anodyne	ALDH1A1	45	37
COc1ccc([C@@H]2CCCN2CN2C(=O)C(=O)c3ccccc32)cc1F	ZINC000853561988	FG	On-Demand	Anodyne	CASP7	84	35
Cn1ncc(C#N)c1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562021	FE	On-Demand	Mild	CTRA_BOVIN	50	31
Cn1ncc(C#N)c1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562021	FE	On-Demand	Mild	CTSK	31	44
Cn1ncc(C#N)c1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562021	FE	On-Demand	Mild	DPP4	35	44
Cn1ncc(C#N)c1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562021	FE	On-Demand	Mild	PREP	37	45
Cn1ncc(C#N)c1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562021	FE	On-Demand	Mild	CELA2A	40	31
Cn1ncc(C#N)c1N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562021	FE	On-Demand	Mild	NPR	48	31
Cn1ncc(C#N)c1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562023	FE	On-Demand	Mild	CTRA_BOVIN	50	31
Cn1ncc(C#N)c1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562023	FE	On-Demand	Mild	CTSK	31	44
Cn1ncc(C#N)c1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562023	FE	On-Demand	Mild	DPP4	35	44
Cn1ncc(C#N)c1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562023	FE	On-Demand	Mild	PREP	37	45
Cn1ncc(C#N)c1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562023	FE	On-Demand	Mild	CELA2A	40	31
Cn1ncc(C#N)c1N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853562023	FE	On-Demand	Mild	NPR	48	31
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	ACE	15	40
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	GRIN2B	26	40
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	PREP	36	40
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	CAPN1	25	40
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	CAPN2	46	40
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	TGM2	25	40
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	NPR	53	32
CC(=O)c1ccnc(N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562042	FG	On-Demand	Anodyne	SLC12A5	62	38
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	ACE	15	40
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	GRIN2B	26	40
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	PREP	36	40
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	CAPN1	25	40
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	CAPN2	46	40
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	TGM2	25	40
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	NPR	53	32
CC(=O)c1ccnc(N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)c1	ZINC000853562043	FG	On-Demand	Anodyne	SLC12A5	62	38
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853562050	GI	On-Demand	Anodyne	HRH2	24	44
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853562050	GI	On-Demand	Anodyne	HRH3	25	40
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853562050	GI	On-Demand	Anodyne	SIGMAR1	32	47
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853562050	GI	On-Demand	Anodyne	BDKRB1	44	39
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853562050	GI	On-Demand	Anodyne	MCHR2	43	37
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853562050	GI	On-Demand	Anodyne	NPFFR1	42	35
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853562052	GI	On-Demand	Anodyne	HRH2	24	44
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853562052	GI	On-Demand	Anodyne	HRH3	25	40
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853562052	GI	On-Demand	Anodyne	SIGMAR1	32	47
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853562052	GI	On-Demand	Anodyne	BDKRB1	44	39
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853562052	GI	On-Demand	Anodyne	MCHR2	43	37
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853562052	GI	On-Demand	Anodyne	NPFFR1	42	35
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853562054	GI	On-Demand	Anodyne	HRH2	24	44
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853562054	GI	On-Demand	Anodyne	HRH3	25	40
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853562054	GI	On-Demand	Anodyne	SIGMAR1	32	47
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853562054	GI	On-Demand	Anodyne	BDKRB1	44	39
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853562054	GI	On-Demand	Anodyne	MCHR2	43	37
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853562054	GI	On-Demand	Anodyne	NPFFR1	42	35
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853562056	GI	On-Demand	Anodyne	HRH2	24	44
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853562056	GI	On-Demand	Anodyne	HRH3	25	40
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853562056	GI	On-Demand	Anodyne	SIGMAR1	32	47
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853562056	GI	On-Demand	Anodyne	BDKRB1	44	39
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853562056	GI	On-Demand	Anodyne	MCHR2	43	37
O=C(NCc1ccc(CN2CCCCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853562056	GI	On-Demand	Anodyne	NPFFR1	42	35
Nc1ccc2nc(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)sc2c1	ZINC000853562058	GI	On-Demand	Anodyne	PREP	26	41
Nc1ccc2nc(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)sc2c1	ZINC000853562061	GI	On-Demand	Anodyne	PREP	26	41
O=C(NC[C@H]1CCCN(c2ccnc(O)c2[N+](=O)[O-])C1)OCc1ccccc1	ZINC000853562069	GF	On-Demand	Bother	TGM2	20	41
O=C(NC[C@H]1CCCN(c2ccnc(O)c2[N+](=O)[O-])C1)OCc1ccccc1	ZINC000853562069	GF	On-Demand	Bother	SLC12A5	47	36
CN(CC1=CCCOC1)CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853562108	ED	On-Demand	Anodyne	GHRL	45	33
CN(CC1=CCCOC1)CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853562109	ED	On-Demand	Anodyne	GHRL	45	33
O=C(NC[C@H]1CCCN(c2cc(O)nc3cccnc23)C1)OCc1ccccc1	ZINC000853562113	GG	On-Demand	Anodyne	GRIN2B	25	40
Nc1cccc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562135	GH	On-Demand	Anodyne	GRIN2B	26	41
Nc1cccc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562135	GH	On-Demand	Anodyne	CTSK	21	40
Nc1cccc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562135	GH	On-Demand	Anodyne	CTSL	20	40
Nc1cccc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562135	GH	On-Demand	Anodyne	PREP	39	41
Nc1cccc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562135	GH	On-Demand	Anodyne	TGM2	25	40
Nc1cccc2c(N3CCC[C@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562135	GH	On-Demand	Anodyne	NPR	45	31
Nc1cccc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562136	GH	On-Demand	Anodyne	GRIN2B	26	41
Nc1cccc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562136	GH	On-Demand	Anodyne	CTSK	21	40
Nc1cccc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562136	GH	On-Demand	Anodyne	CTSL	20	40
Nc1cccc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562136	GH	On-Demand	Anodyne	PREP	39	41
Nc1cccc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562136	GH	On-Demand	Anodyne	TGM2	25	40
Nc1cccc2c(N3CCC[C@@H](CNC(=O)OCc4ccccc4)C3)nccc12	ZINC000853562136	GH	On-Demand	Anodyne	NPR	45	31
CN(CC1=CCCOC1)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853562285	DD	On-Demand	Anodyne	CHRNA7	15	52
CN(CC1=CCCOC1)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853562286	DD	On-Demand	Anodyne	CHRNA7	15	52
COc1ccc([C@@H]2CCCN2Cc2cc3c(cc2O)OCO3)cc1F	ZINC000853562345	EH	On-Demand	Clean	EDNRA	22	41
Fc1ccc2c(c1)[C@H](Nc1cnc(F)cn1)CCC2	ZINC000853562350	CG	On-Demand	Anodyne	KCNN3	18	51
Fc1ccc2c(c1)[C@@H](Nc1cnc(F)cn1)CCC2	ZINC000853562351	CG	On-Demand	Anodyne	KCNN3	18	51
CN(CC1=CCCOC1)Cn1nnc2c(cnn2C)c1=O	ZINC000853562352	CB	On-Demand	Anodyne	Q9M629_MAIZE	63	38
CN(CC1=CCCOC1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853562359	EE	On-Demand	Bother	SLC27A4	47	31
CN(CC1=CCCOC1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853562360	EE	On-Demand	Bother	SLC27A4	47	31
CN(CC1=CCCOC1)CN1C(=O)C(=O)c2cc(-c3ccccc3)ccc21	ZINC000853562525	FG	On-Demand	Anodyne	ALDH1A1	42	34
C#CCCN(CCOC)C(=O)NCCCc1cccc(Cl)c1	ZINC000853562640	DF	On-Demand	Mild	CRTM	50	40
COc1ccc([C@@H]2CCCN2CN2C(=O)c3ccccc3C2=O)cc1F	ZINC000853562730	FG	On-Demand	Anodyne	ACKR3	44	32
CN(CC1=CCCOC1)CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O	ZINC000853562734	FE	On-Demand	Anodyne	SIGMAR1	26	40
COc1ccc([C@@H]2CCCN2Cn2nc(-c3ccccc3)oc2=O)cc1F	ZINC000853562754	FG	On-Demand	Anodyne	ACKR3	50	31
Fc1ccc2c(c1)[C@H](Nc1cc(F)ncn1)CCC2	ZINC000853562781	CG	On-Demand	Anodyne	KCNN3	19	51
Fc1ccc2c(c1)[C@@H](Nc1cc(F)ncn1)CCC2	ZINC000853562782	CG	On-Demand	Anodyne	KCNN3	19	51
COc1ccc([C@@H]2CCCN2Cn2ncc3ccccc3c2=O)cc1F	ZINC000853562803	FG	On-Demand	Anodyne	NPBWR1	26	43
COC(=O)/C=C\c1ccc(OC)c(Oc2cc(C(C)(C)C)ncn2)c1	ZINC000853562807	EH	On-Demand	Anodyne	TUBB1	43	37
COc1ccc([C@@H]2CCCN2Cn2ncc(Cl)c(Cl)c2=O)cc1F	ZINC000853562814	FG	On-Demand	Anodyne	NPBWR1	29	41
CCC1(CC)CCCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853562878	EF	On-Demand	Anodyne	CHRNA7	16	62
CCC1(CC)CCCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853562881	EF	On-Demand	Anodyne	CHRNA7	16	62
CCC1(CC)CCCN(Cn2nnc3c(cnn3C)c2=O)C1	ZINC000853562887	DD	On-Demand	Anodyne	Q9M629_MAIZE	54	36
COc1ccc([C@@H]2CCCN2Cn2nc3c(cc2=O)Cc2ccccc2-3)cc1F	ZINC000853562948	GH	On-Demand	Anodyne	PTGIR	20	40
CCOc1cc(Nc2ccc(F)c(N3CCOC3=O)c2)nc(C)n1	ZINC000853563034	EG	On-Demand	Anodyne	AGPAT2	44	35
Cn1c(S)nnc1CCNC(=O)NCCCc1cccc(Cl)c1	ZINC000853563042	FE	On-Demand	Anodyne	SCNN1A	46	36
COc1ccc([C@@H]2CCCN2Cn2cnc(-c3ccccc3)n2)cc1F	ZINC000853563093	FH	On-Demand	Anodyne	ACKR3	49	31
COC(=O)c1ncn(CN2CCC[C@@H]2c2ccc(OC)c(F)c2)n1	ZINC000853563123	EE	On-Demand	Anodyne	ACKR3	50	31
COC(=O)c1ncn(CN2CCC[C@H]2c2ccc(OC)c(F)c2)n1	ZINC000853563124	EE	On-Demand	Anodyne	ACKR3	50	31
O=C(NCCCc1cccc(Cl)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853563139	EH	On-Demand	Anodyne	SLC6A5	15	40
O=C(NCCCc1cccc(Cl)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853563140	EH	On-Demand	Anodyne	SLC6A5	15	40
O=C(NCCCc1cccc(Cl)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853563141	EH	On-Demand	Anodyne	SLC6A5	15	40
O=C(NCCCc1cccc(Cl)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853563142	EH	On-Demand	Anodyne	SLC6A5	15	40
COC(=O)c1ccc(=O)n(CN2CCC[C@H]2c2ccc(OC)c(F)c2)n1	ZINC000853563156	FD	On-Demand	Anodyne	ACKR3	51	32
COC(=O)c1ccc(=O)n(CN2CCC[C@@H]2c2ccc(OC)c(F)c2)n1	ZINC000853563157	FD	On-Demand	Anodyne	ACKR3	51	32
CON(C)CCNC(=O)NCCCc1cccc(Cl)c1	ZINC000853563254	CE	On-Demand	Anodyne	MTNR1A	36	47
CON(C)CCNC(=O)NCCCc1cccc(Cl)c1	ZINC000853563254	CE	On-Demand	Anodyne	MTNR1B	33	47
CON(C)CCNC(=O)NCCCc1cccc(Cl)c1	ZINC000853563254	CE	On-Demand	Anodyne	CRTM	55	41
COc1ccc([C@@H]2CCCN2CN2C[C@@]3(CN4CCC3CC4)OC2=O)cc1F	ZINC000853563346	GF	On-Demand	Anodyne	CHRNA7	17	46
COc1ccc([C@@H]2CCCN2CN2C[C@]3(CN4CCC3CC4)OC2=O)cc1F	ZINC000853563348	GF	On-Demand	Anodyne	CHRNA7	17	46
CCOc1cc(Oc2cc(/C=C\C(=O)OC)ccc2OC)nc(C)n1	ZINC000853563388	EG	On-Demand	Anodyne	TUBB1	51	40
CCOc1cc(Oc2cc(/C=C/C(=O)OC)ccc2OC)nc(C)n1	ZINC000853563389	EG	On-Demand	Anodyne	TUBB1	51	40
O=C(NCCCc1cccc(Cl)c1)NCCc1nnc(S)n1C1CC1	ZINC000853563431	GG	On-Demand	Anodyne	SCNN1A	43	36
O=c1c2ccccc2cnn1CN1CCC[C@H](CCF)C1	ZINC000853563448	CE	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	35
O=c1c2ccccc2cnn1CN1CCC[C@@H](CCF)C1	ZINC000853563449	CE	On-Demand	Anodyne	Q8MHZ5_SHEEP	49	35
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)C(=O)N1Cc1ccccc1	ZINC000853563451	EE	On-Demand	Anodyne	ACHE	18	41
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)C(=O)N1Cc1ccccc1	ZINC000853563452	EE	On-Demand	Anodyne	ACHE	18	41
O=C(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)NCCc1ccccc1	ZINC000853563454	GC	On-Demand	Anodyne	CA5B	20	43
O=C(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)NCCc1ccccc1	ZINC000853563454	GC	On-Demand	Anodyne	CA5A	19	43
COc1ccccc1-c1nn(CN2CCC[C@H](CCF)C2)c(=S)o1	ZINC000853563503	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	17	40
COc1ccccc1-c1nn(CN2CCC[C@@H](CCF)C2)c(=S)o1	ZINC000853563504	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	17	40
COc1cccc(Nc2nn(CN3CCC[C@H](CCF)C3)c(=S)s2)c1	ZINC000853563509	GI	On-Demand	Anodyne	CCR3	25	41
COc1cccc(Nc2nn(CN3CCC[C@@H](CCF)C3)c(=S)s2)c1	ZINC000853563510	GI	On-Demand	Anodyne	CCR3	25	41
Cn1c(-c2ccccc2F)nn(CN2CCC[C@H](CCF)C2)c1=S	ZINC000853563518	FH	On-Demand	Anodyne	SLC6A1	41	35
Cn1c(-c2ccccc2F)nn(CN2CCC[C@@H](CCF)C2)c1=S	ZINC000853563519	FH	On-Demand	Anodyne	SLC6A1	41	35
O=c1c2ccccc2nnn1CN1CCC[C@H](CCF)C1	ZINC000853563541	CD	On-Demand	Anodyne	Q8MHZ5_SHEEP	55	35
O=c1c2ccccc2nnn1CN1CCC[C@@H](CCF)C1	ZINC000853563542	CD	On-Demand	Anodyne	Q8MHZ5_SHEEP	55	35
COc1ccc([C@@H]2CCCN2Cn2nnc3c(cnn3C)c2=O)cc1F	ZINC000853563553	FD	On-Demand	Anodyne	Q9M629_MAIZE	71	43
CC(C)(C)OC(=O)N1CC=C(CCNc2cnccn2)CC1	ZINC000853563618	DF	On-Demand	Anodyne	GPR119	21	44
FC1(F)CCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853563688	CH	On-Demand	Anodyne	HTR3A	34	52
C#CCCCOc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853563704	FF	On-Demand	Mild	HTR1A	64	43
C#CCCCOc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853563704	FF	On-Demand	Mild	DRD2	46	42
C#CCCCOc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853563704	FF	On-Demand	Mild	DRD4	27	42
C#CCCCOc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853563704	FF	On-Demand	Mild	ADRA1A	35	40
C#CCCCOc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853563704	FF	On-Demand	Mild	DRD3	49	42
C#CCCCOc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853563704	FF	On-Demand	Mild	HTR7	38	42
C=CCn1c(-c2ccccc2OC)nn(CN2CCC[C@@H](CCF)C2)c1=S	ZINC000853563723	GI	On-Demand	Mild	Q8MHZ5_SHEEP	34	40
C=CCn1c(-c2ccccc2OC)nn(CN2CCC[C@H](CCF)C2)c1=S	ZINC000853563729	GI	On-Demand	Mild	Q8MHZ5_SHEEP	34	40
COc1ccc([C@@H]2CCCN2Cn2nc(C)c3ccccc3c2=O)cc1F	ZINC000853563766	FH	On-Demand	Anodyne	HRH1	42	42
COc1ccc([C@@H]2CCCN2Cn2nc(C)c3ccccc3c2=O)cc1F	ZINC000853563766	FH	On-Demand	Anodyne	ADRA1B	17	42
COc1ccc([C@@H]2CCCN2Cn2nc(C)c3ccccc3c2=O)cc1F	ZINC000853563766	FH	On-Demand	Anodyne	ACKR3	44	31
CCOC(=O)c1cnn(CN2CCC[C@H]2c2ccc(OC)c(F)c2)c1	ZINC000853563853	EG	On-Demand	Anodyne	ACKR3	56	31
CCOC(=O)c1cnn(CN2CCC[C@@H]2c2ccc(OC)c(F)c2)c1	ZINC000853563854	EG	On-Demand	Anodyne	ACKR3	56	31
COc1ccccc1-c1nn(CN2CCC[C@@H](CCF)C2)c(=S)n1C	ZINC000853563880	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	34	42
COc1ccccc1-c1nn(CN2CCC[C@H](CCF)C2)c(=S)n1C	ZINC000853563881	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	34	42
COC(=O)c1nccc(N2CCC(F)(F)CC2)n1	ZINC000853563913	CD	On-Demand	Anodyne	SORD	77	40
Cn1c(-c2ccc(F)cc2)nn(CN2CCC[C@H](CCF)C2)c1=S	ZINC000853563962	FH	On-Demand	Anodyne	CCR3	54	35
Cn1c(-c2ccc(F)cc2)nn(CN2CCC[C@@H](CCF)C2)c1=S	ZINC000853563963	FH	On-Demand	Anodyne	CCR3	54	35
Fc1cnc(N2CCC(c3cccc(Cl)c3)CC2)cn1	ZINC000853563986	CH	On-Demand	Anodyne	MLYCD	15	41
Cn1c(-c2ccccc2Cl)nn(CN2CCC[C@H](CCF)C2)c1=S	ZINC000853564007	FI	On-Demand	Anodyne	SLC6A1	56	36
Cn1c(-c2ccccc2Cl)nn(CN2CCC[C@@H](CCF)C2)c1=S	ZINC000853564009	FI	On-Demand	Anodyne	SLC6A1	56	36
CCn1c(-c2ccccc2)nn(CN2CCC[C@@H](CCF)C2)c1=S	ZINC000853564029	EI	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	35
CCn1c(-c2ccccc2)nn(CN2CCC[C@H](CCF)C2)c1=S	ZINC000853564031	EI	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	35
COc1ccc(-c2nnn(CN3CCC[C@H](CCF)C3)n2)cc1OC	ZINC000853564102	EE	On-Demand	Anodyne	SCARB1	31	43
COc1ccc(-c2nnn(CN3CCC[C@@H](CCF)C3)n2)cc1OC	ZINC000853564103	EE	On-Demand	Anodyne	SCARB1	31	43
COc1ccc(-c2nc(=S)n(CN3CCC[C@H](CCF)C3)[nH]2)cc1	ZINC000853564106	FH	On-Demand	Anodyne	CHEK2	21	43
COc1ccc(-c2nc(=S)n(CN3CCC[C@@H](CCF)C3)[nH]2)cc1	ZINC000853564107	FH	On-Demand	Anodyne	CHEK2	21	43
COC(=O)[C@@]12CCOC[C@@H]1CN(c1ncnc3ccc(C(C)C)cc13)C2	ZINC000853564121	FF	On-Demand	Anodyne	PDGFRB	40	41
C[C@@H]1CN(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CCN1S(C)(=O)=O	ZINC000853564125	GD	On-Demand	Bother	KCNJ1	20	40
C[C@@H]1CN(Cn2nc(C(C)(C)C)ccc2=O)CCN1S(C)(=O)=O	ZINC000853564143	EC	On-Demand	Anodyne	HSD11B1	15	44
Cn1c(-c2ccccc2)nn(CN2CCC[C@@H](CCF)C2)c1=S	ZINC000853564289	EH	On-Demand	Anodyne	SLC6A1	50	33
Cn1c(-c2ccccc2)nn(CN2CCC[C@H](CCF)C2)c1=S	ZINC000853564290	EH	On-Demand	Anodyne	SLC6A1	50	33
Cn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@H](CCF)C2)c1=S	ZINC000853564300	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	40
Cn1c(-c2ccc(Cl)cc2)nn(CN2CCC[C@@H](CCF)C2)c1=S	ZINC000853564301	FI	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	40
C[C@@H]1CN(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CCN1S(C)(=O)=O	ZINC000853564437	GC	On-Demand	Bother	KCNJ1	20	40
NS(=O)(=O)c1ccc2nc(N3CCC(F)(F)CC3)[nH]c2c1	ZINC000853564516	DD	On-Demand	Anodyne	NPY5R	17	40
C[C@@H]1CN(Cn2nnc3c(cnn3C)c2=O)CCN1S(C)(=O)=O	ZINC000853564540	EA	On-Demand	Anodyne	Q9M629_MAIZE	52	34
COc1cccc(Nc2nc(N3CCC(F)(F)CC3)nc3[nH]cnc23)c1	ZINC000853564551	FG	On-Demand	Anodyne	PDPK1	16	44
COc1cccc(Nc2nc(N3CCC(F)(F)CC3)nc3[nH]cnc23)c1	ZINC000853564551	FG	On-Demand	Anodyne	GALR2	35	47
Cc1cc(C(F)(F)F)nn1CN1CCN(S(C)(=O)=O)[C@H](C)C1	ZINC000853564576	ED	On-Demand	Anodyne	HSD11B1	18	40
O=C(CNC(=O)NCCCc1nc[nH]n1)NCCc1ccccc1	ZINC000853564602	EC	On-Demand	Anodyne	HRH2	27	42
Fc1cc(N2CCC(c3cccc(Cl)c3)CC2)ncn1	ZINC000853564605	CH	On-Demand	Anodyne	DCK	36	43
C[C@@H]1CN(Cn2nc(C(F)(F)F)ccc2=O)CCN1S(C)(=O)=O	ZINC000853564612	FC	On-Demand	Anodyne	HSD11B1	21	44
C#Cc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853564634	CD	On-Demand	Mild	DRD2	17	41
C#Cc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853564634	CD	On-Demand	Mild	DRD3	17	41
C#Cc1cccnc1N1CCN(c2ccncc2OC)CC1	ZINC000853564634	CD	On-Demand	Mild	HTR7	21	41
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)c2ccc(Br)cc21	ZINC000853564662	FG	On-Demand	Anodyne	CASP3	64	44
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)c2ccc(Br)cc21	ZINC000853564662	FG	On-Demand	Anodyne	CASP7	94	44
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)c2ccc(Br)cc21	ZINC000853564663	FG	On-Demand	Anodyne	CASP3	64	44
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)c2ccc(Br)cc21	ZINC000853564663	FG	On-Demand	Anodyne	CASP7	94	44
C[C@@H]1CN(Cn2ccc(C(F)(F)F)n2)CCN1S(C)(=O)=O	ZINC000853564675	EC	On-Demand	Anodyne	HSD11B1	22	45
CCOC(=O)c1nccc(N2CCC(F)(F)CC2)n1	ZINC000853564759	CD	On-Demand	Anodyne	SORD	83	38
CC(C)c1ccc2ncnc(N3CCC(F)(F)CC3)c2c1	ZINC000853564775	CH	On-Demand	Anodyne	PDE3A	41	41
CC(C)c1ccc2ncnc(N3CCC(F)(F)CC3)c2c1	ZINC000853564775	CH	On-Demand	Anodyne	PDGFRB	43	44
CC(C)c1ccc2ncnc(N3CCC(F)(F)CC3)c2c1	ZINC000853564775	CH	On-Demand	Anodyne	PDE3B	44	41
CCC[C@H](NC(=O)N1CCC2=C(CCC(=O)N2)C1)c1ccc(Cl)c(Cl)c1	ZINC000853564809	GI	On-Demand	Anodyne	MAPK1	48	44
COc1cnccc1N1CCN(c2cc(Br)cnc2C#N)CC1	ZINC000853564872	FE	On-Demand	Mild	TNIK	44	35
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)c2ccccc21	ZINC000853564884	CE	On-Demand	Anodyne	CASP3	43	37
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)c2ccccc21	ZINC000853564884	CE	On-Demand	Anodyne	ALDH1A1	58	41
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)c2ccccc21	ZINC000853564884	CE	On-Demand	Anodyne	ALDH3A1	43	51
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)c2ccccc21	ZINC000853564884	CE	On-Demand	Anodyne	CES1	16	41
O=C1C(=O)N(CN2CCC[C@H](CCF)C2)c2ccccc21	ZINC000853564884	CE	On-Demand	Anodyne	CASP7	65	37
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)c2ccccc21	ZINC000853564885	CE	On-Demand	Anodyne	CASP3	43	37
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)c2ccccc21	ZINC000853564885	CE	On-Demand	Anodyne	ALDH1A1	58	41
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)c2ccccc21	ZINC000853564885	CE	On-Demand	Anodyne	ALDH3A1	43	51
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)c2ccccc21	ZINC000853564885	CE	On-Demand	Anodyne	CES1	16	41
O=C1C(=O)N(CN2CCC[C@@H](CCF)C2)c2ccccc21	ZINC000853564885	CE	On-Demand	Anodyne	CASP7	65	37
COc1ccc(-c2nccc(N3CCC(F)(F)CC3)n2)cc1	ZINC000853564943	DG	On-Demand	Anodyne	SORD	59	33
C[C@@H]1CN(CN2C[C@]3(CN4CCC3CC4)OC2=O)CCN1S(C)(=O)=O	ZINC000853564956	FB	On-Demand	Anodyne	CHRNA7	15	55
C[C@@H]1CN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)CCN1S(C)(=O)=O	ZINC000853564957	FB	On-Demand	Anodyne	CHRNA7	15	55
C[C@@]12COC[C@H]1CN(CN1C(=O)C(=O)c3ccccc31)C2	ZINC000853565082	CD	On-Demand	Anodyne	ALDH1A1	48	39
C[C@@]12COC[C@H]1CN(CN1C(=O)C(=O)c3ccccc31)C2	ZINC000853565082	CD	On-Demand	Anodyne	ALDH3A1	39	45
C[C@@]12COC[C@H]1CN(CN1C(=O)C(=O)c3ccccc31)C2	ZINC000853565082	CD	On-Demand	Anodyne	CES1	15	41
C[C@@]12COC[C@@H]1CN(CN1C(=O)C(=O)c3ccccc31)C2	ZINC000853565084	CD	On-Demand	Anodyne	ALDH1A1	48	39
C[C@@]12COC[C@@H]1CN(CN1C(=O)C(=O)c3ccccc31)C2	ZINC000853565084	CD	On-Demand	Anodyne	ALDH3A1	39	45
C[C@@]12COC[C@@H]1CN(CN1C(=O)C(=O)c3ccccc31)C2	ZINC000853565084	CD	On-Demand	Anodyne	CES1	15	41
CON(C)CCNC(=O)NCC(C)(C)c1ccc2c(c1)OCO2	ZINC000853565270	DD	On-Demand	Anodyne	DYRK2	41	34
COCCCCCNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853565619	CE	On-Demand	Anodyne	EPHX2	25	44
COCCCCCNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853565620	CE	On-Demand	Anodyne	EPHX2	25	44
COCCCCCNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853565621	CE	On-Demand	Anodyne	EPHX2	25	44
COCCCCCNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853565622	CE	On-Demand	Anodyne	EPHX2	25	44
Cn1ncc2c(=O)n(CN3CCOC[C@H]3c3cccc(F)c3)nnc21	ZINC000853565988	EC	On-Demand	Anodyne	Q9M629_MAIZE	62	37
Cn1ncc2c(=O)n(CN3CCOC[C@@H]3c3cccc(F)c3)nnc21	ZINC000853565989	EC	On-Demand	Anodyne	Q9M629_MAIZE	62	37
CCCn1c(CO)nn(CN2CCOC[C@H]2c2cccc(F)c2)c1=S	ZINC000853566076	FE	On-Demand	Anodyne	CCR5	55	31
CCCn1c(CO)nn(CN2CCOC[C@@H]2c2cccc(F)c2)c1=S	ZINC000853566077	FE	On-Demand	Anodyne	CCR5	55	31
COCCCCCNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853566140	DE	On-Demand	Reactive	TBXA2R	18	40
COCCCCCNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853566140	DE	On-Demand	Reactive	CACNA1D	51	35
C[C@@]12COC[C@@H]1CN(CN1C(=O)C(=O)c3ccc(OC(F)(F)F)cc31)C2	ZINC000853566418	FE	On-Demand	Anodyne	CHRM5	15	41
C[C@@]12COC[C@H]1CN(CN1C(=O)C(=O)c3ccc(OC(F)(F)F)cc31)C2	ZINC000853566420	FE	On-Demand	Anodyne	CHRM5	15	41
COCCCCCNC(=O)NNc1cc(F)ccc1C	ZINC000853566871	CF	On-Demand	Reactive	LEF	40	33
CN(Cc1cn(C)nn1)CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O	ZINC000853566882	FD	On-Demand	Anodyne	SIGMAR1	30	44
CON(C)CCNC(=O)NC1CCN(CC(F)F)CC1	ZINC000853566888	CC	On-Demand	Anodyne	EPHX2	25	42
CC(C)c1ccc2ncnc(N3CC[C@@H]4NC(=O)OC[C@H]4C3)c2c1	ZINC000853567014	EF	On-Demand	Anodyne	PDE3A	43	42
CC(C)c1ccc2ncnc(N3CC[C@@H]4NC(=O)OC[C@H]4C3)c2c1	ZINC000853567014	EF	On-Demand	Anodyne	PDE3B	48	42
O=c1oc2ccc(F)cc2n1CN1CCOC[C@H]1c1cccc(F)c1	ZINC000853567223	EF	On-Demand	Anodyne	MIF	17	50
O=c1oc2ccc(F)cc2n1CN1CCOC[C@@H]1c1cccc(F)c1	ZINC000853567225	EF	On-Demand	Anodyne	MIF	17	50
CN(Cc1cn(C)nn1)Cn1ccc(-c2ccc(F)cc2)n1	ZINC000853567351	DD	On-Demand	Anodyne	SCN4A	25	43
CN(Cc1cn(C)nn1)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853567688	DC	On-Demand	Anodyne	CHRNA7	17	53
CN(Cc1cn(C)nn1)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853567692	DC	On-Demand	Anodyne	CHRNA7	17	53
C#C[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)C(C)C	ZINC000853567803	CE	On-Demand	Mild	ABCC8	45	33
C#CCCN(CCOC)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567804	FG	On-Demand	Mild	HRH2	41	46
C#CCCN(CCOC)C(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567804	FG	On-Demand	Mild	CHRM3	15	40
C#C[C@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)C(C)C	ZINC000853567805	CE	On-Demand	Mild	ABCC8	45	33
COC(=O)c1cccc(NNC(=O)NC2CCN(CC(F)F)CC2)c1C	ZINC000853567824	FE	On-Demand	Reactive	EPHX2	29	40
COC(=O)c1cccc(NNC(=O)NC2CCN(CC(F)F)CC2)c1C	ZINC000853567824	FE	On-Demand	Reactive	CCR8	46	31
CON(C)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567885	EE	On-Demand	Anodyne	ACHE	18	46
CON(C)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567885	EE	On-Demand	Anodyne	HRH2	55	58
CON(C)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567885	EE	On-Demand	Anodyne	CHRM3	18	42
CON(C)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567885	EE	On-Demand	Anodyne	HRH3	17	41
CON(C)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567885	EE	On-Demand	Anodyne	MCHR1	17	44
CON(C)CCNC(=O)NCc1cccc(CN2CCCCCC2)c1	ZINC000853567885	EE	On-Demand	Anodyne	NPFFR1	40	37
CN(Cc1cn(C)nn1)Cn1c(=O)oc2ccc(Br)cc21	ZINC000853568216	FD	On-Demand	Anodyne	TSPO	15	47
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCOC[C@H]1c1cccc(F)c1	ZINC000853568294	GE	On-Demand	Anodyne	CHRNA7	18	42
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCOC[C@H]1c1cccc(F)c1	ZINC000853568297	GE	On-Demand	Anodyne	CHRNA7	18	42
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCOC[C@@H]1c1cccc(F)c1	ZINC000853568299	GE	On-Demand	Anodyne	CHRNA7	18	42
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCOC[C@@H]1c1cccc(F)c1	ZINC000853568302	GE	On-Demand	Anodyne	CHRNA7	18	42
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCOC[C@H]1c1cc(F)cc(F)c1	ZINC000853568327	GE	On-Demand	Anodyne	CHRNA7	16	48
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCOC[C@H]1c1cc(F)cc(F)c1	ZINC000853568329	GE	On-Demand	Anodyne	CHRNA7	16	48
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCOC[C@@H]1c1cc(F)cc(F)c1	ZINC000853568331	GE	On-Demand	Anodyne	CHRNA7	16	48
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCOC[C@@H]1c1cc(F)cc(F)c1	ZINC000853568334	GE	On-Demand	Anodyne	CHRNA7	16	48
Cc1onc2c(=O)n(CN(C)Cc3cn(C)nn3)nc(-c3ccccc3)c12	ZINC000853568370	FD	On-Demand	Anodyne	GRM7	52	32
O=C(NC1CCN(CC(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568557	EE	On-Demand	Anodyne	DRD4	17	47
O=C(NC1CCN(CC(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568557	EE	On-Demand	Anodyne	SIGMAR1	18	42
O=C(NC1CCN(CC(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568557	EE	On-Demand	Anodyne	EPHX2	37	42
O=C(NC1CCN(CC(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568558	EE	On-Demand	Anodyne	DRD4	17	47
O=C(NC1CCN(CC(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568558	EE	On-Demand	Anodyne	SIGMAR1	18	42
O=C(NC1CCN(CC(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568558	EE	On-Demand	Anodyne	EPHX2	37	42
O=C(NC1CCN(CC(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568559	EE	On-Demand	Anodyne	DRD4	17	47
O=C(NC1CCN(CC(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568559	EE	On-Demand	Anodyne	SIGMAR1	18	42
O=C(NC1CCN(CC(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568559	EE	On-Demand	Anodyne	EPHX2	37	42
O=C(NC1CCN(CC(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568560	EE	On-Demand	Anodyne	DRD4	17	47
O=C(NC1CCN(CC(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568560	EE	On-Demand	Anodyne	SIGMAR1	18	42
O=C(NC1CCN(CC(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568560	EE	On-Demand	Anodyne	EPHX2	37	42
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CC(F)F)CC1	ZINC000853568720	FF	On-Demand	Reactive	EPHX2	30	48
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CC(F)F)CC1	ZINC000853568720	FF	On-Demand	Reactive	CXCR3	16	44
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568821	GI	On-Demand	Anodyne	HRH2	48	49
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568821	GI	On-Demand	Anodyne	CHRM3	22	41
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568821	GI	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568821	GI	On-Demand	Anodyne	BDKRB1	47	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568821	GI	On-Demand	Anodyne	MCHR2	51	37
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853568821	GI	On-Demand	Anodyne	NPFFR1	40	34
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568822	GI	On-Demand	Anodyne	HRH2	48	49
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568822	GI	On-Demand	Anodyne	CHRM3	22	41
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568822	GI	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568822	GI	On-Demand	Anodyne	BDKRB1	47	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568822	GI	On-Demand	Anodyne	MCHR2	51	37
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853568822	GI	On-Demand	Anodyne	NPFFR1	40	34
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568823	GI	On-Demand	Anodyne	HRH2	48	49
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568823	GI	On-Demand	Anodyne	CHRM3	22	41
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568823	GI	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568823	GI	On-Demand	Anodyne	BDKRB1	47	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568823	GI	On-Demand	Anodyne	MCHR2	51	37
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853568823	GI	On-Demand	Anodyne	NPFFR1	40	34
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568824	GI	On-Demand	Anodyne	HRH2	48	49
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568824	GI	On-Demand	Anodyne	CHRM3	22	41
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568824	GI	On-Demand	Anodyne	SIGMAR1	27	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568824	GI	On-Demand	Anodyne	BDKRB1	47	42
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568824	GI	On-Demand	Anodyne	MCHR2	51	37
O=C(NCc1cccc(CN2CCCCCC2)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853568824	GI	On-Demand	Anodyne	NPFFR1	40	34
FC(F)(F)c1cc(Cl)c(N2CC[C@@H](c3ccccn3)C2)nc1Cl	ZINC000853568923	FJ	On-Demand	Anodyne	RBP4	20	42
FC(F)(F)c1cc(Cl)c(N2CC[C@H](c3ccccn3)C2)nc1Cl	ZINC000853568924	FJ	On-Demand	Anodyne	RBP4	20	42
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	HTR1A	82	43
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	DRD2	73	44
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	DRD4	41	44
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	ADRA1D	71	41
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	ADRA1A	63	41
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	ADRA1B	55	41
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	DRD3	76	44
C#CCCN(CCOC)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853568927	FE	On-Demand	Mild	HTR7	53	38
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	HTR1A	74	46
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	DRD2	67	50
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	DRD4	40	41
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	ADRA1D	86	50
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	HTR1D	15	46
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	HTR1B	18	46
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	ADRA1A	75	50
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	ADRA1B	67	50
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	DRD3	70	44
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	HTR7	50	39
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	NPY1R	22	42
COc1ccccc1N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853568991	FG	On-Demand	Reactive	NPY2R	55	34
O=C1C(=O)N(CN(Cc2ccccc2F)CC2CC2)c2ccccc21	ZINC000853568992	EG	On-Demand	Anodyne	ALDH1A1	56	39
O=C1C(=O)N(CN(Cc2ccccc2F)CC2CC2)c2ccccc21	ZINC000853568992	EG	On-Demand	Anodyne	CES1	16	42
CC(C)c1ccc2ncnc(N3CC[C@H](c4ccccn4)C3)c2c1	ZINC000853569018	DI	On-Demand	Anodyne	PDE3A	51	48
CC(C)c1ccc2ncnc(N3CC[C@H](c4ccccn4)C3)c2c1	ZINC000853569018	DI	On-Demand	Anodyne	PDE3B	60	48
CC(C)c1ccc2ncnc(N3CC[C@H](c4ccccn4)C3)c2c1	ZINC000853569018	DI	On-Demand	Anodyne	SIRT3	46	31
CC(C)c1ccc2ncnc(N3CC[C@@H](c4ccccn4)C3)c2c1	ZINC000853569019	DI	On-Demand	Anodyne	PDE3A	51	48
CC(C)c1ccc2ncnc(N3CC[C@@H](c4ccccn4)C3)c2c1	ZINC000853569019	DI	On-Demand	Anodyne	PDE3B	60	48
CC(C)c1ccc2ncnc(N3CC[C@@H](c4ccccn4)C3)c2c1	ZINC000853569019	DI	On-Demand	Anodyne	SIRT3	46	31
COC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@@H](c2ccccn2)C1	ZINC000853569068	FG	On-Demand	Anodyne	TRPV1	26	41
COC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@H](c2ccccn2)C1	ZINC000853569069	FG	On-Demand	Anodyne	TRPV1	26	41
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	HTR1A	89	42
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	DRD2	89	45
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	DRD4	55	46
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	ADRA1D	82	42
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	HTR2A	25	40
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	ADRA1A	73	42
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	ADRA1B	63	42
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	DRD3	86	45
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	HTR7	56	39
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	SIGMAR1	15	42
COCCN(CCF)C(=O)NC1CCN(c2ccccc2OC)CC1	ZINC000853569084	FE	On-Demand	Anodyne	ACKR3	64	32
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	HTR1A	88	45
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	DRD2	79	50
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	DRD4	47	44
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	ADRA1D	96	50
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	HTR1B	16	42
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	HTR2A	24	41
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	ADRA1A	86	50
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	ADRA1B	75	50
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	DRD3	80	44
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	HTR7	57	40
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	NPY1R	22	42
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853569193	FG	On-Demand	Reactive	CCR3	18	44
CC(C)c1ccc2ncnc(N3CC(n4cncn4)C3)c2c1	ZINC000853569227	CE	On-Demand	Anodyne	PDE3B	43	39
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	HTR1A	85	47
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	DRD2	73	46
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	DRD4	44	45
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	ADRA1D	71	42
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	HTR2A	24	42
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	ADRA1A	64	42
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	ADRA1B	50	42
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	DRD3	81	43
COc1ccccc1N1CCC(NC(=O)NCCc2nnc(S)n2C)CC1	ZINC000853569236	GD	On-Demand	Anodyne	HTR7	56	40
CCOC(=O)c1nccc(N2CC[C@@H](c3ccccn3)C2)n1	ZINC000853569259	CE	On-Demand	Anodyne	SORD	74	38
CCOC(=O)c1nccc(N2CC[C@H](c3ccccn3)C2)n1	ZINC000853569260	CE	On-Demand	Anodyne	SORD	74	38
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	HTR1A	68	42
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	DRD2	53	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	ADRA1D	74	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	ADRA1A	62	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	ADRA1B	59	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	DRD3	53	39
COc1ccccc1N1CCC(NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853569268	GD	On-Demand	Anodyne	HTR7	42	38
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	HTR1A	68	42
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	DRD2	53	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	DRD4	27	41
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	ADRA1D	74	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	ADRA1A	62	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	ADRA1B	59	43
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	DRD3	53	39
COc1ccccc1N1CCC(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853569269	GD	On-Demand	Anodyne	HTR7	42	38
CC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@@H](c2ccccn2)C1	ZINC000853569279	EH	On-Demand	Anodyne	TRPV1	24	40
CC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@@H](c2ccccn2)C1	ZINC000853569279	EH	On-Demand	Anodyne	RBP4	26	40
CC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@H](c2ccccn2)C1	ZINC000853569280	EH	On-Demand	Anodyne	TRPV1	24	40
CC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@H](c2ccccn2)C1	ZINC000853569280	EH	On-Demand	Anodyne	RBP4	26	40
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	HTR1A	83	46
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	DRD2	73	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	DRD4	40	45
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	ADRA1D	80	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	HTR2A	20	41
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	ADRA1A	69	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	ADRA1B	63	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	DRD3	67	43
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	HTR7	55	45
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569294	GG	On-Demand	Anodyne	EPHX2	17	40
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	HTR1A	83	46
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	DRD2	73	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	DRD4	40	45
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	ADRA1D	80	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	HTR2A	20	41
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	ADRA1A	69	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	ADRA1B	63	48
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	DRD3	67	43
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	HTR7	55	45
COc1ccccc1N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569295	GG	On-Demand	Anodyne	EPHX2	17	40
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	HTR1A	83	46
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	DRD2	73	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	DRD4	40	45
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	ADRA1D	80	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	HTR2A	20	41
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	ADRA1A	69	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	ADRA1B	63	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	DRD3	67	43
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	HTR7	55	45
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853569296	GG	On-Demand	Anodyne	EPHX2	17	40
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	HTR1A	83	46
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	DRD2	73	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	DRD4	40	45
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	ADRA1D	80	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	HTR2A	20	41
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	ADRA1A	69	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	ADRA1B	63	48
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	DRD3	67	43
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	HTR7	55	45
COc1ccccc1N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853569297	GG	On-Demand	Anodyne	EPHX2	17	40
C#CCC[C@H](O)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853569329	CF	On-Demand	Mild	CLK4	46	32
C#CCC[C@@H](O)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853569330	CF	On-Demand	Mild	CLK4	46	32
COC(=O)c1nccc(N2CC[C@@H](c3ccccn3)C2)n1	ZINC000853569359	CD	On-Demand	Anodyne	SORD	70	40
COC(=O)c1nccc(N2CC[C@H](c3ccccn3)C2)n1	ZINC000853569360	CD	On-Demand	Anodyne	SORD	70	40
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	HTR1A	96	48
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	DRD2	86	48
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	DRD1	16	42
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	DRD4	54	46
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	ADRA1D	95	47
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	HTR2A	26	41
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	ADRA1A	85	47
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	ADRA1B	69	47
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	DRD3	90	46
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	HTR7	59	40
COc1ccccc1N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853569365	ED	On-Demand	Anodyne	NPY1R	24	46
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	HTR1A	86	43
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	DRD2	82	47
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	DRD4	53	43
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	ADRA1D	96	47
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	HTR1D	17	43
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	HTR1B	20	43
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	HTR2A	23	40
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	ADRA1A	85	47
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	ADRA1B	77	47
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	DRD3	80	43
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	HTR7	60	41
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	SIGMAR1	15	44
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	CCR3	27	42
COc1ccccc1N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853569397	GH	On-Demand	Reactive	RBP4	15	40
CC(C)c1ccc2ncnc(N3CC[C@@H]4C[C@@H]43)c2c1	ZINC000853569458	CG	On-Demand	Anodyne	PDE3B	42	39
CC(C)c1ccc2ncnc(N3CC[C@@H]4C[C@H]43)c2c1	ZINC000853569459	CG	On-Demand	Anodyne	PDE3B	42	39
CC(C)c1ccc2ncnc(N3CC[C@H]4C[C@H]43)c2c1	ZINC000853569460	CG	On-Demand	Anodyne	PDE3B	42	39
CC(C)c1ccc2ncnc(N3CC[C@H]4C[C@@H]43)c2c1	ZINC000853569461	CG	On-Demand	Anodyne	PDE3B	42	39
C#CCC[C@@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853569483	FE	On-Demand	Mild	PDPK1	15	43
C#CCC[C@@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853569483	FE	On-Demand	Mild	CDK1	15	43
C#CCC[C@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853569484	FE	On-Demand	Mild	PDPK1	15	43
C#CCC[C@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853569484	FE	On-Demand	Mild	CDK1	15	43
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	HTR1A	63	39
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	DRD2	47	41
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	DRD4	22	40
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	ADRA1D	62	41
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	ADRA1A	54	41
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	ADRA1B	49	41
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	DRD3	48	38
COc1ccccc1N1CCC(NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853569531	GE	On-Demand	Anodyne	HTR7	41	38
Cc1cc(CO)cc(N2CC[C@H](c3ccccn3)C2)n1	ZINC000853569569	CE	On-Demand	Anodyne	SORD	46	37
Cc1cc(CO)cc(N2CC[C@@H](c3ccccn3)C2)n1	ZINC000853569570	CE	On-Demand	Anodyne	SORD	46	37
Fc1cnc(N2CCC(N3CCc4ccccc43)CC2)cn1	ZINC000853569968	CF	On-Demand	Anodyne	SCD1	29	51
Fc1cnc(N2CCC(N3CCc4ccccc43)CC2)cn1	ZINC000853569968	CF	On-Demand	Anodyne	SCD	29	45
CCOc1cc(NCCS(=O)(=O)CCc2ccccc2)nc(C)n1	ZINC000853570117	EE	On-Demand	Anodyne	METG	48	33
Cc1cccc2c1CCC[C@@H]2NC(=O)NCc1ccccc1O	ZINC000853570162	DH	On-Demand	Clean	P2RX7	15	40
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NCc1ncccn1	ZINC000853570163	FD	On-Demand	Anodyne	HTR1A	17	44
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NCc1ncccn1	ZINC000853570163	FD	On-Demand	Anodyne	HTR7	28	40
Cc1cccc2c1CCC[C@H]2NC(=O)NCc1ccccc1O	ZINC000853570164	DH	On-Demand	Clean	P2RX7	15	40
O=C(CCNC(=O)NCCCc1nc[nH]n1)NCc1ccccc1	ZINC000853570170	EC	On-Demand	Anodyne	HRH2	29	41
O=C(CCNC(=O)NCCCc1nc[nH]n1)NCc1ccccc1	ZINC000853570170	EC	On-Demand	Anodyne	FURIN	51	34
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NCc1ncccn1	ZINC000853570248	FC	On-Demand	Anodyne	DRD4	25	40
C#Cc1cccnc1N1CCC(N2CCc3ccccc32)CC1	ZINC000853570264	DG	On-Demand	Mild	SCD1	17	42
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	HTR1A	81	47
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	DRD2	62	42
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	DRD4	45	37
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	ADRA1D	41	46
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	HTR2A	56	45
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	HTR2C	37	42
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	ADRA1A	52	46
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	ADRA1B	26	46
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	DRD3	87	45
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	HTR7	79	42
CON(C)CCNC(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853570298	FC	On-Demand	Anodyne	NPY1R	17	44
Fc1cc(N2CCC(N3CCc4ccccc43)CC2)ncn1	ZINC000853570320	CF	On-Demand	Anodyne	SCD1	30	49
Fc1cc(N2CCC(N3CCc4ccccc43)CC2)ncn1	ZINC000853570320	CF	On-Demand	Anodyne	SCD	30	47
COC[C@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570396	EF	On-Demand	Clean	ANPEP	16	47
COC[C@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570396	EF	On-Demand	Clean	ROCK1	15	40
COC[C@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570396	EF	On-Demand	Clean	MTNR1A	47	42
COC[C@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570396	EF	On-Demand	Clean	MTNR1B	45	42
COC[C@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570396	EF	On-Demand	Clean	ROCK2	18	40
COC[C@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570396	EF	On-Demand	Clean	PDS	40	39
COC[C@@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570397	EF	On-Demand	Clean	ANPEP	16	47
COC[C@@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570397	EF	On-Demand	Clean	ROCK1	15	40
COC[C@@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570397	EF	On-Demand	Clean	MTNR1A	47	42
COC[C@@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570397	EF	On-Demand	Clean	MTNR1B	45	42
COC[C@@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570397	EF	On-Demand	Clean	ROCK2	18	40
COC[C@@H](NC(=O)NCc1ccccc1O)c1cccc(OC)c1	ZINC000853570397	EF	On-Demand	Clean	PDS	40	39
C#C[C@H](NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1)C1CCOCC1	ZINC000853570431	GD	On-Demand	Mild	ADAM10	30	40
C#C[C@@H](NC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1)C1CCOCC1	ZINC000853570435	GD	On-Demand	Mild	ADAM10	30	40
CC(C)(C)N1C[C@@H](CNC(=O)NCc2ccccc2O)CC1=O	ZINC000853570439	DD	On-Demand	Clean	P2RX7	57	34
CC(C)(C)N1C[C@H](CNC(=O)NCc2ccccc2O)CC1=O	ZINC000853570441	DD	On-Demand	Clean	P2RX7	57	34
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)C1	ZINC000853570466	CD	On-Demand	Clean	EPHX2	25	41
CCOC(=O)c1nc(=NC[C@@H]2CC(c3ccc(C)cc3)=NO2)cc[nH]1	ZINC000853570609	ED	On-Demand	Anodyne	LUCI_PHOPY	59	38
CCOC(=O)c1nc(=NC[C@H]2CC(c3ccc(C)cc3)=NO2)cc[nH]1	ZINC000853570611	ED	On-Demand	Anodyne	LUCI_PHOPY	59	38
C[C@@H]1[C@@H](C(F)(F)F)OCCN1CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853570624	FD	On-Demand	Anodyne	GHRL	46	33
C[C@@H]1[C@@H](C(F)(F)F)OCCN1CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853570634	FD	On-Demand	Anodyne	GHRL	46	33
O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NCC1SCCS1	ZINC000853570767	GD	On-Demand	Anodyne	SSTR1	17	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccccc1O	ZINC000853570784	FE	On-Demand	Clean	STAT6	20	41
C#CCCN(CCOC)C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853570904	GD	On-Demand	Mild	SSTR1	40	38
CN1C[C@H](CNC(=O)NCc2ccccc2O)CC1=O	ZINC000853570916	CC	On-Demand	Clean	P2RX7	54	37
CN1C[C@@H](CNC(=O)NCc2ccccc2O)CC1=O	ZINC000853570919	CC	On-Demand	Clean	P2RX7	54	37
COCCN(CCF)C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853571258	GD	On-Demand	Anodyne	DRD3	19	40
COCCN(CCF)C(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853571258	GD	On-Demand	Anodyne	SSTR1	42	39
O=C(CCNC(=O)NCCS(=O)(=O)CC(F)(F)F)NCc1ccccc1	ZINC000853571318	GC	On-Demand	Anodyne	CA5B	23	41
O=C(CCNC(=O)NCCS(=O)(=O)CC(F)(F)F)NCc1ccccc1	ZINC000853571318	GC	On-Demand	Anodyne	CA5A	27	41
CC(=O)c1ccnc(N[C@H]2Cc3ccc(Cl)cc3C2)c1	ZINC000853571322	CH	On-Demand	Anodyne	TYK2	49	39
CC(=O)c1ccnc(N[C@@H]2Cc3ccc(Cl)cc3C2)c1	ZINC000853571323	CH	On-Demand	Anodyne	TYK2	49	39
C[C@@H]1[C@@H](C(F)(F)F)OCCN1Cn1nnc2c(cnn2C)c1=O	ZINC000853571407	EC	On-Demand	Anodyne	Q9M629_MAIZE	54	36
Cc1cc(CO)cc(N2C[C@@H](CNC(=O)OC(C)(C)C)[C@H](c3ccccc3)C2)n1	ZINC000853571412	GH	On-Demand	Anodyne	ACACB	15	43
C[C@H]1[C@H](C(F)(F)F)OCCN1Cn1nnc2c(cnn2C)c1=O	ZINC000853571419	EC	On-Demand	Anodyne	Q9M629_MAIZE	54	36
O=C(NCc1ccccc1O)NC1CCC(C2CCC2)CC1	ZINC000853571455	DH	On-Demand	Clean	EPHX2	35	49
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853571609	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	32
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853571610	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	32
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853571611	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	32
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853571612	FH	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	32
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	HTR1A	75	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	DRD2	61	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	DRD4	36	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	ADRA1D	30	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	HTR2A	58	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	HTR2C	34	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	SLC6A4	15	40
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	ADRA1A	37	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	ADRA1B	19	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	DRD3	79	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853571724	GE	On-Demand	Anodyne	HTR7	77	41
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	HTR1A	75	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	DRD2	61	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	DRD4	36	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	ADRA1D	30	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	HTR2A	58	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	HTR2C	34	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	SLC6A4	15	40
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	ADRA1A	37	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	ADRA1B	19	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	DRD3	79	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853571725	GE	On-Demand	Anodyne	HTR7	77	41
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	HTR1A	75	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	DRD2	61	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	DRD4	36	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	ADRA1D	30	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	HTR2A	58	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	HTR2C	34	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	SLC6A4	15	40
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	ADRA1A	37	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	ADRA1B	19	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	DRD3	79	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853571726	GE	On-Demand	Anodyne	HTR7	77	41
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	HTR1A	75	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	DRD2	61	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	DRD4	36	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	ADRA1D	30	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	HTR2A	58	47
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	HTR2C	34	42
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	SLC6A4	15	40
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	ADRA1A	37	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	ADRA1B	19	43
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	DRD3	79	51
O=C(NCCCN1CCN(c2ccncc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853571727	GE	On-Demand	Anodyne	HTR7	77	41
COCCN(CCF)C(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000853571757	GC	On-Demand	Anodyne	DRD4	28	42
COC(=O)N(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853571759	GC	On-Demand	Anodyne	SSTR1	45	42
COC(=O)N(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853571759	GC	On-Demand	Anodyne	ADAM10	32	40
C#CCCN(CCOC)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853571776	FD	On-Demand	Mild	HTR1A	54	42
C#CCCN(CCOC)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853571776	FD	On-Demand	Mild	DRD2	47	42
C#CCCN(CCOC)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853571776	FD	On-Demand	Mild	DRD4	43	35
C#CCCN(CCOC)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853571776	FD	On-Demand	Mild	HTR2A	40	42
C#CCCN(CCOC)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853571776	FD	On-Demand	Mild	ADRA1A	45	39
C#CCCN(CCOC)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853571776	FD	On-Demand	Mild	DRD3	77	42
C#CCCN(CCOC)C(=O)NCCCN1CCN(c2ccncc2)CC1	ZINC000853571776	FD	On-Demand	Mild	HTR7	43	38
COCCO[C@@H]1CCCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1	ZINC000853571788	EG	On-Demand	Bother	LIPG	35	43
COCCO[C@H]1CCCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1	ZINC000853571789	EG	On-Demand	Bother	LIPG	35	43
CON(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000853572027	FB	On-Demand	Anodyne	DRD4	29	43
CON(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000853572027	FB	On-Demand	Anodyne	SSTR1	47	39
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(N(C)C)c3)C2)cc1	ZINC000853572098	FF	On-Demand	Clean	MTNR1A	25	48
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(N(C)C)c3)C2)cc1	ZINC000853572098	FF	On-Demand	Clean	MTNR1B	24	48
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(N(C)C)c3)C2)cc1	ZINC000853572098	FF	On-Demand	Clean	MCHR1	22	49
NC(=O)c1ncn(C2CCN(c3ncnc(F)c3Br)CC2)c1N	ZINC000853572294	GD	On-Demand	Anodyne	SIRT3	49	34
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853572306	ED	On-Demand	Anodyne	SSTR1	41	37
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853572306	ED	On-Demand	Anodyne	ADAM10	35	40
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853572307	ED	On-Demand	Anodyne	SSTR1	41	37
O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853572307	ED	On-Demand	Anodyne	ADAM10	35	40
COC(=O)N(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000853572374	GC	On-Demand	Anodyne	DRD4	27	42
COC(=O)N(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000853572374	GC	On-Demand	Anodyne	SSTR1	44	38
Fc1ncnc(N2CCC(N3CCc4ccccc43)CC2)c1Br	ZINC000853572387	GG	On-Demand	Anodyne	SCD1	26	41
Cc1cc(CO)cc(N2CCN(c3ccc(C#N)nc3)CC2)n1	ZINC000853572503	DD	On-Demand	Mild	SORD	20	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C/c2ccccc2)n1	ZINC000853572612	EF	On-Demand	Anodyne	HDAC8	53	39
Cc1cc(CO)cc(NCCCNC(=O)/C=C/c2ccccc2)n1	ZINC000853572612	EF	On-Demand	Anodyne	HDAC1	29	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C/c2ccccc2)n1	ZINC000853572612	EF	On-Demand	Anodyne	HDAC2	20	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C/c2ccccc2)n1	ZINC000853572612	EF	On-Demand	Anodyne	HDAC4	21	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C/c2ccccc2)n1	ZINC000853572612	EF	On-Demand	Anodyne	HDAC6	35	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C/c2ccccc2)n1	ZINC000853572612	EF	On-Demand	Anodyne	HDAC9	34	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C/c2ccccc2)n1	ZINC000853572612	EF	On-Demand	Anodyne	HDAC7	42	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C\c2ccccc2)n1	ZINC000853572613	EF	On-Demand	Anodyne	HDAC8	53	39
Cc1cc(CO)cc(NCCCNC(=O)/C=C\c2ccccc2)n1	ZINC000853572613	EF	On-Demand	Anodyne	HDAC1	29	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C\c2ccccc2)n1	ZINC000853572613	EF	On-Demand	Anodyne	HDAC2	20	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C\c2ccccc2)n1	ZINC000853572613	EF	On-Demand	Anodyne	HDAC4	21	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C\c2ccccc2)n1	ZINC000853572613	EF	On-Demand	Anodyne	HDAC6	35	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C\c2ccccc2)n1	ZINC000853572613	EF	On-Demand	Anodyne	HDAC9	34	40
Cc1cc(CO)cc(NCCCNC(=O)/C=C\c2ccccc2)n1	ZINC000853572613	EF	On-Demand	Anodyne	HDAC7	42	40
C[C@@H]1[C@@H](C(F)(F)F)OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853572640	ED	On-Demand	Anodyne	ALDH1A1	49	41
C[C@@H]1[C@@H](C(F)(F)F)OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853572640	ED	On-Demand	Anodyne	ALDH3A1	39	43
C[C@@H]1[C@@H](C(F)(F)F)OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853572640	ED	On-Demand	Anodyne	CES1	16	40
C[C@H]1[C@H](C(F)(F)F)OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853572641	ED	On-Demand	Anodyne	ALDH1A1	49	41
C[C@H]1[C@H](C(F)(F)F)OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853572641	ED	On-Demand	Anodyne	ALDH3A1	39	43
C[C@H]1[C@H](C(F)(F)F)OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853572641	ED	On-Demand	Anodyne	CES1	16	40
Cn1ncc2c(=O)n(CN3CCC([C@@H]4CCCCO4)CC3)nnc21	ZINC000853572700	EC	On-Demand	Anodyne	Q9M629_MAIZE	52	34
Cn1ncc2c(=O)n(CN3CCC([C@H]4CCCCO4)CC3)nnc21	ZINC000853572701	EC	On-Demand	Anodyne	Q9M629_MAIZE	52	34
O=c1c2cc(Cl)ccc2nnn1CN1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853572749	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	53	34
O=c1c2cc(Cl)ccc2nnn1CN1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853572752	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	53	34
O=c1c2cc(Cl)ccc2nnn1CN1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853572754	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	53	34
O=c1c2cc(Cl)ccc2nnn1CN1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853572756	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	53	34
CCOc1cc(N2CCN(c3ccc(C#N)nc3)CC2)nc(C)n1	ZINC000853572867	DD	On-Demand	Mild	CACNA2D2	45	31
O=C(NCCC(=O)N1CCCCCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853572924	GG	On-Demand	Reactive	CSNK1D	31	41
C#CCCN(CCOC)C(=O)NCCC(=O)N1CCN(c2ccccn2)CC1	ZINC000853572954	GC	On-Demand	Mild	DRD4	24	41
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C/c1ccccc1	ZINC000853572972	GF	On-Demand	Anodyne	HDAC2	16	42
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C/c1ccccc1	ZINC000853572972	GF	On-Demand	Anodyne	HDAC4	15	42
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C/c1ccccc1	ZINC000853572972	GF	On-Demand	Anodyne	HDAC9	33	42
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C/c1ccccc1	ZINC000853572972	GF	On-Demand	Anodyne	HDAC7	40	42
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C\c1ccccc1	ZINC000853572973	GF	On-Demand	Anodyne	HDAC2	16	42
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C\c1ccccc1	ZINC000853572973	GF	On-Demand	Anodyne	HDAC4	15	42
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C\c1ccccc1	ZINC000853572973	GF	On-Demand	Anodyne	HDAC9	33	42
CN(C)S(=O)(=O)c1ccccc1NCCCNC(=O)/C=C\c1ccccc1	ZINC000853572973	GF	On-Demand	Anodyne	HDAC7	40	42
COC(=O)c1nn(CN2CCC([C@H]3CCCCO3)CC2)c2ccccc12	ZINC000853572980	FG	On-Demand	Anodyne	HTR4	58	35
COC(=O)c1nn(CN2CCC([C@@H]3CCCCO3)CC2)c2ccccc12	ZINC000853572981	FG	On-Demand	Anodyne	HTR4	58	35
CC(C)c1ccc2ncnc(N3CCN(c4ccc(C#N)nc4)CC3)c2c1	ZINC000853573161	FG	On-Demand	Mild	PDGFRB	49	41
CON(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853573339	FC	On-Demand	Anodyne	HTR1A	15	41
CON(C)CCNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853573339	FC	On-Demand	Anodyne	SSTR1	47	43
CC(=O)c1ccnc(NCCS(=O)(=O)CCc2ccccc2)c1	ZINC000853573403	EE	On-Demand	Anodyne	KDM4E	20	41
CCOC(=O)c1nccc(N2CCN(c3ccc(C#N)nc3)CC2)n1	ZINC000853573466	ED	On-Demand	Mild	SORD	48	35
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC([C@@H]2CCCCO2)CC1	ZINC000853573582	FE	On-Demand	Anodyne	CHRNA7	16	53
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC([C@@H]2CCCCO2)CC1	ZINC000853573586	FE	On-Demand	Anodyne	CHRNA7	16	53
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC([C@H]2CCCCO2)CC1	ZINC000853573590	FE	On-Demand	Anodyne	CHRNA7	16	53
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC([C@H]2CCCCO2)CC1	ZINC000853573593	FE	On-Demand	Anodyne	CHRNA7	16	53
COC(=O)c1nccc(N2CCN(c3ccc(C#N)nc3)CC2)n1	ZINC000853573817	DC	On-Demand	Mild	SORD	53	35
Fc1ccc2c(c1)CCN2C1CCN(c2cc(F)ncn2)CC1	ZINC000853573909	DF	On-Demand	Anodyne	SCD1	33	54
Fc1ccc2c(c1)CCN2C1CCN(c2cc(F)ncn2)CC1	ZINC000853573909	DF	On-Demand	Anodyne	SCD	35	54
N#Cc1cnnc(NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000853573944	DD	On-Demand	Mild	LUCI_PHOPY	50	41
N#Cc1cnnc(NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1	ZINC000853573946	DD	On-Demand	Mild	LUCI_PHOPY	50	41
FC(F)[C@@H]1CN(c2nc3ccccc3n3cccc23)CCO1	ZINC000853573950	DF	On-Demand	Anodyne	HTR3A	27	42
FC(F)[C@H]1CN(c2nc3ccccc3n3cccc23)CCO1	ZINC000853573952	DF	On-Demand	Anodyne	HTR3A	27	42
Fc1ncnc(NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1Br	ZINC000853573996	GF	On-Demand	Anodyne	LUCI_PHOPY	55	34
Fc1ncnc(NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)c1Br	ZINC000853573998	GF	On-Demand	Anodyne	LUCI_PHOPY	55	34
CC(=O)NCCN(Cc1ccsc1)c1cc(F)ncn1	ZINC000853574000	CD	On-Demand	Anodyne	HCAR3	23	40
Fc1cc(NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)ncn1	ZINC000853574015	DE	On-Demand	Anodyne	LUCI_PHOPY	65	39
Fc1cc(NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)ncn1	ZINC000853574079	DE	On-Demand	Anodyne	LUCI_PHOPY	65	39
CCOC(=O)c1nc(=NC[C@@H]2CC(c3ccc(OC)cc3)=NO2)cc[nH]1	ZINC000853574092	FD	On-Demand	Anodyne	LUCI_PHOPY	64	46
CCOC(=O)c1nc(=NC[C@H]2CC(c3ccc(OC)cc3)=NO2)cc[nH]1	ZINC000853574093	FD	On-Demand	Anodyne	LUCI_PHOPY	64	46
Fc1ccc2c(c1)CCN2C1CCN(c2cnc(F)cn2)CC1	ZINC000853574156	DF	On-Demand	Anodyne	SCD1	34	57
Fc1ccc2c(c1)CCN2C1CCN(c2cnc(F)cn2)CC1	ZINC000853574156	DF	On-Demand	Anodyne	SCD	34	57
Cc1ccc(NC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)nn1	ZINC000853574165	CG	On-Demand	Anodyne	LUCI_PHOPY	73	37
Cc1ccc(NC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)nn1	ZINC000853574166	CG	On-Demand	Anodyne	LUCI_PHOPY	73	37
COCCO[C@@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853574249	FI	On-Demand	Anodyne	LIPG	21	41
COCCO[C@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853574250	FI	On-Demand	Anodyne	LIPG	21	41
c1cnc(NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cn1	ZINC000853574312	CE	On-Demand	Anodyne	LUCI_PHOPY	61	34
c1cnc(NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cn1	ZINC000853574313	CE	On-Demand	Anodyne	LUCI_PHOPY	61	34
C#Cc1cccnc1N1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000853574323	DG	On-Demand	Mild	SCD1	26	46
C#Cc1cccnc1N1CCC(N2CCc3cc(F)ccc32)CC1	ZINC000853574323	DG	On-Demand	Mild	SCD	27	46
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H]2C[C@H]2C1	ZINC000853574346	EE	On-Demand	Anodyne	ACHE	26	41
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H]2C[C@H]2C1	ZINC000853574346	EE	On-Demand	Anodyne	SIGMAR1	54	48
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H]2C[C@H]2C1	ZINC000853574347	EE	On-Demand	Anodyne	ACHE	26	41
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H]2C[C@H]2C1	ZINC000853574347	EE	On-Demand	Anodyne	SIGMAR1	54	48
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H]2C[C@@H]2C1	ZINC000853574348	EE	On-Demand	Anodyne	ACHE	26	41
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H]2C[C@@H]2C1	ZINC000853574348	EE	On-Demand	Anodyne	SIGMAR1	54	48
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853574349	EE	On-Demand	Anodyne	ACHE	26	41
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853574349	EE	On-Demand	Anodyne	SIGMAR1	54	48
N#Cc1nc(NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)sc1Cl	ZINC000853574419	FG	On-Demand	Mild	LUCI_PHOPY	49	34
N#Cc1nc(NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)sc1Cl	ZINC000853574431	FG	On-Demand	Mild	LUCI_PHOPY	49	34
COCCO[C@H]1CCCN(c2ccc(C(=O)C3CC3)cc2S(N)(=O)=O)C1	ZINC000853574530	GD	On-Demand	Anodyne	LIPG	32	44
COCCO[C@@H]1CCCN(c2ccc(C(=O)C3CC3)cc2S(N)(=O)=O)C1	ZINC000853574532	GD	On-Demand	Anodyne	LIPG	32	44
COC(=O)c1nccc(N2CCO[C@@H](C(F)F)C2)n1	ZINC000853574547	CC	On-Demand	Anodyne	SORD	54	41
COC(=O)c1nccc(N2CCO[C@H](C(F)F)C2)n1	ZINC000853574549	CC	On-Demand	Anodyne	SORD	54	41
C[C@@H]1[C@@H](C(F)(F)F)OCCN1CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853574608	FD	On-Demand	Anodyne	CHRNA7	16	55
C[C@@H]1[C@@H](C(F)(F)F)OCCN1CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853574612	FD	On-Demand	Anodyne	CHRNA7	16	55
Fc1cnc(NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)cn1	ZINC000853574731	DE	On-Demand	Anodyne	LUCI_PHOPY	62	35
Fc1cnc(NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)cn1	ZINC000853574732	DE	On-Demand	Anodyne	LUCI_PHOPY	62	35
Cc1ccc(NC[C@@H]2CC(c3ccc4c(c3)CCO4)=NO2)nn1	ZINC000853574748	DE	On-Demand	Anodyne	LUCI_PHOPY	65	35
Cc1ccc(NC[C@H]2CC(c3ccc4c(c3)CCO4)=NO2)nn1	ZINC000853574749	DE	On-Demand	Anodyne	LUCI_PHOPY	65	35
CC(C)c1ccc2ncnc(N3CCO[C@H](C(F)F)C3)c2c1	ZINC000853574792	DG	On-Demand	Anodyne	PDE3A	44	43
CC(C)c1ccc2ncnc(N3CCO[C@H](C(F)F)C3)c2c1	ZINC000853574792	DG	On-Demand	Anodyne	PDGFRB	15	40
CC(C)c1ccc2ncnc(N3CCO[C@H](C(F)F)C3)c2c1	ZINC000853574792	DG	On-Demand	Anodyne	PDE3B	48	43
CC(C)c1ccc2ncnc(N3CCO[C@@H](C(F)F)C3)c2c1	ZINC000853574793	DG	On-Demand	Anodyne	PDE3A	44	43
CC(C)c1ccc2ncnc(N3CCO[C@@H](C(F)F)C3)c2c1	ZINC000853574793	DG	On-Demand	Anodyne	PDGFRB	15	40
CC(C)c1ccc2ncnc(N3CCO[C@@H](C(F)F)C3)c2c1	ZINC000853574793	DG	On-Demand	Anodyne	PDE3B	48	43
Fc1ccc2c(c1)CCN2C1CCN(c2ncnc(F)c2Br)CC1	ZINC000853574863	GH	On-Demand	Anodyne	SCD1	26	47
Fc1ccc2c(c1)CCN2C1CCN(c2ncnc(F)c2Br)CC1	ZINC000853574863	GH	On-Demand	Anodyne	SCD	28	47
CCOC(=O)c1nc(=NC[C@H]2CC(c3ccc(OC)c(F)c3)=NO2)cc[nH]1	ZINC000853574911	FD	On-Demand	Anodyne	MIF	17	40
CCOC(=O)c1nc(=NC[C@H]2CC(c3ccc(OC)c(F)c3)=NO2)cc[nH]1	ZINC000853574911	FD	On-Demand	Anodyne	LUCI_PHOPY	42	38
CCOC(=O)c1nc(=NC[C@@H]2CC(c3ccc(OC)c(F)c3)=NO2)cc[nH]1	ZINC000853574912	FD	On-Demand	Anodyne	MIF	17	40
CCOC(=O)c1nc(=NC[C@@H]2CC(c3ccc(OC)c(F)c3)=NO2)cc[nH]1	ZINC000853574912	FD	On-Demand	Anodyne	LUCI_PHOPY	42	38
CCOC(=O)c1nc(=NC[C@@H]2CC(c3ccc(C)c(C)c3)=NO2)cc[nH]1	ZINC000853575024	FE	On-Demand	Anodyne	LUCI_PHOPY	57	33
CCOC(=O)c1nc(=NC[C@H]2CC(c3ccc(C)c(C)c3)=NO2)cc[nH]1	ZINC000853575025	FE	On-Demand	Anodyne	LUCI_PHOPY	57	33
CCOC(=O)c1nccc(N2CCO[C@@H](C(F)F)C2)n1	ZINC000853575072	CD	On-Demand	Anodyne	SORD	52	39
CCOC(=O)c1nccc(N2CCO[C@H](C(F)F)C2)n1	ZINC000853575073	CD	On-Demand	Anodyne	SORD	52	39
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853575308	ED	On-Demand	Anodyne	DRD4	28	40
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853575308	ED	On-Demand	Anodyne	ACHE	30	46
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853575308	ED	On-Demand	Anodyne	SIGMAR1	54	44
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2C[C@H]2C1	ZINC000853575309	ED	On-Demand	Anodyne	DRD4	28	40
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2C[C@H]2C1	ZINC000853575309	ED	On-Demand	Anodyne	ACHE	30	46
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2C[C@H]2C1	ZINC000853575309	ED	On-Demand	Anodyne	SIGMAR1	54	44
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2C[C@H]2C1	ZINC000853575310	ED	On-Demand	Anodyne	DRD4	28	40
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2C[C@H]2C1	ZINC000853575310	ED	On-Demand	Anodyne	ACHE	30	46
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2C[C@H]2C1	ZINC000853575310	ED	On-Demand	Anodyne	SIGMAR1	54	44
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2C[C@@H]2C1	ZINC000853575311	ED	On-Demand	Anodyne	DRD4	28	40
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2C[C@@H]2C1	ZINC000853575311	ED	On-Demand	Anodyne	ACHE	30	46
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2C[C@@H]2C1	ZINC000853575311	ED	On-Demand	Anodyne	SIGMAR1	54	44
CC(=O)c1ccnc(NC[C@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c1	ZINC000853575687	ED	On-Demand	Anodyne	GPR119	36	41
CC(=O)c1ccnc(NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2O)c1	ZINC000853575688	ED	On-Demand	Anodyne	GPR119	36	41
CC(=O)c1ccnc(NC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c1	ZINC000853575689	ED	On-Demand	Anodyne	GPR119	36	41
CC(=O)c1ccnc(NC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)c1	ZINC000853575690	ED	On-Demand	Anodyne	GPR119	36	41
Fc1cccc(Cc2nn(CN3CC[C@@H]4C[C@@H]4C3)c(=S)o2)c1	ZINC000853575713	DG	On-Demand	Anodyne	CCR5	46	33
Fc1cccc(Cc2nn(CN3CC[C@@H]4C[C@H]4C3)c(=S)o2)c1	ZINC000853575714	DG	On-Demand	Anodyne	CCR5	46	33
Fc1cccc(Cc2nn(CN3CC[C@H]4C[C@@H]4C3)c(=S)o2)c1	ZINC000853575715	DG	On-Demand	Anodyne	CCR5	46	33
Fc1cccc(Cc2nn(CN3CC[C@H]4C[C@H]4C3)c(=S)o2)c1	ZINC000853575716	DG	On-Demand	Anodyne	CCR5	46	33
CC(C)(C)OC(=O)NC[C@]1(C)CCN(c2ncnc(F)c2Br)C1	ZINC000853575755	GG	On-Demand	Anodyne	SIRT3	36	40
CC(C)(C)OC(=O)NC[C@]1(C)CCN(c2ncnc(F)c2Br)C1	ZINC000853575755	GG	On-Demand	Anodyne	SIRT2	32	40
CC(C)(C)OC(=O)NC[C@]1(C)CCN(c2ncnc(F)c2Br)C1	ZINC000853575755	GG	On-Demand	Anodyne	SIRT1	28	40
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(c2ncnc(F)c2Br)C1	ZINC000853575756	GG	On-Demand	Anodyne	SIRT3	36	40
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(c2ncnc(F)c2Br)C1	ZINC000853575756	GG	On-Demand	Anodyne	SIRT2	32	40
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(c2ncnc(F)c2Br)C1	ZINC000853575756	GG	On-Demand	Anodyne	SIRT1	28	40
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNc2ncnc(F)c2Br)C1	ZINC000853575820	GE	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNc2ncnc(F)c2Br)C1	ZINC000853575822	GE	On-Demand	Anodyne	GPR119	38	40
Cn1ncc2c(=O)n(CN3CC[C@@H]4C[C@H]4C3)nnc21	ZINC000853575850	CB	On-Demand	Anodyne	Q9M629_MAIZE	62	37
Cn1ncc2c(=O)n(CN3CC[C@H]4C[C@@H]4C3)nnc21	ZINC000853575851	CB	On-Demand	Anodyne	Q9M629_MAIZE	62	37
Cn1ncc2c(=O)n(CN3CC[C@H]4C[C@H]4C3)nnc21	ZINC000853575852	CB	On-Demand	Anodyne	Q9M629_MAIZE	62	37
Cn1ncc2c(=O)n(CN3CC[C@@H]4C[C@@H]4C3)nnc21	ZINC000853575853	CB	On-Demand	Anodyne	Q9M629_MAIZE	62	37
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575961	DD	On-Demand	Anodyne	ACHE	18	44
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575961	DD	On-Demand	Anodyne	SIGMAR1	44	43
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575961	DD	On-Demand	Anodyne	CTSG	15	45
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575962	DD	On-Demand	Anodyne	ACHE	18	44
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575962	DD	On-Demand	Anodyne	SIGMAR1	44	43
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575962	DD	On-Demand	Anodyne	CTSG	15	45
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575963	DD	On-Demand	Anodyne	ACHE	18	44
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575963	DD	On-Demand	Anodyne	SIGMAR1	44	43
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575963	DD	On-Demand	Anodyne	CTSG	15	45
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575964	DD	On-Demand	Anodyne	ACHE	18	44
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575964	DD	On-Demand	Anodyne	SIGMAR1	44	43
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853575964	DD	On-Demand	Anodyne	CTSG	15	45
O=c1c2ccccc2c(-c2ccc(F)c(F)c2)nn1CN1CC[C@H]2C[C@@H]2C1	ZINC000853576170	FH	On-Demand	Anodyne	HRH1	21	40
O=c1c2ccccc2c(-c2ccc(F)c(F)c2)nn1CN1CC[C@@H]2C[C@H]2C1	ZINC000853576171	FH	On-Demand	Anodyne	HRH1	21	40
O=c1c2ccccc2c(-c2ccc(F)c(F)c2)nn1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853576172	FH	On-Demand	Anodyne	HRH1	21	40
O=c1c2ccccc2c(-c2ccc(F)c(F)c2)nn1CN1CC[C@H]2C[C@H]2C1	ZINC000853576173	FH	On-Demand	Anodyne	HRH1	21	40
CON(C)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000853576174	FD	On-Demand	Anodyne	ADRB3	21	40
CON(C)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000853576174	FD	On-Demand	Anodyne	ROCK2	30	41
CON(C)CCNC(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000853576174	FD	On-Demand	Anodyne	NAMPT	84	47
Cn1c(=O)n(CN2CC[C@@H]3C[C@H]3C2)c2ccccc21	ZINC000853576179	CD	On-Demand	Anodyne	OPRL1	26	40
Cn1c(=O)n(CN2CC[C@H]3C[C@@H]3C2)c2ccccc21	ZINC000853576180	CD	On-Demand	Anodyne	OPRL1	26	40
Cn1c(=O)n(CN2CC[C@H]3C[C@H]3C2)c2ccccc21	ZINC000853576181	CD	On-Demand	Anodyne	OPRL1	26	40
Cn1c(=O)n(CN2CC[C@@H]3C[C@@H]3C2)c2ccccc21	ZINC000853576182	CD	On-Demand	Anodyne	OPRL1	26	40
COc1ccc(-c2nn(CN3CC[C@H]4C[C@@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853576276	FG	On-Demand	Anodyne	HRH1	23	42
COc1ccc(-c2nn(CN3CC[C@@H]4C[C@@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853576277	FG	On-Demand	Anodyne	HRH1	23	42
COc1ccc(-c2nn(CN3CC[C@H]4C[C@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853576278	FG	On-Demand	Anodyne	HRH1	23	42
COc1ccc(-c2nn(CN3CC[C@@H]4C[C@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853576279	FG	On-Demand	Anodyne	HRH1	23	42
CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)N(CN1CC[C@H]3C[C@H]3C1)C2=O	ZINC000853576298	GD	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)N(CN1CC[C@@H]3C[C@H]3C1)C2=O	ZINC000853576299	GD	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)N(CN1CC[C@H]3C[C@@H]3C1)C2=O	ZINC000853576300	GD	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCC2(CC1)NC(=O)N(CN1CC[C@@H]3C[C@@H]3C1)C2=O	ZINC000853576301	GD	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNc2nc3ccc(N)cc3s2)C1	ZINC000853576488	FF	On-Demand	Anodyne	CSNK1D	40	38
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNc2nc3ccc(N)cc3s2)C1	ZINC000853576493	FF	On-Demand	Anodyne	CSNK1D	40	38
COCCN(CCF)C(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000853576507	FE	On-Demand	Anodyne	NAMPT	62	41
O=C(COc1ccccc1)N1CC[C@@H](Nc2cc(F)ncn2)C1	ZINC000853576614	DD	On-Demand	Anodyne	CPT1A	124	43
O=C(COc1ccccc1)N1CC[C@@H](Nc2cc(F)ncn2)C1	ZINC000853576614	DD	On-Demand	Anodyne	CPT2	47	38
O=C(COc1ccccc1)N1CC[C@H](Nc2cc(F)ncn2)C1	ZINC000853576615	DD	On-Demand	Anodyne	CPT1A	124	43
O=C(COc1ccccc1)N1CC[C@H](Nc2cc(F)ncn2)C1	ZINC000853576615	DD	On-Demand	Anodyne	CPT2	47	38
O=C(Cc1ccccc1)N1CCC[C@@H](Nc2ncnc(F)c2Br)C1	ZINC000853576660	GG	On-Demand	Anodyne	BIRC2	18	48
O=C(Cc1ccccc1)N1CCC[C@H](Nc2ncnc(F)c2Br)C1	ZINC000853576661	GG	On-Demand	Anodyne	BIRC2	18	48
O=C(Cc1ccccc1)N1CCC[C@H](Nc2cc(F)ncn2)C1	ZINC000853576727	DE	On-Demand	Anodyne	BIRC2	16	46
O=C(Cc1ccccc1)N1CCC[C@@H](Nc2cc(F)ncn2)C1	ZINC000853576729	DE	On-Demand	Anodyne	BIRC2	16	46
C#CCCCOc1cccnc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853576763	GF	On-Demand	Mild	CPT1A	102	41
C#CCCCOc1cccnc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853576763	GF	On-Demand	Mild	CPT2	44	36
C#CCCCOc1cccnc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853576766	GF	On-Demand	Mild	CPT1A	102	41
C#CCCCOc1cccnc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853576766	GF	On-Demand	Mild	CPT2	44	36
CC(C)(C)OC(=O)N1CCN([C@H](CNc2cnc(F)cn2)C(F)(F)F)CC1	ZINC000853576797	GF	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CCN([C@@H](CNc2cnc(F)cn2)C(F)(F)F)CC1	ZINC000853576803	GF	On-Demand	Anodyne	GPR119	36	41
O=C(COc1ccccc1)N1CC[C@@H](Nc2cnc(F)cn2)C1	ZINC000853576854	DD	On-Demand	Anodyne	CPT1A	122	43
O=C(COc1ccccc1)N1CC[C@@H](Nc2cnc(F)cn2)C1	ZINC000853576854	DD	On-Demand	Anodyne	CPT2	48	38
O=C(COc1ccccc1)N1CC[C@H](Nc2cnc(F)cn2)C1	ZINC000853576857	DD	On-Demand	Anodyne	CPT1A	122	43
O=C(COc1ccccc1)N1CC[C@H](Nc2cnc(F)cn2)C1	ZINC000853576857	DD	On-Demand	Anodyne	CPT2	48	38
O=c1c(C(F)(F)F)cc(-c2ccccc2)nn1CN1CC[C@H]2C[C@H]2C1	ZINC000853576935	EG	On-Demand	Anodyne	RBP4	49	32
O=c1c(C(F)(F)F)cc(-c2ccccc2)nn1CN1CC[C@@H]2C[C@H]2C1	ZINC000853576938	EG	On-Demand	Anodyne	RBP4	49	32
O=c1c(C(F)(F)F)cc(-c2ccccc2)nn1CN1CC[C@H]2C[C@@H]2C1	ZINC000853576941	EG	On-Demand	Anodyne	RBP4	49	32
O=c1c(C(F)(F)F)cc(-c2ccccc2)nn1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853576944	EG	On-Demand	Anodyne	RBP4	49	32
O=C1N(CN2CC[C@@H]3C[C@@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853576992	EG	On-Demand	Anodyne	RBP4	56	35
O=C1N(CN2CC[C@@H]3C[C@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853576995	EG	On-Demand	Anodyne	RBP4	56	35
O=C1N(CN2CC[C@H]3C[C@@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853576997	EG	On-Demand	Anodyne	RBP4	56	35
O=C1N(CN2CC[C@H]3C[C@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853576999	EG	On-Demand	Anodyne	RBP4	56	35
COC(=O)c1cccc(NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)c1C	ZINC000853577090	GD	On-Demand	Reactive	HTR4	23	42
COC(=O)c1cccc(NNC(=O)NCC2CCN(S(C)(=O)=O)CC2)c1C	ZINC000853577090	GD	On-Demand	Reactive	EPHX2	15	41
O=C(COc1ccccc1)N1CC[C@@H](Nc2ncnc(F)c2Br)C1	ZINC000853577447	GE	On-Demand	Anodyne	CPT1A	114	41
O=C(COc1ccccc1)N1CC[C@@H](Nc2ncnc(F)c2Br)C1	ZINC000853577447	GE	On-Demand	Anodyne	CPT2	45	36
O=C(COc1ccccc1)N1CC[C@H](Nc2ncnc(F)c2Br)C1	ZINC000853577449	GE	On-Demand	Anodyne	CPT1A	114	41
O=C(COc1ccccc1)N1CC[C@H](Nc2ncnc(F)c2Br)C1	ZINC000853577449	GE	On-Demand	Anodyne	CPT2	45	36
O=C1[C@H](CCc2ccccc2)CCN1CN1CC[C@H]2C[C@@H]2C1	ZINC000853577696	CF	On-Demand	Anodyne	SLC18A2	41	34
O=C1[C@H](CCc2ccccc2)CCN1CN1CC[C@@H]2C[C@H]2C1	ZINC000853577698	CF	On-Demand	Anodyne	SLC18A2	41	34
O=C1[C@H](CCc2ccccc2)CCN1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853577701	CF	On-Demand	Anodyne	SLC18A2	41	34
O=C1[C@H](CCc2ccccc2)CCN1CN1CC[C@H]2C[C@H]2C1	ZINC000853577703	CF	On-Demand	Anodyne	SLC18A2	41	34
N#Cc1ncc(Br)cc1N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853577765	GG	On-Demand	Mild	PREP	42	36
N#Cc1ncc(Br)cc1N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853577767	GG	On-Demand	Mild	PREP	42	36
Cn1nnc2c(N3CC[C@@](C)(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853578144	ED	On-Demand	Anodyne	SIRT3	48	43
Cn1nnc2c(N3CC[C@@](C)(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853578144	ED	On-Demand	Anodyne	SIRT2	38	43
Cn1nnc2c(N3CC[C@@](C)(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853578144	ED	On-Demand	Anodyne	SIRT1	29	43
Cn1nnc2c(N3CC[C@](C)(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853578145	ED	On-Demand	Anodyne	SIRT3	48	43
Cn1nnc2c(N3CC[C@](C)(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853578145	ED	On-Demand	Anodyne	SIRT2	38	43
Cn1nnc2c(N3CC[C@](C)(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853578145	ED	On-Demand	Anodyne	SIRT1	29	43
COC(=O)c1nn(CN2CC[C@@H]3C[C@H]3C2)c2ccccc12	ZINC000853578170	CE	On-Demand	Anodyne	HTR4	47	39
COC(=O)c1nn(CN2CC[C@H]3C[C@@H]3C2)c2ccccc12	ZINC000853578171	CE	On-Demand	Anodyne	HTR4	47	39
COC(=O)c1nn(CN2CC[C@H]3C[C@H]3C2)c2ccccc12	ZINC000853578172	CE	On-Demand	Anodyne	HTR4	47	39
COC(=O)c1nn(CN2CC[C@@H]3C[C@@H]3C2)c2ccccc12	ZINC000853578174	CE	On-Demand	Anodyne	HTR4	47	39
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccc(Br)cc21	ZINC000853578274	EE	On-Demand	Anodyne	ALDH1A1	24	47
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccc(Br)cc21	ZINC000853578274	EE	On-Demand	Anodyne	CASP7	52	38
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccc(Br)cc21	ZINC000853578278	EE	On-Demand	Anodyne	ALDH1A1	24	47
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccc(Br)cc21	ZINC000853578278	EE	On-Demand	Anodyne	CASP7	52	38
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](CNc2cc(F)ncn2)C1	ZINC000853578280	DD	On-Demand	Anodyne	GPR119	44	36
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccc(Br)cc21	ZINC000853578282	EE	On-Demand	Anodyne	ALDH1A1	24	47
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccc(Br)cc21	ZINC000853578282	EE	On-Demand	Anodyne	CASP7	52	38
CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](CNc2cc(F)ncn2)C1	ZINC000853578286	DD	On-Demand	Anodyne	GPR119	44	36
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccc(Br)cc21	ZINC000853578287	EE	On-Demand	Anodyne	ALDH1A1	24	47
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccc(Br)cc21	ZINC000853578287	EE	On-Demand	Anodyne	CASP7	52	38
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853578456	JJ	On-Demand	Mild	VIPR1	26	42
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853578654	JJ	On-Demand	Anodyne	KCNQ2	19	44
COCCN(CCF)C(=O)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000853578783	GD	On-Demand	Anodyne	MLNR	17	40
COCCN(CCF)C(=O)NC1CCN(C(=O)Cc2ccccc2OC)CC1	ZINC000853578783	GD	On-Demand	Anodyne	ACKR3	63	32
CC(C)(C)OC(=O)N1CCN([C@H](CNc2cnccn2)C(F)(F)F)CC1	ZINC000853579013	GE	On-Demand	Anodyne	GPR119	35	46
CC(C)(C)OC(=O)N1CCN([C@@H](CNc2cnccn2)C(F)(F)F)CC1	ZINC000853579016	GE	On-Demand	Anodyne	GPR119	35	46
Fc1cnc(N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)cn1	ZINC000853579091	CH	On-Demand	Anodyne	SLC18A3	26	41
C#Cc1cccnc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853579168	DE	On-Demand	Mild	CPT1A	120	43
C#Cc1cccnc1N[C@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853579168	DE	On-Demand	Mild	CPT2	46	38
C#Cc1cccnc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853579171	DE	On-Demand	Mild	CPT1A	120	43
C#Cc1cccnc1N[C@@H]1CCN(C(=O)COc2ccccc2)C1	ZINC000853579171	DE	On-Demand	Mild	CPT2	46	38
Fc1cc(N2[C@H]3CC[C@@H]2C[C@H](c2ccccc2)C3)ncn1	ZINC000853579188	CH	On-Demand	Anodyne	SLC18A3	17	40
CCCCN(Cc1ccccc1O)c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000853579207	EG	On-Demand	Clean	COLA	87	33
CC(C)(C)OC(=O)N1CCN([C@H](CNc2cc(F)ncn2)C(F)(F)F)CC1	ZINC000853579252	GF	On-Demand	Anodyne	GPR119	43	38
CC(C)(C)OC(=O)N1CCN([C@@H](CNc2cc(F)ncn2)C(F)(F)F)CC1	ZINC000853579254	GF	On-Demand	Anodyne	GPR119	43	38
C[Si](C)(C)c1ccc(CNC(=O)NCC2CCN(S(C)(=O)=O)CC2)cc1	ZINC000853579354	GD	On-Demand	Anodyne	NAMPT	64	40
Cn1nnc2c(NC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)ncnc21	ZINC000853579434	EC	On-Demand	Anodyne	GPR119	24	43
Cn1nnc2c(NC[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)ncnc21	ZINC000853579435	EC	On-Demand	Anodyne	GPR119	24	43
Cn1nnc2c(NC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)ncnc21	ZINC000853579437	EC	On-Demand	Anodyne	GPR119	24	43
Cn1nnc2c(NC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)ncnc21	ZINC000853579439	EC	On-Demand	Anodyne	GPR119	24	43
O=C(Nc1ccccc1)N1CC[C@@H](Nc2cc(F)ncn2)C1	ZINC000853579500	DE	On-Demand	Anodyne	PDGFRB	31	41
O=C(Nc1ccccc1)N1CC[C@@H](Nc2cc(F)ncn2)C1	ZINC000853579500	DE	On-Demand	Anodyne	CCR3	15	41
O=C(Nc1ccccc1)N1CC[C@@H](Nc2cc(F)ncn2)C1	ZINC000853579500	DE	On-Demand	Anodyne	RBP4	45	32
O=C(Nc1ccccc1)N1CC[C@H](Nc2cc(F)ncn2)C1	ZINC000853579501	DE	On-Demand	Anodyne	PDGFRB	31	41
O=C(Nc1ccccc1)N1CC[C@H](Nc2cc(F)ncn2)C1	ZINC000853579501	DE	On-Demand	Anodyne	CCR3	15	41
O=C(Nc1ccccc1)N1CC[C@H](Nc2cc(F)ncn2)C1	ZINC000853579501	DE	On-Demand	Anodyne	RBP4	45	32
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H]2C[C@H]2C1	ZINC000853579512	CD	On-Demand	Anodyne	CHRNA7	18	59
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H]2C[C@H]2C1	ZINC000853579516	CD	On-Demand	Anodyne	CHRNA7	18	59
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H]2C[C@@H]2C1	ZINC000853579518	CD	On-Demand	Anodyne	CHRNA7	18	59
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853579522	CD	On-Demand	Anodyne	CHRNA7	18	59
Cc1onc2c(=O)n(CN3CC[C@@H]4C[C@H]4C3)nc(-c3ccccc3)c12	ZINC000853579544	EF	On-Demand	Anodyne	GRM7	62	34
Cc1onc2c(=O)n(CN3CC[C@H]4C[C@H]4C3)nc(-c3ccccc3)c12	ZINC000853579548	EF	On-Demand	Anodyne	GRM7	62	34
Cc1onc2c(=O)n(CN3CC[C@@H]4C[C@@H]4C3)nc(-c3ccccc3)c12	ZINC000853579551	EF	On-Demand	Anodyne	GRM7	62	34
Cc1onc2c(=O)n(CN3CC[C@H]4C[C@@H]4C3)nc(-c3ccccc3)c12	ZINC000853579554	EF	On-Demand	Anodyne	GRM7	62	34
O=C1N(Cc2cccnc2)CCN1CN1CC[C@@H]2C[C@H]2C1	ZINC000853579557	CD	On-Demand	Anodyne	CHRNA7	43	38
O=C1N(Cc2cccnc2)CCN1CN1CC[C@H]2C[C@H]2C1	ZINC000853579559	CD	On-Demand	Anodyne	CHRNA7	43	38
O=C1N(Cc2cccnc2)CCN1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853579562	CD	On-Demand	Anodyne	CHRNA7	43	38
O=C1N(Cc2cccnc2)CCN1CN1CC[C@H]2C[C@@H]2C1	ZINC000853579565	CD	On-Demand	Anodyne	CHRNA7	43	38
C#Cc1cccnc1N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853579678	DF	On-Demand	Mild	PREP	45	34
C#Cc1cccnc1N[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853579680	DF	On-Demand	Mild	PREP	45	34
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579768	EG	On-Demand	Anodyne	CASP3	46	36
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579768	EG	On-Demand	Anodyne	ALDH1A1	53	38
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579768	EG	On-Demand	Anodyne	ALDH3A1	34	43
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579768	EG	On-Demand	Anodyne	CASP7	64	36
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579770	EG	On-Demand	Anodyne	CASP3	46	36
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579770	EG	On-Demand	Anodyne	ALDH1A1	53	38
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579770	EG	On-Demand	Anodyne	ALDH3A1	34	43
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579770	EG	On-Demand	Anodyne	CASP7	64	36
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579771	EG	On-Demand	Anodyne	CASP3	46	36
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579771	EG	On-Demand	Anodyne	ALDH1A1	53	38
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579771	EG	On-Demand	Anodyne	ALDH3A1	34	43
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579771	EG	On-Demand	Anodyne	CASP7	64	36
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579774	EG	On-Demand	Anodyne	CASP3	46	36
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579774	EG	On-Demand	Anodyne	ALDH1A1	53	38
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579774	EG	On-Demand	Anodyne	ALDH3A1	34	43
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853579774	EG	On-Demand	Anodyne	CASP7	64	36
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853579787	EE	On-Demand	Anodyne	CHRM5	16	44
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853579792	EE	On-Demand	Anodyne	CHRM5	16	44
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853579796	EE	On-Demand	Anodyne	CHRM5	16	44
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853579800	EE	On-Demand	Anodyne	CHRM5	16	44
C#CCCN(CCOC)C(=O)NCc1ccc(NC(=O)c2cccnc2)cc1	ZINC000853579875	GF	On-Demand	Mild	NAMPT	62	40
CCN(Cc1c(O)ccc2ccc(OC)cc12)[C@H](C)C#N	ZINC000853580064	CG	On-Demand	Mild	MTNR1A	18	45
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853580120	JI	On-Demand	Anodyne	DRD4	25	42
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853580120	JI	On-Demand	Anodyne	SIGMAR1	27	45
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853580120	JI	On-Demand	Anodyne	MCHR1	29	41
CCN(Cc1c(O)ccc2ccc(OC)cc12)[C@@H](C)C#N	ZINC000853580131	CG	On-Demand	Mild	MTNR1A	18	45
CCOc1ccc(-n2c(-c3ccco3)nn(CN(CC)[C@@H](C)C#N)c2=S)cc1	ZINC000853580608	GI	On-Demand	Mild	CACNA2D1	56	35
CCOc1ccc(-n2c(-c3ccco3)nn(CN(CC)[C@H](C)C#N)c2=S)cc1	ZINC000853580610	GI	On-Demand	Mild	CACNA2D1	56	35
O=C(Cc1ccccc1)N1CCC[C@H](Nc2cnc(F)cn2)C1	ZINC000853580617	DE	On-Demand	Anodyne	PREP	59	36
O=C(Cc1ccccc1)N1CCC[C@H](Nc2cnc(F)cn2)C1	ZINC000853580617	DE	On-Demand	Anodyne	BIRC2	20	49
O=C(Cc1ccccc1)N1CCC[C@@H](Nc2cnc(F)cn2)C1	ZINC000853580619	DE	On-Demand	Anodyne	PREP	59	36
O=C(Cc1ccccc1)N1CCC[C@@H](Nc2cnc(F)cn2)C1	ZINC000853580619	DE	On-Demand	Anodyne	BIRC2	20	49
O=C(COC(=O)c1ccccc1CSC1=NCCS1)NCC1(c2ccccc2)CC1	ZINC000853580693	II	On-Demand	Anodyne	KCNA3	44	36
CCOc1ccc(-c2nnn(CN3CC[C@H]4C[C@H]4C3)n2)cc1	ZINC000853580698	CE	On-Demand	Anodyne	CACNA2D1	43	34
CCOc1ccc(-c2nnn(CN3CC[C@H]4C[C@H]4C3)n2)cc1	ZINC000853580698	CE	On-Demand	Anodyne	CACNA2D2	52	32
CCOc1ccc(-c2nnn(CN3CC[C@@H]4C[C@H]4C3)n2)cc1	ZINC000853580699	CE	On-Demand	Anodyne	CACNA2D1	43	34
CCOc1ccc(-c2nnn(CN3CC[C@@H]4C[C@H]4C3)n2)cc1	ZINC000853580699	CE	On-Demand	Anodyne	CACNA2D2	52	32
CCOc1ccc(-c2nnn(CN3CC[C@H]4C[C@@H]4C3)n2)cc1	ZINC000853580700	CE	On-Demand	Anodyne	CACNA2D1	43	34
CCOc1ccc(-c2nnn(CN3CC[C@H]4C[C@@H]4C3)n2)cc1	ZINC000853580700	CE	On-Demand	Anodyne	CACNA2D2	52	32
CCOc1ccc(-c2nnn(CN3CC[C@@H]4C[C@@H]4C3)n2)cc1	ZINC000853580701	CE	On-Demand	Anodyne	CACNA2D1	43	34
CCOc1ccc(-c2nnn(CN3CC[C@@H]4C[C@@H]4C3)n2)cc1	ZINC000853580701	CE	On-Demand	Anodyne	CACNA2D2	52	32
COc1ccc(-c2nccc(N3CCC[C@@](CO)(c4ccccc4)C3)n2)cc1	ZINC000853580707	GH	On-Demand	Anodyne	SORD	71	34
COc1ccc(-c2nccc(N3CCC[C@](CO)(c4ccccc4)C3)n2)cc1	ZINC000853580708	GH	On-Demand	Anodyne	SORD	71	34
CC(=O)c1ccnc(N2CCC[C@](CO)(c3ccccc3)C2)c1	ZINC000853580755	DF	On-Demand	Anodyne	SORD	41	33
CC(=O)c1ccnc(N2CCC[C@@](CO)(c3ccccc3)C2)c1	ZINC000853580756	DF	On-Demand	Anodyne	SORD	41	33
CC(C)c1ccc2ncnc(N[C@H]3CCCc4nn(C)cc43)c2c1	ZINC000853580844	DH	On-Demand	Anodyne	CD38	44	36
CC(C)c1ccc2ncnc(N[C@@H]3CCCc4nn(C)cc43)c2c1	ZINC000853580845	DH	On-Demand	Anodyne	CD38	44	36
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853580949	JH	On-Demand	Anodyne	DRD4	25	44
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853580949	JH	On-Demand	Anodyne	SIGMAR1	20	41
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853580953	JH	On-Demand	Anodyne	DRD4	25	44
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853580953	JH	On-Demand	Anodyne	SIGMAR1	20	41
COC(=O)c1nccc(N2CCC[C@@](CO)(c3ccccc3)C2)n1	ZINC000853581005	ED	On-Demand	Anodyne	SORD	87	36
COC(=O)c1nccc(N2CCC[C@](CO)(c3ccccc3)C2)n1	ZINC000853581007	ED	On-Demand	Anodyne	SORD	87	36
S=c1n(Cc2ccccc2)ccn1CN1CC[C@@H]2C[C@H]2C1	ZINC000853581019	CG	On-Demand	Anodyne	SIGMAR1	40	42
S=c1n(Cc2ccccc2)ccn1CN1CC[C@H]2C[C@H]2C1	ZINC000853581022	CG	On-Demand	Anodyne	SIGMAR1	40	42
S=c1n(Cc2ccccc2)ccn1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853581023	CG	On-Demand	Anodyne	SIGMAR1	40	42
S=c1n(Cc2ccccc2)ccn1CN1CC[C@H]2C[C@@H]2C1	ZINC000853581024	CG	On-Demand	Anodyne	SIGMAR1	40	42
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853581140	JI	On-Demand	Anodyne	EDNRB	18	40
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853581140	JI	On-Demand	Anodyne	TACR1	16	43
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853581140	JI	On-Demand	Anodyne	CCKAR	24	41
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853581140	JI	On-Demand	Anodyne	BRS3	25	40
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853581140	JI	On-Demand	Anodyne	NMBR	20	42
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853581531	JJ	On-Demand	Anodyne	KIT	24	41
C[C@H](OC(=O)c1ccccc1CSC1=NCCS1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853581531	JJ	On-Demand	Anodyne	BRAF	20	41
Cc1cc(C(F)(F)F)cc(N2CCC[C@@](CO)(c3ccccc3)C2)n1	ZINC000853581586	FH	On-Demand	Anodyne	TACR1	37	50
Cc1cc(C(F)(F)F)cc(N2CCC[C@](CO)(c3ccccc3)C2)n1	ZINC000853581587	FH	On-Demand	Anodyne	TACR1	37	50
COc1ccc(-c2nnn(CN3CC[C@H]4C[C@H]4C3)n2)cc1OC	ZINC000853581724	DD	On-Demand	Anodyne	SCARB1	23	41
COc1ccc(-c2nnn(CN3CC[C@@H]4C[C@@H]4C3)n2)cc1OC	ZINC000853581725	DD	On-Demand	Anodyne	SCARB1	23	41
COc1ccc(-c2nnn(CN3CC[C@H]4C[C@@H]4C3)n2)cc1OC	ZINC000853581726	DD	On-Demand	Anodyne	SCARB1	23	41
COc1ccc(-c2nnn(CN3CC[C@@H]4C[C@H]4C3)n2)cc1OC	ZINC000853581727	DD	On-Demand	Anodyne	SCARB1	23	41
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccccc21	ZINC000853581751	CD	On-Demand	Anodyne	ALDH1A1	62	45
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccccc21	ZINC000853581751	CD	On-Demand	Anodyne	ALDH3A1	46	55
O=C1C(=O)N(CN2CC[C@@H]3C[C@@H]3C2)c2ccccc21	ZINC000853581751	CD	On-Demand	Anodyne	CES1	18	44
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccccc21	ZINC000853581752	CD	On-Demand	Anodyne	ALDH1A1	62	45
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccccc21	ZINC000853581752	CD	On-Demand	Anodyne	ALDH3A1	46	55
O=C1C(=O)N(CN2CC[C@@H]3C[C@H]3C2)c2ccccc21	ZINC000853581752	CD	On-Demand	Anodyne	CES1	18	44
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccccc21	ZINC000853581753	CD	On-Demand	Anodyne	ALDH1A1	62	45
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccccc21	ZINC000853581753	CD	On-Demand	Anodyne	ALDH3A1	46	55
O=C1C(=O)N(CN2CC[C@H]3C[C@H]3C2)c2ccccc21	ZINC000853581753	CD	On-Demand	Anodyne	CES1	18	44
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccccc21	ZINC000853581754	CD	On-Demand	Anodyne	ALDH1A1	62	45
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccccc21	ZINC000853581754	CD	On-Demand	Anodyne	ALDH3A1	46	55
O=C1C(=O)N(CN2CC[C@H]3C[C@@H]3C2)c2ccccc21	ZINC000853581754	CD	On-Demand	Anodyne	CES1	18	44
O=c1oc2ccccc2n1CN1CC[C@@H]2C[C@@H]2C1	ZINC000853581825	BD	On-Demand	Anodyne	SIGMAR1	16	50
O=c1oc2ccccc2n1CN1CC[C@@H]2C[C@H]2C1	ZINC000853581826	BD	On-Demand	Anodyne	SIGMAR1	16	50
O=c1oc2ccccc2n1CN1CC[C@H]2C[C@H]2C1	ZINC000853581827	BD	On-Demand	Anodyne	SIGMAR1	16	50
O=c1oc2ccccc2n1CN1CC[C@H]2C[C@@H]2C1	ZINC000853581828	BD	On-Demand	Anodyne	SIGMAR1	16	50
CCOC(=O)c1nccc(N2CCC[C@](CO)(c3ccccc3)C2)n1	ZINC000853581829	EE	On-Demand	Anodyne	SORD	81	35
CCOC(=O)c1nccc(N2CCC[C@@](CO)(c3ccccc3)C2)n1	ZINC000853581830	EE	On-Demand	Anodyne	SORD	81	35
CON(C)CCNC(=O)NCc1ccc(NC(=O)c2ccncc2)cc1	ZINC000853581892	FD	On-Demand	Anodyne	ROCK2	29	44
CON(C)CCNC(=O)NCCc1cccc(C)c1	ZINC000853581914	CD	On-Demand	Anodyne	MTNR1A	47	40
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@H](OC(F)F)C1	ZINC000853581941	FD	On-Demand	Anodyne	LIPG	43	35
COC[C@@H](O)CNc1nc2ncccc2cc1C#N	ZINC000853581945	CC	On-Demand	Mild	CASR	43	40
COC[C@@H](O)CNc1nc2ncccc2cc1C#N	ZINC000853581945	CC	On-Demand	Mild	CYP2D6	17	40
Fc1ncnc(N2CC[C@H](OC(F)F)C2)c1Br	ZINC000853581962	DE	On-Demand	Anodyne	PDE3B	45	35
COc1ccccc1-c1nn(CN2CC[C@@H](N(C)C(=O)N(C)C)C2)c(=S)o1	ZINC000853581987	GF	On-Demand	Anodyne	MBTPS1	45	33
COc1ccccc1-c1nn(CN2CC[C@H](N(C)C(=O)N(C)C)C2)c(=S)o1	ZINC000853581988	GF	On-Demand	Anodyne	MBTPS1	45	33
O=C(NCC1CCOCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853582016	EG	On-Demand	Reactive	LCK	28	40
O=C(NCC1CCOCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853582016	EG	On-Demand	Reactive	CSNK1D	42	45
O=C(NCC1CCOCC1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853582021	DD	On-Demand	Reactive	SLC27A4	42	32
CN1[C@H]2CC[C@H]1CC([C@@H](Nc1cc(F)ncn1)c1ccc(Cl)cc1)C2	ZINC000853582056	FI	On-Demand	Anodyne	SLC6A3	22	43
CN1[C@H]2CC[C@H]1CC([C@H](Nc1cc(F)ncn1)c1ccc(Cl)cc1)C2	ZINC000853582057	FI	On-Demand	Anodyne	SLC6A3	22	43
COCCN(CCF)C(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000853582081	GG	On-Demand	Anodyne	NOD2	40	35
CC[C@H](C(=O)N1CCC(NC(=O)N(CCF)CCOC)CC1)c1ccccc1	ZINC000853582086	GF	On-Demand	Anodyne	P2RY12	65	33
CC[C@@H](C(=O)N1CCC(NC(=O)N(CCF)CCOC)CC1)c1ccccc1	ZINC000853582087	GF	On-Demand	Anodyne	P2RY12	65	33
CON(C)CCNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000853582099	FE	On-Demand	Anodyne	HTR1F	27	40
CON(C)CCNC(=O)NCc1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000853582099	FE	On-Demand	Anodyne	ROCK2	17	42
CC[C@@H](C(=O)N1CCC(NC(=O)NCCN(C)OC)CC1)c1ccccc1	ZINC000853582108	GD	On-Demand	Anodyne	CCR5	18	41
CC[C@@H](C(=O)N1CCC(NC(=O)NCCN(C)OC)CC1)c1ccccc1	ZINC000853582108	GD	On-Demand	Anodyne	EPHX2	35	43
CC[C@H](C(=O)N1CCC(NC(=O)NCCN(C)OC)CC1)c1ccccc1	ZINC000853582109	GD	On-Demand	Anodyne	CCR5	18	41
CC[C@H](C(=O)N1CCC(NC(=O)NCCN(C)OC)CC1)c1ccccc1	ZINC000853582109	GD	On-Demand	Anodyne	EPHX2	35	43
Cn1nnc2c(N3CC(OC(=O)Nc4cccc(F)c4)C3)ncnc21	ZINC000853582173	ED	On-Demand	Anodyne	LIMK2	41	36
CC[C@@H](C(=O)N1CCC(NC(=O)NCc2ncccn2)CC1)c1ccccc1	ZINC000853582266	GE	On-Demand	Anodyne	GRIN2B	17	41
CC[C@@H](C(=O)N1CCC(NC(=O)NCc2ncccn2)CC1)c1ccccc1	ZINC000853582266	GE	On-Demand	Anodyne	C3AR1	37	41
CC[C@@H](C(=O)N1CCC(NC(=O)NCc2ncccn2)CC1)c1ccccc1	ZINC000853582266	GE	On-Demand	Anodyne	EPHX2	48	44
CC[C@H](C(=O)N1CCC(NC(=O)NCc2ncccn2)CC1)c1ccccc1	ZINC000853582267	GE	On-Demand	Anodyne	GRIN2B	17	41
CC[C@H](C(=O)N1CCC(NC(=O)NCc2ncccn2)CC1)c1ccccc1	ZINC000853582267	GE	On-Demand	Anodyne	C3AR1	37	41
CC[C@H](C(=O)N1CCC(NC(=O)NCc2ncccn2)CC1)c1ccccc1	ZINC000853582267	GE	On-Demand	Anodyne	EPHX2	48	44
COC[C@@H](O)CNc1ncnc2c1ncn2-c1ccccc1	ZINC000853582272	CD	On-Demand	Anodyne	ADORA1	19	42
COC[C@@H](O)CNc1ncnc2c1ncn2-c1ccccc1	ZINC000853582272	CD	On-Demand	Anodyne	ADORA3	40	42
CC(=O)c1ccc(N2CC[C@H](OC(F)F)C2)c(I)c1	ZINC000853582308	GG	On-Demand	Anodyne	LIPG	47	36
COC[C@@H](O)CNc1nc(Nc2ccccc2)c2nc[nH]c2n1	ZINC000853582324	DD	On-Demand	Anodyne	CCNB_PATPE	52	30
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H]2C=CCC2)CC1)c1ccccc1	ZINC000853582333	FG	On-Demand	Anodyne	EPHX2	41	48
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H]2C=CCC2)CC1)c1ccccc1	ZINC000853582334	FG	On-Demand	Anodyne	EPHX2	41	48
CC[C@H](C(=O)N1CCC(NC(=O)N[C@@H]2C=CCC2)CC1)c1ccccc1	ZINC000853582335	FG	On-Demand	Anodyne	EPHX2	41	48
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@H]2C=CCC2)CC1)c1ccccc1	ZINC000853582336	FG	On-Demand	Anodyne	EPHX2	41	48
C[C@@H](CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1)N(C)C(=O)OC(C)(C)C	ZINC000853582392	GD	On-Demand	Bother	COLA	96	40
Fc1cc(N2CC[C@H](OC(F)F)C2)ncn1	ZINC000853582612	BD	On-Demand	Anodyne	PDE3B	43	34
COC[C@@H](O)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853582636	CE	On-Demand	Anodyne	EGFR	27	40
COC[C@@H](O)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853582636	CE	On-Demand	Anodyne	CLK4	56	35
O=C1C(=O)N(CN2CCOC(C3CC3)(C3CC3)C2)c2ccccc21	ZINC000853582654	EE	On-Demand	Anodyne	ALDH1A1	50	40
O=C1C(=O)N(CN2CCOC(C3CC3)(C3CC3)C2)c2ccccc21	ZINC000853582654	EE	On-Demand	Anodyne	ALDH3A1	41	50
O=C1C(=O)N(CN2CCOC(C3CC3)(C3CC3)C2)c2ccccc21	ZINC000853582654	EE	On-Demand	Anodyne	CES1	16	40
CN1[C@H]2CC[C@H]1CC([C@@H](Nc1cnc(F)cn1)c1ccc(Cl)cc1)C2	ZINC000853582678	FI	On-Demand	Anodyne	SLC6A3	22	44
CN1[C@H]2CC[C@H]1CC([C@H](Nc1cnc(F)cn1)c1ccc(Cl)cc1)C2	ZINC000853582679	FI	On-Demand	Anodyne	SLC6A3	22	44
O=C(NCC1CCOCC1)NNc1cc(F)cc(Cl)c1	ZINC000853582753	DF	On-Demand	Reactive	CACNA1I	70	37
Fc1ccc(N2CCCN(c3ncnc(F)c3Br)CC2)cc1F	ZINC000853582840	GG	On-Demand	Anodyne	ABCC1	53	33
COC[C@@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853582896	ED	On-Demand	Anodyne	PDPK1	16	45
COC[C@@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853582896	ED	On-Demand	Anodyne	SYK	21	44
COC[C@@H](O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853582896	ED	On-Demand	Anodyne	CDK1	17	46
Cc1ccc(N2CCC(c3nnc4n3CCN(C(=O)OC(C)(C)C)C4)CC2)nn1	ZINC000853582977	GF	On-Demand	Anodyne	GPR119	23	42
CC[C@H](C(=O)N1CCC(NC(=O)N[C@@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853582996	GG	On-Demand	Anodyne	GHRHR	44	32
CC[C@H](C(=O)N1CCC(NC(=O)N[C@@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853582996	GG	On-Demand	Anodyne	EPHX2	35	44
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853582998	GG	On-Demand	Anodyne	GHRHR	44	32
CC[C@H](C(=O)N1CCC(NC(=O)N[C@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853582998	GG	On-Demand	Anodyne	EPHX2	35	44
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853583000	GG	On-Demand	Anodyne	GHRHR	44	32
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853583000	GG	On-Demand	Anodyne	EPHX2	35	44
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853583003	GG	On-Demand	Anodyne	GHRHR	44	32
CC[C@@H](C(=O)N1CCC(NC(=O)N[C@H]2COC3(CCC3)C2)CC1)c1ccccc1	ZINC000853583003	GG	On-Demand	Anodyne	EPHX2	35	44
COc1ccc(-c2nnn(CN3CC[C@H](N(C)C(=O)N(C)C)C3)n2)cc1OC	ZINC000853583048	GD	On-Demand	Anodyne	SCARB1	40	48
COc1ccc(-c2nnn(CN3CC[C@@H](N(C)C(=O)N(C)C)C3)n2)cc1OC	ZINC000853583050	GD	On-Demand	Anodyne	SCARB1	40	48
CN(c1ccccc1)[C@H]1CCN(Cn2cc(S(=O)(=O)N(C)C)cn2)C1	ZINC000853583337	FD	On-Demand	Anodyne	CCR5	28	41
CN(c1ccccc1)[C@@H]1CCN(Cn2cc(S(=O)(=O)N(C)C)cn2)C1	ZINC000853583338	FD	On-Demand	Anodyne	CCR5	28	41
COc1cccc([C@H]2CC(=O)N(CN3CC[C@H](N(C)c4ccccc4)C3)C2)c1	ZINC000853583356	GG	On-Demand	Anodyne	HTR1A	15	40
COc1cccc([C@H]2CC(=O)N(CN3CC[C@@H](N(C)c4ccccc4)C3)C2)c1	ZINC000853583357	GG	On-Demand	Anodyne	HTR1A	15	40
Cn1ncc2c(=O)n(CN3CCOC(C4CC4)(C4CC4)C3)nnc21	ZINC000853583445	EC	On-Demand	Anodyne	Q9M629_MAIZE	58	34
COC(=O)c1ncn(CN2CC[C@H](N(C)c3ccccc3)C2)n1	ZINC000853583510	DD	On-Demand	Anodyne	CCR5	33	41
COC(=O)c1ncn(CN2CC[C@@H](N(C)c3ccccc3)C2)n1	ZINC000853583511	DD	On-Demand	Anodyne	CCR5	33	41
C[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)N(C)C(=O)OC(C)(C)C	ZINC000853583585	FE	On-Demand	Bother	COLA	45	36
COC(=O)c1nn(CN2CCOC(C3CC3)(C3CC3)C2)c2ccccc12	ZINC000853583600	FF	On-Demand	Anodyne	HTR4	37	42
Cc1ccc(N2CC(OC(=O)Nc3cccc(F)c3)C2)nn1	ZINC000853583660	DE	On-Demand	Anodyne	SCD1	24	41
CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853583743	GD	On-Demand	Anodyne	SIGMAR1	19	40
CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853583743	GD	On-Demand	Anodyne	MCHR1	22	42
CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853583743	GD	On-Demand	Anodyne	CACNA1I	48	34
CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853583746	GD	On-Demand	Anodyne	SIGMAR1	19	40
CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853583746	GD	On-Demand	Anodyne	MCHR1	22	42
CC(C)(C)OC(=O)NCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853583746	GD	On-Demand	Anodyne	CACNA1I	48	34
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCC2CCOCC2)C1	ZINC000853583854	EE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCC2CCOCC2)C1	ZINC000853583855	EE	On-Demand	Anodyne	CACNA1I	41	32
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCOC(C2CC2)(C2CC2)C1	ZINC000853583896	FD	On-Demand	Anodyne	CHRNA7	17	61
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCOC(C2CC2)(C2CC2)C1	ZINC000853583901	FD	On-Demand	Anodyne	CHRNA7	17	61
CC(C)(C)OC(=O)NCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853584027	ED	On-Demand	Anodyne	CPT1A	70	34
CC(C)(C)OC(=O)NCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853584030	ED	On-Demand	Anodyne	CPT1A	70	34
C#CCCN(CCOC)C(=O)NC1CCN(C(=O)[C@@H](CC)c2ccccc2)CC1	ZINC000853584093	GF	On-Demand	Mild	P2RY12	42	33
C#CCCN(CCOC)C(=O)NC1CCN(C(=O)[C@H](CC)c2ccccc2)CC1	ZINC000853584094	GF	On-Demand	Mild	P2RY12	42	33
CN(c1ccccc1)[C@@H]1CCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853584249	FE	On-Demand	Anodyne	CHRNA7	18	53
CN(c1ccccc1)[C@H]1CCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853584254	FE	On-Demand	Anodyne	CHRNA7	18	53
CN(c1ccccc1)[C@H]1CCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853584258	FE	On-Demand	Anodyne	CHRNA7	18	53
CN(c1ccccc1)[C@@H]1CCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853584261	FE	On-Demand	Anodyne	CHRNA7	18	53
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)c3cc4c(cc32)OCCO4)C1	ZINC000853584295	GE	On-Demand	Anodyne	ALDH1A1	41	31
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)c3cc4c(cc32)OCCO4)C1	ZINC000853584295	GE	On-Demand	Anodyne	ALDH3A1	28	41
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)c3cc4c(cc32)OCCO4)C1	ZINC000853584296	GE	On-Demand	Anodyne	ALDH1A1	41	31
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)c3cc4c(cc32)OCCO4)C1	ZINC000853584296	GE	On-Demand	Anodyne	ALDH3A1	28	41
COc1ccccc1-n1cnn(CN2CC[C@H](N(C)C(=O)N(C)C)C2)c1=S	ZINC000853584428	GE	On-Demand	Anodyne	HTR1A	41	38
COc1ccccc1-n1cnn(CN2CC[C@@H](N(C)C(=O)N(C)C)C2)c1=S	ZINC000853584429	GE	On-Demand	Anodyne	HTR1A	41	38
COC(=O)c1ccc(=O)n(CN2CC[C@H](N(C)c3ccccc3)C2)n1	ZINC000853584452	ED	On-Demand	Anodyne	CCR5	33	41
COC(=O)c1ccc(=O)n(CN2CC[C@@H](N(C)c3ccccc3)C2)n1	ZINC000853584453	ED	On-Demand	Anodyne	CCR5	33	41
CN(c1ccccc1)[C@@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000853584503	FF	On-Demand	Anodyne	WNT3A	40	32
CN(c1ccccc1)[C@H]1CCN(Cn2nc(-c3ccc(F)cc3)oc2=O)C1	ZINC000853584504	FF	On-Demand	Anodyne	WNT3A	40	32
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)c3cccc(F)c32)C1	ZINC000853584660	FF	On-Demand	Anodyne	ALDH1A1	41	31
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)c3cccc(F)c32)C1	ZINC000853584663	FF	On-Demand	Anodyne	ALDH1A1	41	31
COc1ccc(-c2nnn(CN3CC[C@@H](N(C)c4ccccc4)C3)n2)cc1OC	ZINC000853584704	GF	On-Demand	Anodyne	SCARB1	41	46
COc1ccc(-c2nnn(CN3CC[C@H](N(C)c4ccccc4)C3)n2)cc1OC	ZINC000853584706	GF	On-Demand	Anodyne	SCARB1	41	46
COC(=O)c1cn(CN2CC[C@H](N(C)c3ccccc3)C2)nn1	ZINC000853584891	DD	On-Demand	Anodyne	CCR5	23	40
COC(=O)c1cn(CN2CC[C@@H](N(C)c3ccccc3)C2)nn1	ZINC000853584892	DD	On-Demand	Anodyne	CCR5	23	40
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853584921	EE	On-Demand	Anodyne	ALDH1A1	64	45
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853584921	EE	On-Demand	Anodyne	ALDH3A1	46	54
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853584921	EE	On-Demand	Anodyne	CES1	18	44
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853584923	EE	On-Demand	Anodyne	ALDH1A1	64	45
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853584923	EE	On-Demand	Anodyne	ALDH3A1	46	54
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853584923	EE	On-Demand	Anodyne	CES1	18	44
CN(c1ccccc1)[C@H]1CCN(Cn2nnc3c(cnn3C)c2=O)C1	ZINC000853584946	EC	On-Demand	Anodyne	Q9M629_MAIZE	51	34
CN(c1ccccc1)[C@@H]1CCN(Cn2nnc3c(cnn3C)c2=O)C1	ZINC000853584948	EC	On-Demand	Anodyne	Q9M629_MAIZE	51	34
C#CCCN(CCOC)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000853585054	EE	On-Demand	Mild	CACNA1G	21	41
CC(C)(C)OC(=O)NCCNC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853585091	FD	On-Demand	Anodyne	CASR	35	40
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)cc3)C2)cc1	ZINC000853585117	FF	On-Demand	Clean	MTNR1A	36	45
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)cc3)C2)cc1	ZINC000853585117	FF	On-Demand	Clean	MTNR1B	29	45
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)cc3)C2)cc1	ZINC000853585117	FF	On-Demand	Clean	MCHR1	19	55
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)NCCc1ccc(O)cc1	ZINC000853585119	FD	On-Demand	Reactive	GRIA1	47	40
O=c1oc2ccccc2n1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853585120	CD	On-Demand	Anodyne	SIGMAR1	16	48
O=c1oc2ccccc2n1CN1CC[C@H]2COC[C@H]2C1	ZINC000853585121	CD	On-Demand	Anodyne	SIGMAR1	16	48
O=c1oc2ccccc2n1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853585122	CD	On-Demand	Anodyne	SIGMAR1	16	48
O=c1oc2ccccc2n1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853585123	CD	On-Demand	Anodyne	SIGMAR1	16	48
Cc1ccn(CN2CC[C@H](N(C)c3ccccc3)C2)c(=O)c1C#N	ZINC000853585233	DE	On-Demand	Mild	GRM2	17	42
Cc1ccn(CN2CC[C@@H](N(C)c3ccccc3)C2)c(=O)c1C#N	ZINC000853585235	DE	On-Demand	Mild	GRM2	17	42
CN(c1ccccc1)[C@H]1CCN(Cn2c(=O)oc3ccc(F)cc32)C1	ZINC000853585245	EF	On-Demand	Anodyne	TSPO	21	45
CN(c1ccccc1)[C@@H]1CCN(Cn2c(=O)oc3ccc(F)cc32)C1	ZINC000853585247	EF	On-Demand	Anodyne	TSPO	21	45
CON(C)CCNC(=O)NCCCc1nc2ccccc2[nH]1	ZINC000853585381	DD	On-Demand	Anodyne	CACNA1G	25	48
CC(C)(C)OC(=O)NCCNC(=O)N[C@@H](c1cccs1)C1(CO)CCC1	ZINC000853585511	GF	On-Demand	Anodyne	PAPA1_CARPA	27	43
CC(C)(C)OC(=O)NCCNC(=O)N[C@H](c1cccs1)C1(CO)CCC1	ZINC000853585513	GF	On-Demand	Anodyne	PAPA1_CARPA	27	43
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	MME	40	38
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	CTSB	33	42
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	PAPA1_CARPA	52	48
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	CTSL	20	48
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	TACR3	18	45
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	REN	42	39
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	NPY5R	17	44
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853585542	FD	On-Demand	Anodyne	FPR1	51	40
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	MME	40	38
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	CTSB	33	42
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	PAPA1_CARPA	52	48
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	CTSL	20	48
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	TACR3	18	45
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	REN	42	39
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	NPY5R	17	44
CN(C(=O)NCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853585544	FD	On-Demand	Anodyne	FPR1	51	40
CC(C)(C)OC(=O)NCCNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853585591	EF	On-Demand	Mild	IMDH_CRYPV	57	34
CN(c1ccccc1)[C@@H]1CCN(CN2C[C@@H](O)CC2=O)C1	ZINC000853585626	CC	On-Demand	Anodyne	OPRK1	16	41
CN(c1ccccc1)[C@H]1CCN(CN2C[C@@H](O)CC2=O)C1	ZINC000853585628	CC	On-Demand	Anodyne	OPRK1	16	41
CN(c1ccccc1)[C@@H]1CCN(CN2C[C@H](O)CC2=O)C1	ZINC000853585630	CC	On-Demand	Anodyne	OPRK1	16	41
CN(c1ccccc1)[C@H]1CCN(CN2C[C@H](O)CC2=O)C1	ZINC000853585632	CC	On-Demand	Anodyne	OPRK1	16	41
COCCN(CCF)C(=O)NCCc1ccc(O)cc1	ZINC000853585679	CD	On-Demand	Anodyne	SLC6A5	23	40
CC(C)(C)OC(=O)NCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853585681	GG	On-Demand	Reactive	LCK	22	45
CC(C)(C)OC(=O)NCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853585681	GG	On-Demand	Reactive	CSNK1D	44	47
C#CCCCOc1cccnc1NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000853585692	GH	On-Demand	Mild	HRH3	16	51
COC(=O)c1ccc2c(c1)C(=O)N(CN1CC[C@H](N(C)c3ccccc3)C1)C2	ZINC000853585762	GF	On-Demand	Anodyne	CCR5	15	42
COC(=O)c1ccc2c(c1)C(=O)N(CN1CC[C@H](N(C)c3ccccc3)C1)C2	ZINC000853585762	GF	On-Demand	Anodyne	FLT4	17	40
COC(=O)c1ccc2c(c1)C(=O)N(CN1CC[C@@H](N(C)c3ccccc3)C1)C2	ZINC000853585763	GF	On-Demand	Anodyne	CCR5	15	42
COC(=O)c1ccc2c(c1)C(=O)N(CN1CC[C@@H](N(C)c3ccccc3)C1)C2	ZINC000853585763	GF	On-Demand	Anodyne	FLT4	17	40
COC(=O)c1nccc(N2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)n1	ZINC000853585774	DE	On-Demand	Anodyne	SORD	33	40
COC(=O)c1nccc(N2CC[C@]3(C)[C@@H](C2)C3(Cl)Cl)n1	ZINC000853585775	DE	On-Demand	Anodyne	SORD	33	40
COC(=O)c1nccc(N2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)n1	ZINC000853585776	DE	On-Demand	Anodyne	SORD	33	40
COC(=O)c1nccc(N2CC[C@@]3(C)[C@H](C2)C3(Cl)Cl)n1	ZINC000853585777	DE	On-Demand	Anodyne	SORD	33	40
COc1ccc(N2CC[C@H](NC(=O)NCCN(C)C3CCCCC3)C2)cc1	ZINC000853585822	FF	On-Demand	Clean	MTNR1A	18	44
COc1ccc(N2CC[C@H](NC(=O)NCCN(C)C3CCCCC3)C2)cc1	ZINC000853585822	FF	On-Demand	Clean	MCHR1	18	51
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1ccc(O)cc1	ZINC000853585826	GF	On-Demand	Anodyne	GPR119	32	43
CN(c1ccccc1)[C@H]1CCN(Cn2c(=O)oc3ccccc32)C1	ZINC000853585835	DF	On-Demand	Anodyne	TSPO	20	55
CN(c1ccccc1)[C@@H]1CCN(Cn2c(=O)oc3ccccc32)C1	ZINC000853585837	DF	On-Demand	Anodyne	TSPO	20	55
COc1cccc(C2(NC(=O)NCCNC(=O)OC(C)(C)C)CCC2)c1	ZINC000853585859	FF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C2(NC(=O)NCCNC(=O)OC(C)(C)C)CCC2)c1	ZINC000853585859	FF	On-Demand	Anodyne	MTNR1A	42	38
COC[C@H](NC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853585874	FE	On-Demand	Anodyne	DRD4	41	31
COC[C@H](NC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853585874	FE	On-Demand	Anodyne	MTNR1A	44	41
COC[C@H](NC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853585874	FE	On-Demand	Anodyne	MTNR1B	44	41
COC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853585876	FE	On-Demand	Anodyne	DRD4	41	31
COC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853585876	FE	On-Demand	Anodyne	MTNR1A	44	41
COC[C@@H](NC(=O)NCCNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853585876	FE	On-Demand	Anodyne	MTNR1B	44	41
CC(C)(C)OC(=O)NCCNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853585936	GE	On-Demand	Anodyne	SLC6A3	16	44
C[C@@H](CCNC(=O)NCCNC(=O)OC(C)(C)C)N(C)C	ZINC000853585953	DD	On-Demand	Anodyne	CTSK	15	40
C[C@@H](CCNC(=O)NCCNC(=O)OC(C)(C)C)N(C)C	ZINC000853585953	DD	On-Demand	Anodyne	CHRNA4	22	49
COCCn1cc([C@@H]2OCC[C@H]2NC(=O)NCCNC(=O)OC(C)(C)C)cn1	ZINC000853585970	GD	On-Demand	Anodyne	PANC	40	30
CN(c1ccccc1)[C@@H]1CCN(CN2CC3(CCCC3)CC2=O)C1	ZINC000853585983	EF	On-Demand	Anodyne	ADRA1D	16	43
CN(c1ccccc1)[C@H]1CCN(CN2CC3(CCCC3)CC2=O)C1	ZINC000853585984	EF	On-Demand	Anodyne	ADRA1D	16	43
CN(c1ccccc1)[C@H]1CCN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1	ZINC000853585996	FF	On-Demand	Bother	TSPO	20	44
CN(c1ccccc1)[C@@H]1CCN(Cn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1	ZINC000853585997	FF	On-Demand	Bother	TSPO	20	44
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853586181	GE	On-Demand	Anodyne	ACHE	20	41
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853586181	GE	On-Demand	Anodyne	SIGMAR1	42	42
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853586182	GE	On-Demand	Anodyne	ACHE	20	41
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853586182	GE	On-Demand	Anodyne	SIGMAR1	42	42
CC(C)(C)OC(=O)NCCNC(=O)N[C@H](c1cccs1)C(C)(C)CO	ZINC000853586216	FF	On-Demand	Anodyne	PAPA1_CARPA	28	44
CC(C)(C)OC(=O)NCCNC(=O)N[C@@H](c1cccs1)C(C)(C)CO	ZINC000853586217	FF	On-Demand	Anodyne	PAPA1_CARPA	28	44
COc1cc2c(cc1OC)N(CN1CC[C@H](N(C)c3ccccc3)C1)C(=O)C2=O	ZINC000853586238	GE	On-Demand	Anodyne	ACHE	18	41
COc1cc2c(cc1OC)N(CN1CC[C@H](N(C)c3ccccc3)C1)C(=O)C2=O	ZINC000853586238	GE	On-Demand	Anodyne	ALDH1A1	41	31
COc1cc2c(cc1OC)N(CN1CC[C@H](N(C)c3ccccc3)C1)C(=O)C2=O	ZINC000853586238	GE	On-Demand	Anodyne	CASP7	45	34
COc1cc2c(cc1OC)N(CN1CC[C@@H](N(C)c3ccccc3)C1)C(=O)C2=O	ZINC000853586239	GE	On-Demand	Anodyne	ACHE	18	41
COc1cc2c(cc1OC)N(CN1CC[C@@H](N(C)c3ccccc3)C1)C(=O)C2=O	ZINC000853586239	GE	On-Demand	Anodyne	ALDH1A1	41	31
COc1cc2c(cc1OC)N(CN1CC[C@@H](N(C)c3ccccc3)C1)C(=O)C2=O	ZINC000853586239	GE	On-Demand	Anodyne	CASP7	45	34
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853586248	GE	On-Demand	Anodyne	GALR1	47	36
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853586248	GE	On-Demand	Anodyne	CCR5	20	43
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853586248	GE	On-Demand	Anodyne	GHRL	41	33
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853586266	GE	On-Demand	Anodyne	GALR1	47	36
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853586266	GE	On-Demand	Anodyne	CCR5	20	43
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853586266	GE	On-Demand	Anodyne	GHRL	41	33
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000853586268	GE	On-Demand	Anodyne	GALR1	47	36
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000853586268	GE	On-Demand	Anodyne	CCR5	20	43
CN(c1ccccc1)[C@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000853586268	GE	On-Demand	Anodyne	GHRL	41	33
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000853586270	GE	On-Demand	Anodyne	GALR1	47	36
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000853586270	GE	On-Demand	Anodyne	CCR5	20	43
CN(c1ccccc1)[C@@H]1CCN(CN2C(=O)N[C@H](Cc3ccccc3)C2=O)C1	ZINC000853586270	GE	On-Demand	Anodyne	GHRL	41	33
COc1ccc(-c2nnn(CN3CC[C@H]4COC[C@@H]4C3)n2)cc1OC	ZINC000853586321	ED	On-Demand	Anodyne	SCARB1	25	42
COc1ccc(-c2nnn(CN3CC[C@@H]4COC[C@@H]4C3)n2)cc1OC	ZINC000853586322	ED	On-Demand	Anodyne	SCARB1	25	42
COc1ccc(-c2nnn(CN3CC[C@H]4COC[C@H]4C3)n2)cc1OC	ZINC000853586323	ED	On-Demand	Anodyne	SCARB1	25	42
COc1ccc(-c2nnn(CN3CC[C@@H]4COC[C@H]4C3)n2)cc1OC	ZINC000853586324	ED	On-Demand	Anodyne	SCARB1	25	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586336	EC	On-Demand	Anodyne	ACHE	21	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586336	EC	On-Demand	Anodyne	SIGMAR1	46	40
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586337	EC	On-Demand	Anodyne	ACHE	21	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586337	EC	On-Demand	Anodyne	SIGMAR1	46	40
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586338	EC	On-Demand	Anodyne	ACHE	21	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586338	EC	On-Demand	Anodyne	SIGMAR1	46	40
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586339	EC	On-Demand	Anodyne	ACHE	21	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)C(=O)N1Cc1ccccc1	ZINC000853586339	EC	On-Demand	Anodyne	SIGMAR1	46	40
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccc(Br)cc21	ZINC000853586427	FD	On-Demand	Anodyne	ALDH1A1	15	44
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccc(Br)cc21	ZINC000853586427	FD	On-Demand	Anodyne	CASP7	42	37
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccc(Br)cc21	ZINC000853586428	FD	On-Demand	Anodyne	ALDH1A1	15	44
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccc(Br)cc21	ZINC000853586428	FD	On-Demand	Anodyne	CASP7	42	37
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccc(Br)cc21	ZINC000853586429	FD	On-Demand	Anodyne	ALDH1A1	15	44
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccc(Br)cc21	ZINC000853586429	FD	On-Demand	Anodyne	CASP7	42	37
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccc(Br)cc21	ZINC000853586430	FD	On-Demand	Anodyne	ALDH1A1	15	44
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccc(Br)cc21	ZINC000853586430	FD	On-Demand	Anodyne	CASP7	42	37
CC(C)(C)OC(=O)NCCNC(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853586481	EE	On-Demand	Anodyne	NQO2	20	46
CC(C)(C)OC(=O)NCCNC(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853586482	EE	On-Demand	Anodyne	NQO2	20	46
COC1(c2nc(-c3ccccn3)no2)CCN(c2cc(F)ncn2)CC1	ZINC000853586532	FE	On-Demand	Anodyne	LUCI_PHOPE	23	40
Cc1nnc(-c2cccc(C#N)c2)n1CN1CC[C@H]2COC[C@H]2C1	ZINC000853586664	DE	On-Demand	Mild	LRRK2	15	41
Cc1nnc(-c2cccc(C#N)c2)n1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853586665	DE	On-Demand	Mild	LRRK2	15	41
Cc1nnc(-c2cccc(C#N)c2)n1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853586666	DE	On-Demand	Mild	LRRK2	15	41
Cc1nnc(-c2cccc(C#N)c2)n1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853586667	DE	On-Demand	Mild	LRRK2	15	41
Cc1ccc2c(c1Br)CN(C(=O)NCc1ccc([C@@H](C)O)cc1)C2	ZINC000853586672	GI	On-Demand	Anodyne	NAMPT	23	41
Cc1ccc2c(c1Br)CN(C(=O)NCc1ccc([C@H](C)O)cc1)C2	ZINC000853586673	GI	On-Demand	Anodyne	NAMPT	23	41
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccccc21	ZINC000853586777	CD	On-Demand	Anodyne	ALDH1A1	58	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccccc21	ZINC000853586777	CD	On-Demand	Anodyne	ALDH3A1	43	52
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccccc21	ZINC000853586777	CD	On-Demand	Anodyne	CES1	16	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccccc21	ZINC000853586779	CD	On-Demand	Anodyne	ALDH1A1	58	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccccc21	ZINC000853586779	CD	On-Demand	Anodyne	ALDH3A1	43	52
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccccc21	ZINC000853586779	CD	On-Demand	Anodyne	CES1	16	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccccc21	ZINC000853586781	CD	On-Demand	Anodyne	ALDH1A1	58	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccccc21	ZINC000853586781	CD	On-Demand	Anodyne	ALDH3A1	43	52
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccccc21	ZINC000853586781	CD	On-Demand	Anodyne	CES1	16	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccccc21	ZINC000853586783	CD	On-Demand	Anodyne	ALDH1A1	58	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccccc21	ZINC000853586783	CD	On-Demand	Anodyne	ALDH3A1	43	52
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccccc21	ZINC000853586783	CD	On-Demand	Anodyne	CES1	16	42
Cn1c(S)nnc1CCNC(=O)NCCCc1nc2ccccc2[nH]1	ZINC000853586785	FD	On-Demand	Anodyne	PIN1	19	40
Fc1ncnc(N2CCC(CC(F)(F)F)CC2)c1Br	ZINC000853586843	EH	On-Demand	Anodyne	SIRT3	50	36
Fc1ncnc(N2CCC(CC(F)(F)F)CC2)c1Br	ZINC000853586843	EH	On-Demand	Anodyne	SIRT2	40	33
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)Nc1cnc(F)cn1	ZINC000853586860	DE	On-Demand	Anodyne	MME	43	36
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)Nc1cnc(F)cn1	ZINC000853586860	DE	On-Demand	Anodyne	CAPNS1	42	33
COC(=O)[C@H](Cc1ccccc1)[C@H](C)Nc1cnc(F)cn1	ZINC000853586861	DE	On-Demand	Anodyne	MME	43	36
COC(=O)[C@H](Cc1ccccc1)[C@H](C)Nc1cnc(F)cn1	ZINC000853586861	DE	On-Demand	Anodyne	CAPNS1	42	33
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)Nc1cnc(F)cn1	ZINC000853586862	DE	On-Demand	Anodyne	MME	43	36
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)Nc1cnc(F)cn1	ZINC000853586862	DE	On-Demand	Anodyne	CAPNS1	42	33
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000853586905	FE	On-Demand	Mild	CACNA1G	21	40
C[C@H](O)c1ccc(CNC(=O)N[C@]2(C)CC2(C)C)cc1	ZINC000853586993	CF	On-Demand	Anodyne	ANPEP	18	43
C[C@H](O)c1ccc(CNC(=O)N[C@@]2(C)CC2(C)C)cc1	ZINC000853586994	CF	On-Demand	Anodyne	ANPEP	18	43
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H](C3CCC3)C2)cc1	ZINC000853587073	DG	On-Demand	Anodyne	BIRC2	41	33
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H](C3CCC3)C2)cc1	ZINC000853587075	DG	On-Demand	Anodyne	BIRC2	41	33
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)C(=O)N(C)C)C2)cc1	ZINC000853587095	ED	On-Demand	Anodyne	CCR5	26	44
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)C(=O)N(C)C)C2)cc1	ZINC000853587095	ED	On-Demand	Anodyne	MCHR1	22	43
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)C(=O)N(C)C)C2)cc1	ZINC000853587098	ED	On-Demand	Anodyne	CCR5	26	44
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)C(=O)N(C)C)C2)cc1	ZINC000853587098	ED	On-Demand	Anodyne	MCHR1	22	43
CCOc1ccc(-c2nnn(CN3CC[C@@H]4COC[C@@H]4C3)n2)cc1	ZINC000853587115	ED	On-Demand	Anodyne	CACNA2D2	50	31
CCOc1ccc(-c2nnn(CN3CC[C@H]4COC[C@@H]4C3)n2)cc1	ZINC000853587116	ED	On-Demand	Anodyne	CACNA2D2	50	31
CCOc1ccc(-c2nnn(CN3CC[C@@H]4COC[C@H]4C3)n2)cc1	ZINC000853587117	ED	On-Demand	Anodyne	CACNA2D2	50	31
CCOc1ccc(-c2nnn(CN3CC[C@H]4COC[C@H]4C3)n2)cc1	ZINC000853587118	ED	On-Demand	Anodyne	CACNA2D2	50	31
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853587137	FE	On-Demand	Anodyne	CHRM5	15	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853587138	FE	On-Demand	Anodyne	CHRM5	15	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853587139	FE	On-Demand	Anodyne	CHRM5	15	42
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853587140	FE	On-Demand	Anodyne	CHRM5	15	42
C[C@H](O)c1ccc(CNC(=O)NC2CCC(C3CCC3)CC2)cc1	ZINC000853587162	EH	On-Demand	Anodyne	EPHX2	22	43
C[C@H](O)c1ccc(CNC(=O)N2CCc3c(cccc3C(N)=O)C2)cc1	ZINC000853587202	FE	On-Demand	Anodyne	NAMPT	23	40
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)cc1	ZINC000853587205	GH	On-Demand	Anodyne	ADRB2	55	47
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)cc1	ZINC000853587205	GH	On-Demand	Anodyne	ADRB1	18	53
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)cc1	ZINC000853587207	GH	On-Demand	Anodyne	ADRB2	55	47
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)cc1	ZINC000853587207	GH	On-Demand	Anodyne	ADRB1	18	53
C[C@H](O)c1ccc(CNC(=O)N[C@]2(c3ccccc3)CC2(C)C)cc1	ZINC000853587251	EH	On-Demand	Anodyne	ANPEP	15	40
C[C@H](O)c1ccc(CNC(=O)N[C@@]2(c3ccccc3)CC2(C)C)cc1	ZINC000853587254	EH	On-Demand	Anodyne	ANPEP	15	40
COc1cc2c(cc1OC)N(CN1CC[C@@H]3COC[C@@H]3C1)C(=O)C2=O	ZINC000853587330	ED	On-Demand	Anodyne	ADRA2C	43	32
COc1cc2c(cc1OC)N(CN1CC[C@H]3COC[C@H]3C1)C(=O)C2=O	ZINC000853587331	ED	On-Demand	Anodyne	ADRA2C	43	32
COc1cc2c(cc1OC)N(CN1CC[C@H]3COC[C@@H]3C1)C(=O)C2=O	ZINC000853587332	ED	On-Demand	Anodyne	ADRA2C	43	32
COc1cc2c(cc1OC)N(CN1CC[C@@H]3COC[C@H]3C1)C(=O)C2=O	ZINC000853587333	ED	On-Demand	Anodyne	ADRA2C	43	32
C[C@H](O)c1ccc(CNC(=O)NCc2cc(F)ccc2OC(F)F)cc1	ZINC000853587429	FG	On-Demand	Anodyne	PDE4A	22	42
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587430	FF	On-Demand	Anodyne	CASP3	41	35
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587430	FF	On-Demand	Anodyne	ALDH1A1	43	36
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587430	FF	On-Demand	Anodyne	ALDH3A1	28	41
O=C1C(=O)N(CN2CC[C@@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587430	FF	On-Demand	Anodyne	CASP7	55	34
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587431	FF	On-Demand	Anodyne	CASP3	41	35
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587431	FF	On-Demand	Anodyne	ALDH1A1	43	36
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587431	FF	On-Demand	Anodyne	ALDH3A1	28	41
O=C1C(=O)N(CN2CC[C@@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587431	FF	On-Demand	Anodyne	CASP7	55	34
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587432	FF	On-Demand	Anodyne	CASP3	41	35
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587432	FF	On-Demand	Anodyne	ALDH1A1	43	36
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587432	FF	On-Demand	Anodyne	ALDH3A1	28	41
O=C1C(=O)N(CN2CC[C@H]3COC[C@@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587432	FF	On-Demand	Anodyne	CASP7	55	34
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587433	FF	On-Demand	Anodyne	CASP3	41	35
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587433	FF	On-Demand	Anodyne	ALDH1A1	43	36
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587433	FF	On-Demand	Anodyne	ALDH3A1	28	41
O=C1C(=O)N(CN2CC[C@H]3COC[C@H]3C2)c2ccc(-c3ccccc3)cc21	ZINC000853587433	FF	On-Demand	Anodyne	CASP7	55	34
C[C@H](O)c1ccc(CNC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853587469	EF	On-Demand	Anodyne	CCR3	91	37
C[C@H](O)c1ccc(CNC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853587471	EF	On-Demand	Anodyne	CCR3	91	37
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)c3ccccc3)C2)cc1	ZINC000853587526	FG	On-Demand	Anodyne	CCR1	20	40
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)c3ccccc3)C2)cc1	ZINC000853587526	FG	On-Demand	Anodyne	CCR5	57	46
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)c3ccccc3)C2)cc1	ZINC000853587526	FG	On-Demand	Anodyne	NPSR1	27	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)c3ccccc3)C2)cc1	ZINC000853587526	FG	On-Demand	Anodyne	NAMPT	20	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)c3ccccc3)C2)cc1	ZINC000853587527	FG	On-Demand	Anodyne	CCR1	20	40
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)c3ccccc3)C2)cc1	ZINC000853587527	FG	On-Demand	Anodyne	CCR5	57	46
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)c3ccccc3)C2)cc1	ZINC000853587527	FG	On-Demand	Anodyne	NPSR1	27	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)c3ccccc3)C2)cc1	ZINC000853587527	FG	On-Demand	Anodyne	NAMPT	20	41
Cc1nnc(CN(C)C(=O)NCc2ccc([C@H](C)O)cc2)s1	ZINC000853587653	DE	On-Demand	Anodyne	UL54	52	33
Cc1nnc(CN(C)C(=O)NCc2ccc([C@@H](C)O)cc2)s1	ZINC000853587654	DE	On-Demand	Anodyne	UL54	52	33
C[C@H](O)c1ccc(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)cc1	ZINC000853587665	FF	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](O)c1ccc(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)cc1	ZINC000853587665	FF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@H](O)c1ccc(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)cc1	ZINC000853587665	FF	On-Demand	Anodyne	CCR5	15	40
C[C@H](O)c1ccc(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)cc1	ZINC000853587665	FF	On-Demand	Anodyne	MBTPS1	40	31
C[C@H](O)c1ccc(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)cc1	ZINC000853587666	FF	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](O)c1ccc(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)cc1	ZINC000853587666	FF	On-Demand	Anodyne	SIGMAR1	30	43
C[C@H](O)c1ccc(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)cc1	ZINC000853587666	FF	On-Demand	Anodyne	CCR5	15	40
C[C@H](O)c1ccc(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)cc1	ZINC000853587666	FF	On-Demand	Anodyne	MBTPS1	40	31
C[C@H](O)c1ccc(CNC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853587701	EE	On-Demand	Anodyne	MME	56	37
C[C@H](O)c1ccc(CNC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853587701	EE	On-Demand	Anodyne	NPY5R	33	42
C[C@H](O)c1ccc(CNC(=O)N(C)[C@@H](CO)Cc2ccccc2)cc1	ZINC000853587701	EE	On-Demand	Anodyne	AMP1_PLAFQ	45	38
C[C@H](O)c1ccc(CNC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853587703	EE	On-Demand	Anodyne	MME	56	37
C[C@H](O)c1ccc(CNC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853587703	EE	On-Demand	Anodyne	NPY5R	33	42
C[C@H](O)c1ccc(CNC(=O)N(C)[C@H](CO)Cc2ccccc2)cc1	ZINC000853587703	EE	On-Demand	Anodyne	AMP1_PLAFQ	45	38
C[C@H](O)c1ccc(CNC(=O)N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)cc1	ZINC000853587716	GD	On-Demand	Anodyne	TRPV1	68	37
C[C@H](O)c1ccc(CNC(=O)N2CCc3nnc(-c4cnn(C)c4)cc3C2)cc1	ZINC000853587735	GE	On-Demand	Anodyne	MAPK1	40	41
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2c2nccc(C(F)(F)F)n2)cc1	ZINC000853587765	GH	On-Demand	Anodyne	TRPV1	57	36
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H]2c2nccc(C(F)(F)F)n2)cc1	ZINC000853587767	GH	On-Demand	Anodyne	TRPV1	57	36
CCN1CC[C@H](N(CC)C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000853587769	DE	On-Demand	Anodyne	CCR5	51	61
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000853587771	DE	On-Demand	Anodyne	CCR5	51	61
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000853587773	DE	On-Demand	Anodyne	CCR5	51	61
CCN1CC[C@H](N(CC)C(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000853587774	DE	On-Demand	Anodyne	CCR5	51	61
CC(C)c1ccc2c(c1)CN(C(=O)NCc1ccc([C@H](C)O)cc1)CC2	ZINC000853587849	FI	On-Demand	Anodyne	MAPK1	38	45
CC(C)c1ccc2c(c1)CN(C(=O)NCc1ccc([C@@H](C)O)cc1)CC2	ZINC000853587851	FI	On-Demand	Anodyne	MAPK1	38	45
CON(C)CCNC(=O)NCCN1CCN(S(C)(=O)=O)CC1	ZINC000853587884	EA	On-Demand	Anodyne	DRD4	40	30
O=C(NCCS(=O)(=O)CC(F)(F)F)NCc1ccc(CO)c(F)c1	ZINC000853587891	FD	On-Demand	Anodyne	TRPV1	58	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(CO)c(F)c1	ZINC000853587914	GF	On-Demand	Anodyne	GPR119	34	42
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CCC(c2ccon2)CC1	ZINC000853587978	GD	On-Demand	Anodyne	DRD4	21	41
Cn1ncc2c(=O)n(CN3CCC[C@@H](C4CCC4)C3)nnc21	ZINC000853587981	DC	On-Demand	Anodyne	Q9M629_MAIZE	54	35
Cn1ncc2c(=O)n(CN3CCC[C@H](C4CCC4)C3)nnc21	ZINC000853587983	DC	On-Demand	Anodyne	Q9M629_MAIZE	54	35
C[C@H](O)c1ccc(CNC(=O)NCc2cnccc2C(F)(F)F)cc1	ZINC000853587987	FG	On-Demand	Anodyne	TRPV1	26	42
Cn1c(S)nnc1CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853587988	FC	On-Demand	Anodyne	NOS2	85	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CCCC2)[C@@H]1c1ccco1	ZINC000853587991	GH	On-Demand	Anodyne	NOS2	94	36
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CCCC2)[C@H]1c1ccco1	ZINC000853587998	GH	On-Demand	Anodyne	NOS2	94	36
CC(C)(CO)[C@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C1CC1	ZINC000853588004	ED	On-Demand	Anodyne	NOS2	99	36
O=C(NCc1ccnc(-n2ccnc2)c1)N(CCOCCO)C1CCC1	ZINC000853588005	FD	On-Demand	Anodyne	NOS2	101	38
COC[C@@H](CCNC(=O)NCc1ccnc(-n2ccnc2)c1)OC	ZINC000853588016	ED	On-Demand	Anodyne	NOS2	92	37
COc1cccc([C@]2(C)CCN(C(=O)NCc3ccc([C@H](C)O)cc3)C2)c1	ZINC000853588030	FH	On-Demand	Anodyne	DRD4	40	30
COc1cccc([C@]2(C)CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)C2)c1	ZINC000853588033	FH	On-Demand	Anodyne	DRD4	40	30
C[C@H](O)c1ccc(CNC(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)cc1	ZINC000853588041	GC	On-Demand	Anodyne	NAMPT	40	42
O=C1N(CN2CC[C@H]3COC[C@@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853588044	FF	On-Demand	Anodyne	RBP4	51	32
O=C1N(CN2CC[C@@H]3COC[C@@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853588047	FF	On-Demand	Anodyne	RBP4	51	32
O=C1N(CN2CC[C@H]3COC[C@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853588050	FF	On-Demand	Anodyne	RBP4	51	32
O=C1N(CN2CC[C@@H]3COC[C@H]3C2)CCN1c1ccccc1C(F)(F)F	ZINC000853588054	FF	On-Demand	Anodyne	RBP4	51	32
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C=CCC1	ZINC000853588112	CD	On-Demand	Anodyne	NOS2	102	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C=CCC1	ZINC000853588112	CD	On-Demand	Anodyne	NAMPT	15	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1C=CCC1	ZINC000853588114	CD	On-Demand	Anodyne	NOS2	102	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1C=CCC1	ZINC000853588114	CD	On-Demand	Anodyne	NAMPT	15	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853588120	FD	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853588136	FF	On-Demand	Anodyne	NOS2	108	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853588139	FF	On-Demand	Anodyne	NOS2	108	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853588142	FF	On-Demand	Anodyne	NOS2	108	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)cc1	ZINC000853588144	EG	On-Demand	Anodyne	CD22	43	31
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)cc1	ZINC000853588144	EG	On-Demand	Anodyne	EPHX2	34	43
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)cc1	ZINC000853588144	EG	On-Demand	Anodyne	PDS	52	36
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853588145	FF	On-Demand	Anodyne	NOS2	108	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H](OC1CCCC1)C(F)(F)F	ZINC000853588148	GF	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H](OC1CCCC1)C(F)(F)F	ZINC000853588151	GF	On-Demand	Anodyne	NOS2	98	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](Cn2ccnn2)C1	ZINC000853588166	FD	On-Demand	Anodyne	NOS2	103	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853588168	FD	On-Demand	Anodyne	NOS2	103	40
CO[C@]1(CO)CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853588183	EC	On-Demand	Anodyne	NOS2	105	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC([C@H]2CCCCO2)CC1	ZINC000853588185	FF	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853588187	FF	On-Demand	Anodyne	NOS2	107	41
COC[C@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C1CCOCC1	ZINC000853588210	FD	On-Demand	Anodyne	NOS2	104	38
COC[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C1CCOCC1	ZINC000853588212	FD	On-Demand	Anodyne	NOS2	104	38
C[C@H](O)c1ccc(CNC(=O)N(C)Cc2cnc[nH]2)cc1	ZINC000853588217	CD	On-Demand	Anodyne	TAAR1	25	41
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853588257	FD	On-Demand	Anodyne	SIGMAR1	54	45
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H]2COC[C@H]2C1	ZINC000853588258	FD	On-Demand	Anodyne	SIGMAR1	54	45
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853588259	FD	On-Demand	Anodyne	SIGMAR1	54	45
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853588260	FD	On-Demand	Anodyne	SIGMAR1	54	45
CS(=O)(=O)N1CCN(CCNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853588262	GC	On-Demand	Reactive	CACNA1H	26	44
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(CO)c(F)c3)C2)cc1	ZINC000853588292	FE	On-Demand	Clean	MCHR1	20	49
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853588367	ED	On-Demand	Anodyne	NOS2	105	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1COC2(CCC2)C1	ZINC000853588369	ED	On-Demand	Anodyne	NOS2	105	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853588371	FE	On-Demand	Anodyne	NOS2	103	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853588374	FE	On-Demand	Anodyne	NOS2	103	40
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CCC(c2ccon2)CC1	ZINC000853588376	GF	On-Demand	Anodyne	SIGMAR1	29	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853588387	ED	On-Demand	Anodyne	NOS2	103	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](O)C(F)(F)C1	ZINC000853588389	ED	On-Demand	Anodyne	NOS2	103	39
CC[C@@H](O)CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588390	CC	On-Demand	Anodyne	NOS2	95	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]([C@H]1CCCO1)C1(CO)CCC1	ZINC000853588403	GD	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]([C@@H]1CCCO1)C1(CO)CCC1	ZINC000853588405	GD	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]([C@H]1CCCO1)C1(CO)CCC1	ZINC000853588408	GD	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]([C@@H]1CCCO1)C1(CO)CCC1	ZINC000853588410	GD	On-Demand	Anodyne	NOS2	102	39
C[C@@H]1CC(CNC(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H](C)C1	ZINC000853588416	EG	On-Demand	Anodyne	NOS2	102	39
C[C@H]1CC(CNC(=O)NCc2ccnc(-n3ccnc3)c2)C[C@H](C)C1	ZINC000853588419	EG	On-Demand	Anodyne	NOS2	102	39
C[C@H]1C[C@@H](C)C[C@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853588422	EG	On-Demand	Anodyne	NOS2	102	39
C[C@@H](CCNC(=O)NCc1ccnc(-n2ccnc2)c1)N(C)C	ZINC000853588428	DD	On-Demand	Anodyne	NOS2	103	40
C[C@@H](CCNC(=O)NCc1ccnc(-n2ccnc2)c1)N(C)C	ZINC000853588428	DD	On-Demand	Anodyne	CYP26A1	44	31
Cn1ncc(C2CCC2)c1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588458	FE	On-Demand	Anodyne	NOS2	98	37
Cc1ccncc1CCNC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000853588480	DE	On-Demand	Anodyne	NAMPT	25	40
Cc1ccncc1CCNC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000853588483	DE	On-Demand	Anodyne	NAMPT	25	40
N#CC1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CCCCC1	ZINC000853588493	EF	On-Demand	Mild	NOS2	92	36
COc1ccc(-c2nn(CN3CC[C@@H]4COC[C@@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853588526	GF	On-Demand	Anodyne	HRH1	15	40
COc1ccc(-c2nn(CN3CC[C@@H]4COC[C@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853588530	GF	On-Demand	Anodyne	HRH1	15	40
C[C@H]1CCC[C@@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)O1	ZINC000853588533	EE	On-Demand	Anodyne	NOS2	103	39
COc1ccc(-c2nn(CN3CC[C@H]4COC[C@@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853588534	GF	On-Demand	Anodyne	HRH1	15	40
COc1ccc(-c2nn(CN3CC[C@H]4COC[C@H]4C3)c(=O)c3ccccc23)cc1	ZINC000853588537	GF	On-Demand	Anodyne	HRH1	15	40
C[C@H](O)c1ccc(CNC(=O)N2CCC3(CCc4ccccc4O3)CC2)cc1	ZINC000853588560	GH	On-Demand	Anodyne	NPSR1	26	40
C[C@H](O)c1ccc(CNC(=O)N2CCC3(CCc4ccccc4O3)CC2)cc1	ZINC000853588560	GH	On-Demand	Anodyne	SCD1	22	46
C[C@H](O)c1ccc(CNC(=O)N2CCC3(CCc4ccccc4O3)CC2)cc1	ZINC000853588560	GH	On-Demand	Anodyne	SCD	31	45
C[C@H](O)c1ccc(CNC(=O)N2CCC3(CCc4ccccc4O3)CC2)cc1	ZINC000853588560	GH	On-Demand	Anodyne	TRPM8	22	52
CC1(C)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC(C)(C)C1	ZINC000853588581	FH	On-Demand	Anodyne	NOS2	100	38
C[C@@H]1[C@@H](C(F)(F)F)OCCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588593	FE	On-Demand	Anodyne	NOS2	103	37
C[C@H]1[C@H](C(F)(F)F)OCCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588597	FE	On-Demand	Anodyne	NOS2	103	37
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)NCc1ccc(CO)c(F)c1	ZINC000853588609	GD	On-Demand	Reactive	TRPV1	18	42
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853588689	FD	On-Demand	Anodyne	DRD4	28	41
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853588689	FD	On-Demand	Anodyne	ACHE	30	44
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853588689	FD	On-Demand	Anodyne	SIGMAR1	54	43
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853588690	FD	On-Demand	Anodyne	DRD4	28	41
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853588690	FD	On-Demand	Anodyne	ACHE	30	44
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853588690	FD	On-Demand	Anodyne	SIGMAR1	54	43
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853588691	FD	On-Demand	Anodyne	DRD4	28	41
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853588691	FD	On-Demand	Anodyne	ACHE	30	44
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853588691	FD	On-Demand	Anodyne	SIGMAR1	54	43
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2COC[C@H]2C1	ZINC000853588692	FD	On-Demand	Anodyne	DRD4	28	41
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2COC[C@H]2C1	ZINC000853588692	FD	On-Demand	Anodyne	ACHE	30	44
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CC[C@H]2COC[C@H]2C1	ZINC000853588692	FD	On-Demand	Anodyne	SIGMAR1	54	43
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC[C@@H](C2CCC2)C1	ZINC000853588707	EE	On-Demand	Anodyne	CHRNA7	17	57
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC[C@H](C2CCC2)C1	ZINC000853588708	EE	On-Demand	Anodyne	CHRNA7	17	57
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC[C@H](C2CCC2)C1	ZINC000853588709	EE	On-Demand	Anodyne	CHRNA7	17	57
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC[C@@H](C2CCC2)C1	ZINC000853588710	EE	On-Demand	Anodyne	CHRNA7	17	57
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)cc1	ZINC000853588750	GG	On-Demand	Anodyne	ADAM17	27	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)cc1	ZINC000853588750	GG	On-Demand	Anodyne	SSTR3	37	51
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)cc1	ZINC000853588750	GG	On-Demand	Anodyne	CCR2	16	46
O=C1CC[C@@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)CC[C@@H]2N1	ZINC000853588784	FD	On-Demand	Anodyne	NOS2	103	40
O=C1CC[C@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)CC[C@@H]2N1	ZINC000853588786	FD	On-Demand	Anodyne	NOS2	103	40
O=C1CC[C@@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)CC[C@H]2N1	ZINC000853588789	FD	On-Demand	Anodyne	NOS2	103	40
O=C1CC[C@H]2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)CC[C@H]2N1	ZINC000853588791	FD	On-Demand	Anodyne	NOS2	103	40
O=C(NCCO[C@@H]1CC1(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000853588808	ED	On-Demand	Anodyne	NOS2	97	35
O=C(NCCO[C@H]1CC1(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000853588810	ED	On-Demand	Anodyne	NOS2	97	35
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588815	FF	On-Demand	Anodyne	NOS2	101	37
N#Cc1sccc1N1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000853588817	GE	On-Demand	Mild	NOS2	91	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588832	EF	On-Demand	Anodyne	NR3C2	21	43
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588832	EF	On-Demand	Anodyne	MME	42	34
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588832	EF	On-Demand	Anodyne	ANPEP	32	49
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588832	EF	On-Demand	Anodyne	CTSB	17	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588832	EF	On-Demand	Anodyne	AMP1_PLAFQ	42	37
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588834	EF	On-Demand	Anodyne	NR3C2	21	43
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588834	EF	On-Demand	Anodyne	MME	42	34
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588834	EF	On-Demand	Anodyne	ANPEP	32	49
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588834	EF	On-Demand	Anodyne	CTSB	17	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588834	EF	On-Demand	Anodyne	AMP1_PLAFQ	42	37
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588836	EF	On-Demand	Anodyne	NR3C2	21	43
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588836	EF	On-Demand	Anodyne	MME	42	34
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588836	EF	On-Demand	Anodyne	ANPEP	32	49
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588836	EF	On-Demand	Anodyne	CTSB	17	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)cc1	ZINC000853588836	EF	On-Demand	Anodyne	AMP1_PLAFQ	42	37
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588837	EF	On-Demand	Anodyne	NR3C2	21	43
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588837	EF	On-Demand	Anodyne	MME	42	34
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588837	EF	On-Demand	Anodyne	ANPEP	32	49
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588837	EF	On-Demand	Anodyne	CTSB	17	40
C[C@H](O)c1ccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)cc1	ZINC000853588837	EF	On-Demand	Anodyne	AMP1_PLAFQ	42	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(c2ccco2)CC1	ZINC000853588847	FF	On-Demand	Anodyne	NOS2	108	42
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1CCN(C2CCOCC2)CC1	ZINC000853588849	GD	On-Demand	Anodyne	NOS2	103	39
C[C@H](O)c1ccc(CNC(=O)NCC(F)(F)c2ccc(F)cc2)cc1	ZINC000853588855	FG	On-Demand	Anodyne	TRPV1	17	41
C[C@H](O)c1ccc(CNC(=O)NCC(F)(F)c2ccc(F)cc2)cc1	ZINC000853588855	FG	On-Demand	Anodyne	CCR2	20	40
CCC(C)(C)[C@@H](C)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588856	DF	On-Demand	Anodyne	NOS2	93	36
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(CC3CC3)CC2)cc1	ZINC000853588865	EF	On-Demand	Anodyne	HTR4	56	41
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(CC3CC3)CC2)cc1	ZINC000853588865	EF	On-Demand	Anodyne	CCR3	37	41
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(CC3CC3)CC2)cc1	ZINC000853588865	EF	On-Demand	Anodyne	CACNA1I	67	42
COc1ccc(N2CC[C@H](NC(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000853588870	GE	On-Demand	Clean	NOS2	104	46
COCCN(CCF)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588874	DD	On-Demand	Anodyne	NOS2	94	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@]1(OCCO)CCOC1	ZINC000853588876	FC	On-Demand	Anodyne	NOS2	99	37
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@]1(OCCO)CCOC1	ZINC000853588878	FC	On-Demand	Anodyne	NOS2	99	37
O=C1CCC2=C(CCN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)N1	ZINC000853588887	FD	On-Demand	Anodyne	NOS2	90	37
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2CS(C)(=O)=O)cc1	ZINC000853588913	ED	On-Demand	Anodyne	F2	20	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2CS(C)(=O)=O)cc1	ZINC000853588913	ED	On-Demand	Anodyne	TMPRSS11D	54	36
N#C[C@H]1CCCC[C@@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588914	DE	On-Demand	Mild	NOS2	98	39
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588916	DE	On-Demand	Mild	NOS2	98	39
N#C[C@H]1CCCC[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588918	DE	On-Demand	Mild	NOS2	98	39
N#C[C@@H]1CCCC[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853588920	DE	On-Demand	Mild	NOS2	98	39
C[C@H](O)c1ccc(CNC(=O)N2CCN([C@@H]3CCOC3)CC2)cc1	ZINC000853588946	ED	On-Demand	Anodyne	NAMPT	22	44
C[C@H](O)c1ccc(CNC(=O)N2CCN([C@H]3CCOC3)CC2)cc1	ZINC000853588948	ED	On-Demand	Anodyne	NAMPT	22	44
C=CCCC1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CCCC1	ZINC000853588951	FH	On-Demand	Mild	NOS2	91	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853588954	GF	On-Demand	Anodyne	NOS2	109	45
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853588954	GF	On-Demand	Anodyne	EPHX2	15	40
C[C@H]1CC[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)CS1(=O)=O	ZINC000853588956	FD	On-Demand	Anodyne	NOS2	97	36
C[C@H]1CC[C@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)CS1(=O)=O	ZINC000853588958	FD	On-Demand	Anodyne	NOS2	97	36
C[C@H](O)c1ccc(CNC(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)cc1	ZINC000853588978	GH	On-Demand	Anodyne	CACNA1I	42	33
C[C@H](O)c1ccc(CNC(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)cc1	ZINC000853588980	GH	On-Demand	Anodyne	CACNA1I	42	33
CON(C)CCNC(=O)NC1CCN(C(=O)CC(C)C)CC1	ZINC000853589130	DC	On-Demand	Anodyne	EPHX2	27	49
C[C@H](O)c1ccc(CNC(=O)N2CCC(N3CC[C@@H](O)C3)CC2)cc1	ZINC000853589141	ED	On-Demand	Anodyne	L3MBTL3	45	33
C[C@H](O)c1ccc(CNC(=O)N2CCC(N3CC[C@H](O)C3)CC2)cc1	ZINC000853589143	ED	On-Demand	Anodyne	L3MBTL3	45	33
C[C@H](O)c1ccc(CNC(=O)N(C)CC(=O)N2CCCC2)cc1	ZINC000853589150	DD	On-Demand	Anodyne	DPP7	44	36
C[C@@H]1CC[C@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)CS1(=O)=O	ZINC000853589166	FD	On-Demand	Anodyne	NOS2	97	36
C=CCN(C(=O)NCc1ccnc(-n2ccnc2)c1)[C@@H](C)COC	ZINC000853589176	ED	On-Demand	Mild	NOS2	94	37
C=CCN(C(=O)NCc1ccnc(-n2ccnc2)c1)[C@H](C)COC	ZINC000853589178	ED	On-Demand	Mild	NOS2	94	37
C[C@H](O)c1ccc(CNC(=O)N2CCc3nccnc3C2)cc1	ZINC000853589183	DD	On-Demand	Anodyne	MAPK1	48	50
C[C@H](O)c1ccc(CNC(=O)N2CCc3nccnc3C2)cc1	ZINC000853589183	DD	On-Demand	Anodyne	NAMPT	25	44
CS(=O)(=O)C1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CCCCC1	ZINC000853589211	GD	On-Demand	Anodyne	NOS2	97	37
CS(=O)(=O)C1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CCCCC1	ZINC000853589211	GD	On-Demand	Anodyne	NAMPT	19	41
COc1cc2c(cc1OC)N(CN1CCC[C@H](C3CCC3)C1)C(=O)C2=O	ZINC000853589217	FF	On-Demand	Anodyne	CASP3	44	35
COc1cc2c(cc1OC)N(CN1CCC[C@H](C3CCC3)C1)C(=O)C2=O	ZINC000853589217	FF	On-Demand	Anodyne	CASP7	62	35
COc1cc2c(cc1OC)N(CN1CCC[C@@H](C3CCC3)C1)C(=O)C2=O	ZINC000853589220	FF	On-Demand	Anodyne	CASP3	44	35
COc1cc2c(cc1OC)N(CN1CCC[C@@H](C3CCC3)C1)C(=O)C2=O	ZINC000853589220	FF	On-Demand	Anodyne	CASP7	62	35
O=C(NCCS(=O)(=O)CC(F)(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000853589224	GD	On-Demand	Anodyne	NOS2	82	34
O=C(NCCS(=O)(=O)CC(F)(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000853589224	GD	On-Demand	Anodyne	NAMPT	15	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853589228	FD	On-Demand	Anodyne	NOS2	115	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853589231	FD	On-Demand	Anodyne	NOS2	115	44
Cn1ccnc1[C@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C(C)(C)CO	ZINC000853589233	GD	On-Demand	Anodyne	NOS2	63	33
Cn1ccnc1[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C(C)(C)CO	ZINC000853589235	GD	On-Demand	Anodyne	NOS2	63	33
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853589237	FC	On-Demand	Anodyne	NOS2	100	36
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCC[C@H]2C[C@H]21	ZINC000853589239	EF	On-Demand	Anodyne	NOS2	103	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCC[C@H]2C[C@@H]21	ZINC000853589241	EF	On-Demand	Anodyne	NOS2	103	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCC[C@@H]2C[C@@H]12	ZINC000853589243	EF	On-Demand	Anodyne	NOS2	103	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCC[C@@H]2C[C@H]12	ZINC000853589245	EF	On-Demand	Anodyne	NOS2	103	41
C[C@H](O)c1ccc(CNC(=O)N2CCc3nnc(N4CCCC4)cc3C2)cc1	ZINC000853589263	GE	On-Demand	Anodyne	MAPK1	31	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](C2CCCCC2)C1	ZINC000853589267	FG	On-Demand	Anodyne	NOS2	110	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H](C2CCCCC2)C1	ZINC000853589270	FG	On-Demand	Anodyne	NOS2	110	42
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853589278	ED	On-Demand	Anodyne	NPSR1	26	40
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853589281	ED	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@](O)(C2CC2)C1	ZINC000853589293	ED	On-Demand	Anodyne	NOS2	106	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853589295	ED	On-Demand	Anodyne	NOS2	106	40
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)cc1	ZINC000853589331	GF	On-Demand	Anodyne	ACHE	28	44
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)cc1	ZINC000853589331	GF	On-Demand	Anodyne	HTR4	53	46
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)cc1	ZINC000853589331	GF	On-Demand	Anodyne	SIGMAR1	27	42
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)cc1	ZINC000853589331	GF	On-Demand	Anodyne	CCR3	35	42
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)cc1	ZINC000853589331	GF	On-Demand	Anodyne	MCHR1	31	42
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)cc1	ZINC000853589331	GF	On-Demand	Anodyne	CACNA1I	68	44
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc([C@@H](C)O)cc3)C2)cc1	ZINC000853589344	FF	On-Demand	Clean	MCHR1	17	49
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc([C@H](C)O)cc3)C2)cc1	ZINC000853589346	FF	On-Demand	Clean	MCHR1	17	49
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H](C)C1O	ZINC000853589347	ED	On-Demand	Anodyne	NOS2	108	42
O=C(NCc1ccnc(-n2ccnc2)c1)NC1CCC2(CC1)CC2(F)F	ZINC000853589357	FG	On-Demand	Anodyne	NOS2	103	38
C[C@H]1CC[C@@](C)(CNC(=O)NCc2ccnc(-n3ccnc3)c2)C1(C)C	ZINC000853589360	FH	On-Demand	Anodyne	NOS2	108	40
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853589376	DC	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853589377	DC	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@H]2COC[C@H]2C1	ZINC000853589380	DC	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853589382	DC	On-Demand	Anodyne	CHRNA7	17	56
O=C(NCc1ccnc(-n2ccnc2)c1)NCc1cccnc1N1CCCC1	ZINC000853589388	GE	On-Demand	Anodyne	SCN2A	19	45
O=C(NCc1ccnc(-n2ccnc2)c1)NCc1cccnc1N1CCCC1	ZINC000853589388	GE	On-Demand	Anodyne	NOS2	106	40
O=C(NCc1ccnc(-n2ccnc2)c1)NCc1cccnc1N1CCCC1	ZINC000853589388	GE	On-Demand	Anodyne	SCN10A	20	45
O=C(NCc1ccnc(-n2ccnc2)c1)NCc1cccnc1N1CCCC1	ZINC000853589388	GE	On-Demand	Anodyne	NAMPT	25	42
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853589393	GE	On-Demand	Anodyne	OPRK1	22	41
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853589393	GE	On-Demand	Anodyne	SIGMAR1	23	43
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853589393	GE	On-Demand	Anodyne	CCR3	27	41
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853589393	GE	On-Demand	Anodyne	CCR5	17	40
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853589393	GE	On-Demand	Anodyne	MCHR1	31	44
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853589399	GE	On-Demand	Anodyne	OPRK1	22	41
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853589399	GE	On-Demand	Anodyne	SIGMAR1	23	43
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853589399	GE	On-Demand	Anodyne	CCR3	27	41
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853589399	GE	On-Demand	Anodyne	CCR5	17	40
C[C@H](O)c1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853589399	GE	On-Demand	Anodyne	MCHR1	31	44
CS(=O)(=O)N1CCN(CCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853589460	GC	On-Demand	Anodyne	DRD4	41	31
CS(=O)(=O)N1CCN(CCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853589460	GC	On-Demand	Anodyne	HTR4	26	41
CS(=O)(=O)N1CCN(CCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853589461	GC	On-Demand	Anodyne	DRD4	41	31
CS(=O)(=O)N1CCN(CCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853589461	GC	On-Demand	Anodyne	HTR4	26	41
CS(=O)(=O)N1CCN(CCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853589462	GC	On-Demand	Anodyne	DRD4	41	31
CS(=O)(=O)N1CCN(CCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853589462	GC	On-Demand	Anodyne	HTR4	26	41
CS(=O)(=O)N1CCN(CCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853589463	GC	On-Demand	Anodyne	DRD4	41	31
CS(=O)(=O)N1CCN(CCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853589463	GC	On-Demand	Anodyne	HTR4	26	41
CCC(CC)CCCN(C)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853589509	EG	On-Demand	Anodyne	CHRNA7	17	58
CCC(CC)CCCN(C)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853589510	EG	On-Demand	Anodyne	CHRNA7	17	58
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NCc2ccc(CO)c(F)c2)C3)cn1	ZINC000853589528	GD	On-Demand	Anodyne	MAPK1	31	42
CCC1(CC)CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853589568	EG	On-Demand	Anodyne	NOS2	101	38
CC[C@@H](C)CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589588	DF	On-Demand	Anodyne	NOS2	99	37
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1C[C@H](c2ccccc2)CO1	ZINC000853589592	GF	On-Demand	Anodyne	NOS2	100	39
Cn1ncc(C2CC2)c1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589611	FD	On-Demand	Anodyne	NOS2	98	36
C=CCOCCCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589613	DD	On-Demand	Mild	NOS2	95	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853589625	DC	On-Demand	Anodyne	NOS2	111	45
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000853589633	EF	On-Demand	Anodyne	ANPEP	18	42
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000853589633	EF	On-Demand	Anodyne	SOAT1	25	40
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000853589636	EF	On-Demand	Anodyne	ANPEP	18	42
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)[C@H](C)c2ccccc2)cc1	ZINC000853589636	EF	On-Demand	Anodyne	SOAT1	25	40
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000853589639	EF	On-Demand	Anodyne	ANPEP	18	42
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)[C@@H](C)c2ccccc2)cc1	ZINC000853589639	EF	On-Demand	Anodyne	SOAT1	25	40
O=C1N(Cc2cccnc2)CCN1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853589640	DD	On-Demand	Anodyne	CHRNA7	45	36
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000853589642	EF	On-Demand	Anodyne	ANPEP	18	42
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)[C@H](C)c2ccccc2)cc1	ZINC000853589642	EF	On-Demand	Anodyne	SOAT1	25	40
O=C1N(Cc2cccnc2)CCN1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853589643	DD	On-Demand	Anodyne	CHRNA7	45	36
O=C1N(Cc2cccnc2)CCN1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853589646	DD	On-Demand	Anodyne	CHRNA7	45	36
O=C1N(Cc2cccnc2)CCN1CN1CC[C@H]2COC[C@H]2C1	ZINC000853589649	DD	On-Demand	Anodyne	CHRNA7	45	36
C=CC[C@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853589660	EF	On-Demand	Mild	NOS2	106	40
C=CC[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853589662	EF	On-Demand	Mild	NOS2	106	40
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)COc2c(F)cccc2F)cc1	ZINC000853589667	FG	On-Demand	Anodyne	ANPEP	17	41
C[C@H](O)c1ccc(CNC(=O)N[C@H](C)COc2c(F)cccc2F)cc1	ZINC000853589667	FG	On-Demand	Anodyne	PDS	54	35
COc1ccc([C@@H]2CCCN2C(=O)NCc2ccnc(-n3ccnc3)c2)cc1F	ZINC000853589682	GG	On-Demand	Anodyne	NOS2	100	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(n2cnnc2O)CC1	ZINC000853589696	FD	On-Demand	Anodyne	NOS2	102	39
COC[C@@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589700	FF	On-Demand	Anodyne	ANPEP	20	49
COC[C@@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589700	FF	On-Demand	Anodyne	MTNR1A	29	40
COC[C@@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589700	FF	On-Demand	Anodyne	MTNR1B	31	40
COC[C@@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589700	FF	On-Demand	Anodyne	SOAT1	15	40
COC[C@@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589700	FF	On-Demand	Anodyne	PDS	57	41
COC[C@@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589702	FF	On-Demand	Anodyne	ANPEP	20	49
COC[C@@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589702	FF	On-Demand	Anodyne	MTNR1A	29	40
COC[C@@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589702	FF	On-Demand	Anodyne	MTNR1B	31	40
COC[C@@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589702	FF	On-Demand	Anodyne	SOAT1	15	40
COC[C@@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589702	FF	On-Demand	Anodyne	PDS	57	41
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](c1cccs1)C1(CO)CCC1	ZINC000853589703	GG	On-Demand	Anodyne	NOS2	91	37
COC[C@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589705	FF	On-Demand	Anodyne	ANPEP	20	49
COC[C@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589705	FF	On-Demand	Anodyne	MTNR1A	29	40
COC[C@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589705	FF	On-Demand	Anodyne	MTNR1B	31	40
COC[C@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589705	FF	On-Demand	Anodyne	SOAT1	15	40
COC[C@H](NC(=O)NCc1ccc([C@@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589705	FF	On-Demand	Anodyne	PDS	57	41
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](c1cccs1)C1(CO)CCC1	ZINC000853589706	GG	On-Demand	Anodyne	NOS2	91	37
COC[C@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589707	FF	On-Demand	Anodyne	ANPEP	20	49
COC[C@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589707	FF	On-Demand	Anodyne	MTNR1A	29	40
COC[C@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589707	FF	On-Demand	Anodyne	MTNR1B	31	40
COC[C@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589707	FF	On-Demand	Anodyne	SOAT1	15	40
COC[C@H](NC(=O)NCc1ccc([C@H](C)O)cc1)c1cccc(OC)c1	ZINC000853589707	FF	On-Demand	Anodyne	PDS	57	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000853589710	FG	On-Demand	Anodyne	SLC6A3	19	45
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000853589710	FG	On-Demand	Anodyne	CCR5	40	39
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589714	ED	On-Demand	Anodyne	NOS2	106	40
CCN1CC[C@H](N(CC)C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853589727	ED	On-Demand	Anodyne	NOS2	109	39
CCN1CC[C@@H](N(CC)C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853589728	ED	On-Demand	Anodyne	NOS2	109	39
CS(=O)(=O)C1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853589729	EC	On-Demand	Anodyne	NOS2	113	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(C2CCC2)CC1	ZINC000853589735	EF	On-Demand	Anodyne	NOS2	111	42
C[C@H]1c2ccccc2C[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589749	EF	On-Demand	Anodyne	NOS2	101	36
Cc1cc(F)ccc1C[C@H](C)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589774	FG	On-Demand	Anodyne	NOS2	98	35
C[C@H](O)c1ccc(CNC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853589794	FD	On-Demand	Anodyne	CASR	56	39
COC(=O)c1cccc(NNC(=O)NC2CCN(C(=O)CC(C)C)CC2)c1C	ZINC000853589834	GE	On-Demand	Reactive	EPHX2	31	47
COC(=O)c1cccc(NNC(=O)NC2CCN(C(=O)CC(C)C)CC2)c1C	ZINC000853589834	GE	On-Demand	Reactive	CCR8	68	35
Cc1cc(F)ccc1C[C@@H](C)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589842	FG	On-Demand	Anodyne	NOS2	98	35
O=C1CC[C@@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)N1	ZINC000853589845	DC	On-Demand	Anodyne	NOS2	99	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccccc1CO	ZINC000853589853	FE	On-Demand	Clean	EPHX2	15	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccccc1CO	ZINC000853589853	FE	On-Demand	Clean	STAT6	16	40
CCC(CC)CCCN(C)Cn1nnc2c(cnn2C)c1=O	ZINC000853589860	DD	On-Demand	Anodyne	Q9M629_MAIZE	58	36
C[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)[C@@H]1CCO	ZINC000853589945	ED	On-Demand	Anodyne	NOS2	103	40
C[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)[C@H]1CCO	ZINC000853589950	ED	On-Demand	Anodyne	NOS2	103	40
COC(=O)c1ccc(CNC(=O)NCc2ccc([C@@H](C)O)cc2)c(F)c1	ZINC000853589955	FF	On-Demand	Anodyne	TRPV1	86	36
COC(=O)c1ccc(CNC(=O)NCc2ccc([C@@H](C)O)cc2)c(F)c1	ZINC000853589955	FF	On-Demand	Anodyne	BDKRB1	26	43
COC(=O)c1ccc(CNC(=O)NCc2ccc([C@H](C)O)cc2)c(F)c1	ZINC000853589957	FF	On-Demand	Anodyne	TRPV1	86	36
COC(=O)c1ccc(CNC(=O)NCc2ccc([C@H](C)O)cc2)c(F)c1	ZINC000853589957	FF	On-Demand	Anodyne	BDKRB1	26	43
O=C(NCC[S@@](=O)CC(F)(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000853589961	GD	On-Demand	Anodyne	NOS2	78	32
O=C(NCC[S@](=O)CC(F)(F)F)NCc1ccnc(-n2ccnc2)c1	ZINC000853589962	GD	On-Demand	Anodyne	NOS2	78	32
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853589978	ED	On-Demand	Anodyne	NOS2	90	35
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853589980	ED	On-Demand	Anodyne	NOS2	90	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](CCF)C1	ZINC000853589982	EF	On-Demand	Anodyne	NOS2	108	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](CCF)C1	ZINC000853589984	EF	On-Demand	Anodyne	NOS2	108	41
CN(CC1=CCCOC1)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853589986	ED	On-Demand	Anodyne	NOS2	100	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](CO)C1CCC1	ZINC000853589994	DD	On-Demand	Anodyne	NOS2	100	39
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)cc1	ZINC000853589995	CD	On-Demand	Anodyne	PREP	23	43
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)cc1	ZINC000853589995	CD	On-Demand	Anodyne	TMPRSS11D	57	36
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](CO)C1CCC1	ZINC000853589996	DD	On-Demand	Anodyne	NOS2	100	39
CC(C)(C)N1CC[C@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853589998	ED	On-Demand	Anodyne	NOS2	109	40
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)cc1	ZINC000853589999	CD	On-Demand	Anodyne	PREP	23	43
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)cc1	ZINC000853589999	CD	On-Demand	Anodyne	TMPRSS11D	57	36
CC(C)(C)N1CC[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853590000	ED	On-Demand	Anodyne	NOS2	109	40
O=C1C(=O)N(CN2CCC[C@H](C3CCC3)C2)c2ccccc21	ZINC000853590010	CF	On-Demand	Anodyne	ALDH1A1	62	44
O=C1C(=O)N(CN2CCC[C@H](C3CCC3)C2)c2ccccc21	ZINC000853590010	CF	On-Demand	Anodyne	ALDH3A1	45	54
O=C1C(=O)N(CN2CCC[C@H](C3CCC3)C2)c2ccccc21	ZINC000853590010	CF	On-Demand	Anodyne	CES1	17	45
O=C1C(=O)N(CN2CCC[C@H](C3CCC3)C2)c2ccccc21	ZINC000853590010	CF	On-Demand	Anodyne	CASP7	53	35
O=C1C(=O)N(CN2CCC[C@@H](C3CCC3)C2)c2ccccc21	ZINC000853590012	CF	On-Demand	Anodyne	ALDH1A1	62	44
O=C1C(=O)N(CN2CCC[C@@H](C3CCC3)C2)c2ccccc21	ZINC000853590012	CF	On-Demand	Anodyne	ALDH3A1	45	54
O=C1C(=O)N(CN2CCC[C@@H](C3CCC3)C2)c2ccccc21	ZINC000853590012	CF	On-Demand	Anodyne	CES1	17	45
O=C1C(=O)N(CN2CCC[C@@H](C3CCC3)C2)c2ccccc21	ZINC000853590012	CF	On-Demand	Anodyne	CASP7	53	35
O=C(NCCCc1nc[nH]n1)NCc1ccnc(-n2ccnc2)c1	ZINC000853590014	EC	On-Demand	Anodyne	NOS2	83	34
COc1cccc(OC)c1CNC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000853590021	EF	On-Demand	Anodyne	ADRB2	19	41
COc1cccc(OC)c1CNC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000853590021	EF	On-Demand	Anodyne	ANPEP	17	41
COc1cccc(OC)c1CNC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000853590021	EF	On-Demand	Anodyne	TRPV1	16	42
COc1cccc(OC)c1CNC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000853590023	EF	On-Demand	Anodyne	ADRB2	19	41
COc1cccc(OC)c1CNC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000853590023	EF	On-Demand	Anodyne	ANPEP	17	41
COc1cccc(OC)c1CNC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000853590023	EF	On-Demand	Anodyne	TRPV1	16	42
O=C(NCc1ccnc(-n2ccnc2)c1)NCc1cccc(OC2CC2)c1F	ZINC000853590035	GF	On-Demand	Anodyne	NOS2	102	38
CON(C)CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853590076	DC	On-Demand	Anodyne	NOS2	100	37
CCO[C@@H]1C[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853590105	DD	On-Demand	Anodyne	NOS2	100	38
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC(c2ccon2)CC1	ZINC000853590108	ED	On-Demand	Anodyne	CHRNA7	19	43
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC(c2ccon2)CC1	ZINC000853590111	ED	On-Demand	Anodyne	CHRNA7	19	43
N#CC[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853590116	DE	On-Demand	Mild	NOS2	110	42
N#CC[C@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853590118	DE	On-Demand	Mild	NOS2	110	42
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCN1S(C)(=O)=O	ZINC000853590134	GC	On-Demand	Anodyne	NOS2	108	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCn2c(O)nnc2C1	ZINC000853590145	EC	On-Demand	Anodyne	NOS2	94	40
CCn1c(O)nnc1C1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000853590152	GD	On-Demand	Anodyne	NOS2	100	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC2(CCCC2)CC1	ZINC000853590178	FH	On-Demand	Anodyne	NOS2	106	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCC1CCN(CCC)CC1	ZINC000853590242	FE	On-Demand	Mild	CACNA1I	50	36
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1	ZINC000853590256	GG	On-Demand	Anodyne	GPR119	25	40
C[C@H](O)c1ccc(CNC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000853590357	GI	On-Demand	Anodyne	PDS	57	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN([C@H]2CCOC2)CC1	ZINC000853590365	FC	On-Demand	Anodyne	NOS2	108	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN([C@H]2CCOC2)CC1	ZINC000853590365	FC	On-Demand	Anodyne	NAMPT	20	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN([C@@H]2CCOC2)CC1	ZINC000853590368	FC	On-Demand	Anodyne	NOS2	108	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCN([C@@H]2CCOC2)CC1	ZINC000853590368	FC	On-Demand	Anodyne	NAMPT	20	43
COCC1(NC(=O)NCc2ccnc(-n3ccnc3)c2)CCCC1	ZINC000853590387	EE	On-Demand	Anodyne	NOS2	106	42
C[C@@]1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1(F)F	ZINC000853590444	DE	On-Demand	Anodyne	NOS2	99	36
C[C@@]12COC[C@H]1CN(C(=O)NCc1ccnc(-n3ccnc3)c1)C2	ZINC000853590452	ED	On-Demand	Anodyne	NOS2	109	42
C#CCCN(CCOC)C(=O)NCC1CCN(CCC)CC1	ZINC000853590454	DD	On-Demand	Mild	CACNA1I	47	35
C[C@@]12COC[C@@H]1CN(C(=O)NCc1ccnc(-n3ccnc3)c1)C2	ZINC000853590456	ED	On-Demand	Anodyne	NOS2	109	42
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@@H](Oc2ccccc2)C1	ZINC000853590481	FF	On-Demand	Anodyne	NOS2	96	38
CN(C[C@@H]1COCCO1)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853590490	EC	On-Demand	Anodyne	NOS2	104	44
CO[C@]1(CO)CCCN(C(=O)NCc2ccc(CO)c(F)c2)C1	ZINC000853590503	ED	On-Demand	Anodyne	EPHX2	15	44
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1	ZINC000853590511	FE	On-Demand	Anodyne	L3MBTL3	91	39
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1	ZINC000853590511	FE	On-Demand	Anodyne	NAMPT	21	41
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1	ZINC000853590514	FE	On-Demand	Anodyne	L3MBTL3	91	39
C[C@H](O)c1ccc(CNC(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1	ZINC000853590514	FE	On-Demand	Anodyne	NAMPT	21	41
COc1ccc(N2CC[C@H](NC(=O)NCc3ccccc3CO)C2)cc1	ZINC000853590528	FE	On-Demand	Clean	SIGMAR1	15	43
COc1ccc(N2CC[C@H](NC(=O)NCc3ccccc3CO)C2)cc1	ZINC000853590528	FE	On-Demand	Clean	MTNR1A	24	48
COc1ccc(N2CC[C@H](NC(=O)NCc3ccccc3CO)C2)cc1	ZINC000853590528	FE	On-Demand	Clean	MTNR1B	19	48
COc1ccc(N2CC[C@H](NC(=O)NCc3ccccc3CO)C2)cc1	ZINC000853590528	FE	On-Demand	Clean	EPHX2	21	41
COc1ccc(N2CC[C@H](NC(=O)NCc3ccccc3CO)C2)cc1	ZINC000853590528	FE	On-Demand	Clean	MCHR1	16	46
C[C@@H]1CN(CCNC(=O)NCc2ccnc(-n3ccnc3)c2)[C@H](C)CO1	ZINC000853590544	FD	On-Demand	Anodyne	NOS2	101	38
COc1cccc([C@]2(C)CCN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)c1	ZINC000853590558	GG	On-Demand	Anodyne	NOS2	83	39
CC(C)(C)N1CC[C@H]1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853590577	ED	On-Demand	Anodyne	NOS2	107	39
CC(C)(C)N1CC[C@@H]1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853590580	ED	On-Demand	Anodyne	NOS2	107	39
S=c1n(Cc2ccccc2)ccn1CN1CC[C@H]2COC[C@H]2C1	ZINC000853590705	EF	On-Demand	Anodyne	SIGMAR1	41	39
S=c1n(Cc2ccccc2)ccn1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853590706	EF	On-Demand	Anodyne	SIGMAR1	41	39
S=c1n(Cc2ccccc2)ccn1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853590707	EF	On-Demand	Anodyne	SIGMAR1	41	39
S=c1n(Cc2ccccc2)ccn1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853590708	EF	On-Demand	Anodyne	SIGMAR1	41	39
COc1cccc(C2(NC(=O)NCc3ccc([C@H](C)O)cc3)CCC2)c1	ZINC000853590713	FH	On-Demand	Anodyne	SOAT1	17	40
COc1cccc(C2(NC(=O)NCc3ccc([C@@H](C)O)cc3)CCC2)c1	ZINC000853590714	FH	On-Demand	Anodyne	SOAT1	17	40
Fc1cccc(Cc2nn(CN3CC[C@H]4COC[C@@H]4C3)c(=S)o2)c1	ZINC000853590719	EF	On-Demand	Anodyne	CCR5	50	34
Fc1cccc(Cc2nn(CN3CC[C@@H]4COC[C@@H]4C3)c(=S)o2)c1	ZINC000853590720	EF	On-Demand	Anodyne	CCR5	50	34
Fc1cccc(Cc2nn(CN3CC[C@H]4COC[C@H]4C3)c(=S)o2)c1	ZINC000853590721	EF	On-Demand	Anodyne	CCR5	50	34
Fc1cccc(Cc2nn(CN3CC[C@@H]4COC[C@H]4C3)c(=S)o2)c1	ZINC000853590722	EF	On-Demand	Anodyne	CCR5	50	34
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCc3ccccc3-n3ccnc32)cc1	ZINC000853590729	GG	On-Demand	Anodyne	NPY1R	29	40
C[C@H](O)c1ccc(CNC(=O)N[C@H]2CCc3ccccc3-n3ccnc32)cc1	ZINC000853590730	GG	On-Demand	Anodyne	NPY1R	29	40
CNC(=O)c1nn(CN2CCC[C@H](C3CCC3)C2)c(=O)c2ccccc12	ZINC000853590776	FE	On-Demand	Anodyne	HRH1	43	42
CNC(=O)c1nn(CN2CCC[C@@H](C3CCC3)C2)c(=O)c2ccccc12	ZINC000853590778	FE	On-Demand	Anodyne	HRH1	43	42
C[C@H](O)c1ccc(CNC(=O)NCc2cccnc2N2CCCC2)cc1	ZINC000853590811	FF	On-Demand	Anodyne	KCNQ2	50	33
C[C@H](O)c1ccc(CNC(=O)NCc2cccnc2N2CCCC2)cc1	ZINC000853590811	FF	On-Demand	Anodyne	TRPV1	38	41
C[C@H](O)c1ccc(CNC(=O)NCc2cccnc2N2CCCC2)cc1	ZINC000853590811	FF	On-Demand	Anodyne	SCN2A	18	45
C[C@H](O)c1ccc(CNC(=O)NCc2cccnc2N2CCCC2)cc1	ZINC000853590811	FF	On-Demand	Anodyne	SCN10A	20	45
C[C@H](O)c1ccc(CNC(=O)NCc2cccnc2N2CCCC2)cc1	ZINC000853590811	FF	On-Demand	Anodyne	NAMPT	27	41
O=C(NCc1ccc(CO)c(F)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853590815	ED	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccc(CO)c(F)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853590818	ED	On-Demand	Anodyne	NPSR1	26	40
Cc1nn(C)cc1[C@@H]1OCC[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853590830	GD	On-Demand	Anodyne	NOS2	102	37
CC(C)c1ccc2c(c1)CN(C(=O)NCc1ccnc(-n3ccnc3)c1)CC2	ZINC000853590837	GH	On-Demand	Anodyne	NOS2	98	38
CC(C)c1ccc2c(c1)CN(C(=O)NCc1ccnc(-n3ccnc3)c1)CC2	ZINC000853590837	GH	On-Demand	Anodyne	MAPK1	32	40
O=C(NCCCC1CCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000853590886	DF	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CCOCC2)[C@@H]1c1ccco1	ZINC000853590949	GF	On-Demand	Anodyne	NOS2	89	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CCOCC2)[C@H]1c1ccco1	ZINC000853590951	GF	On-Demand	Anodyne	NOS2	89	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853590965	DE	On-Demand	Anodyne	NOS2	106	41
O=C1N[C@]2(CCCN(Cc3ccccc3)C2)C(=O)N1CN1CC[C@@H]2COC[C@@H]2C1	ZINC000853591028	GD	On-Demand	Anodyne	SIGMAR1	34	40
O=C1N[C@]2(CCCN(Cc3ccccc3)C2)C(=O)N1CN1CC[C@H]2COC[C@@H]2C1	ZINC000853591030	GD	On-Demand	Anodyne	SIGMAR1	34	40
O=C1N[C@]2(CCCN(Cc3ccccc3)C2)C(=O)N1CN1CC[C@H]2COC[C@H]2C1	ZINC000853591033	GD	On-Demand	Anodyne	SIGMAR1	34	40
O=C1N[C@]2(CCCN(Cc3ccccc3)C2)C(=O)N1CN1CC[C@@H]2COC[C@H]2C1	ZINC000853591036	GD	On-Demand	Anodyne	SIGMAR1	34	40
C[C@H](O)c1ccc(CNC(=O)NC[C@H]2CN(C)CCN2Cc2ccccc2)cc1	ZINC000853591059	GE	On-Demand	Anodyne	SIGMAR1	15	46
C[C@H](O)c1ccc(CNC(=O)NC[C@@H]2CN(C)CCN2Cc2ccccc2)cc1	ZINC000853591064	GE	On-Demand	Anodyne	SIGMAR1	15	46
C[C@H](O)c1ccc(CNC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853591111	FF	On-Demand	Anodyne	TRPV1	20	42
C[C@H](O)c1ccc(CNC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853591112	FF	On-Demand	Anodyne	TRPV1	20	42
COC(=O)N(C)CCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591153	EC	On-Demand	Anodyne	NOS2	98	36
COC[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)c1cccc(OC)c1	ZINC000853591170	GE	On-Demand	Anodyne	NOS2	88	40
COC[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)c1cccc(OC)c1	ZINC000853591170	GE	On-Demand	Anodyne	ROCK2	19	42
COC[C@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)c1cccc(OC)c1	ZINC000853591171	GE	On-Demand	Anodyne	NOS2	88	40
COC[C@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)c1cccc(OC)c1	ZINC000853591171	GE	On-Demand	Anodyne	ROCK2	19	42
O=C(NCCc1nnc(S)n1C1CC1)NCc1ccnc(-n2ccnc2)c1	ZINC000853591172	GD	On-Demand	Anodyne	NOS2	94	35
C=CCCSCCNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591175	EE	On-Demand	Mild	NOS2	81	32
CS(=O)(=O)CC1(CCNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000853591177	GD	On-Demand	Anodyne	NOS2	95	37
CC[C@H](C)N(CC)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591181	DF	On-Demand	Anodyne	NOS2	103	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1CCCC12CCCCC2	ZINC000853591184	FH	On-Demand	Anodyne	NOS2	99	39
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1CCCC12CCCCC2	ZINC000853591185	FH	On-Demand	Anodyne	NOS2	99	39
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853591189	GD	On-Demand	Anodyne	NOS2	102	38
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853591190	GD	On-Demand	Anodyne	NOS2	102	38
COC1CC(CCNC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853591200	ED	On-Demand	Anodyne	NOS2	100	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591204	FD	On-Demand	Mild	NOS2	83	33
CC(C)(CO)[C@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)c1cccs1	ZINC000853591223	GF	On-Demand	Anodyne	NOS2	81	32
C=CC[C@H]1CCCC[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591244	EG	On-Demand	Mild	NOS2	96	38
C=CC[C@@H]1CCCC[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591246	EG	On-Demand	Mild	NOS2	96	38
C=CC[C@H]1CCCC[C@@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591248	EG	On-Demand	Mild	NOS2	96	38
C=CC[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853591250	EG	On-Demand	Mild	NOS2	96	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853591252	FD	On-Demand	Anodyne	CPT1A	50	36
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853591252	FD	On-Demand	Anodyne	NOS2	99	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853591254	FD	On-Demand	Anodyne	CPT1A	50	36
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853591254	FD	On-Demand	Anodyne	NOS2	99	40
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cc1	ZINC000853591360	GI	On-Demand	Anodyne	CHRM1	18	41
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cc1	ZINC000853591360	GI	On-Demand	Anodyne	SLC6A3	28	46
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cc1	ZINC000853591360	GI	On-Demand	Anodyne	KCNH2	42	41
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cc1	ZINC000853591360	GI	On-Demand	Anodyne	EPHX2	18	41
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cc1	ZINC000853591360	GI	On-Demand	Anodyne	GLRA1	42	32
C[C@H](O)c1ccc(CNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cc1	ZINC000853591360	GI	On-Demand	Anodyne	PDS	44	34
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(C3CCOCC3)CC2)cc1	ZINC000853591395	GE	On-Demand	Anodyne	HTR4	47	39
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(C3CCOCC3)CC2)cc1	ZINC000853591395	GE	On-Demand	Anodyne	CACNA1I	54	37
C[C@H](O)c1ccc(CNC(=O)NCC2CCN(C3CCOCC3)CC2)cc1	ZINC000853591395	GE	On-Demand	Anodyne	NAMPT	17	40
Cc1cc([C@@H]2CCN(C(=O)NCc3ccc([C@@H](C)O)cc3)C2)c(O)cc1Cl	ZINC000853591424	GI	On-Demand	Anodyne	EPHX2	15	42
Cc1cc([C@@H]2CCN(C(=O)NCc3ccc([C@H](C)O)cc3)C2)c(O)cc1Cl	ZINC000853591425	GI	On-Demand	Anodyne	EPHX2	15	42
C[C@H](O)c1ccc(CNC(=O)N2CCC(C3CCC3)CC2)cc1	ZINC000853591429	DG	On-Demand	Anodyne	TPSAB1	15	46
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853591442	EF	On-Demand	Anodyne	SLC6A5	22	41
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853591442	EF	On-Demand	Anodyne	EPHX2	19	44
C[C@H](O)c1ccc(CNC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853591444	EF	On-Demand	Anodyne	SLC6A5	22	41
C[C@H](O)c1ccc(CNC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853591444	EF	On-Demand	Anodyne	EPHX2	19	44
C[C@H](O)c1ccc(CNC(=O)N2CCc3ccc(Cl)c(Cl)c3C2)cc1	ZINC000853591496	GI	On-Demand	Anodyne	MAPK1	48	47
CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc([C@H](C)O)cc2)C1	ZINC000853591525	CE	On-Demand	Anodyne	TIMP3	55	39
CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc([C@@H](C)O)cc2)C1	ZINC000853591526	CE	On-Demand	Anodyne	TIMP3	55	39
C[C@H](O)c1ccc(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853591624	FD	On-Demand	Anodyne	TRPV1	30	41
C[C@H](O)c1ccc(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591654	FE	On-Demand	Anodyne	SSTR4	48	33
C[C@H](O)c1ccc(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591654	FE	On-Demand	Anodyne	PYGL	34	47
C[C@H](O)c1ccc(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591654	FE	On-Demand	Anodyne	PYGM	30	47
C[C@H](O)c1ccc(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591654	FE	On-Demand	Anodyne	TPP2	43	31
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591655	FE	On-Demand	Anodyne	SSTR4	48	33
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591655	FE	On-Demand	Anodyne	PYGL	34	47
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591655	FE	On-Demand	Anodyne	PYGM	30	47
C[C@H](O)c1ccc(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)cc1	ZINC000853591655	FE	On-Demand	Anodyne	TPP2	43	31
C[C@H](O)c1ccc(CNC(=O)NCC(F)(F)c2cccc(F)c2)cc1	ZINC000853591675	FG	On-Demand	Anodyne	PDS	42	40
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)cc1	ZINC000853591678	GG	On-Demand	Anodyne	CCR5	43	46
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)cc1	ZINC000853591678	GG	On-Demand	Anodyne	NPSR1	26	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)cc1	ZINC000853591680	GG	On-Demand	Anodyne	CCR5	43	46
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)cc1	ZINC000853591680	GG	On-Demand	Anodyne	NPSR1	26	41
C[C@H](O)c1ccc(CNC(=O)NC(C)(C)c2cccc(C#N)c2)cc1	ZINC000853591688	EG	On-Demand	Mild	IMDH_CRYPV	48	32
COc1ccc([C@@H]2CCCN2C(=O)NCc2ccc([C@@H](C)O)cc2)cc1F	ZINC000853591812	FH	On-Demand	Anodyne	ADAM17	15	41
COc1ccc([C@@H]2CCCN2C(=O)NCc2ccc([C@H](C)O)cc2)cc1F	ZINC000853591813	FH	On-Demand	Anodyne	ADAM17	15	41
C[C@H](O)c1ccc(CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)cc1	ZINC000853591842	EH	On-Demand	Anodyne	NPSR1	25	42
C[C@H](O)c1ccc(CNC(=O)N2CC[C@H]2c2ccc(F)cc2)cc1	ZINC000853591843	EH	On-Demand	Anodyne	NPSR1	25	42
Cn1ncc2c(=O)n(CN3CC[C@@H]4COC[C@H]4C3)nnc21	ZINC000853591848	CB	On-Demand	Anodyne	Q9M629_MAIZE	54	36
Cn1ncc2c(=O)n(CN3CC[C@H]4COC[C@@H]4C3)nnc21	ZINC000853591849	CB	On-Demand	Anodyne	Q9M629_MAIZE	54	36
Cn1ncc2c(=O)n(CN3CC[C@H]4COC[C@H]4C3)nnc21	ZINC000853591850	CB	On-Demand	Anodyne	Q9M629_MAIZE	54	36
Cn1ncc2c(=O)n(CN3CC[C@@H]4COC[C@@H]4C3)nnc21	ZINC000853591851	CB	On-Demand	Anodyne	Q9M629_MAIZE	54	36
CCC(C)(C)[C@@H](C)NC(=O)NCc1ccc([C@@H](C)O)cc1	ZINC000853591858	CG	On-Demand	Anodyne	ANPEP	18	44
CCC(C)(C)[C@@H](C)NC(=O)NCc1ccc([C@H](C)O)cc1	ZINC000853591860	CG	On-Demand	Anodyne	ANPEP	18	44
COC(=O)c1nn(CN2CC[C@@H]3COC[C@H]3C2)c2ccccc12	ZINC000853591930	DD	On-Demand	Anodyne	HTR4	50	41
COC(=O)c1nn(CN2CC[C@@H]3COC[C@@H]3C2)c2ccccc12	ZINC000853591931	DD	On-Demand	Anodyne	HTR4	50	41
COC(=O)c1nn(CN2CC[C@H]3COC[C@H]3C2)c2ccccc12	ZINC000853591932	DD	On-Demand	Anodyne	HTR4	50	41
COC(=O)c1nn(CN2CC[C@H]3COC[C@@H]3C2)c2ccccc12	ZINC000853591933	DD	On-Demand	Anodyne	HTR4	50	41
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@@H](C)CO)cc1	ZINC000853591942	DE	On-Demand	Anodyne	TMPRSS11D	51	35
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2[C@H](C)CO)cc1	ZINC000853591943	DE	On-Demand	Anodyne	TMPRSS11D	51	35
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@H](C)CO)cc1	ZINC000853591944	DE	On-Demand	Anodyne	TMPRSS11D	51	35
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2[C@@H](C)CO)cc1	ZINC000853591945	DE	On-Demand	Anodyne	TMPRSS11D	51	35
C[C@H](O)c1ccc(CNC(=O)N2CC(S(C)(=O)=O)C2)cc1	ZINC000853591962	DC	On-Demand	Anodyne	NAMPT	26	40
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000853592000	EE	On-Demand	Anodyne	CPT1A	68	37
C[C@H](O)c1ccc(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000853592001	EE	On-Demand	Anodyne	CPT1A	68	37
C[C@H](O)c1ccc(CNC(=O)N2CCc3nc(-c4ccccc4)sc3C2)cc1	ZINC000853592002	GI	On-Demand	Anodyne	MAPK1	18	42
C[C@H](O)c1ccc(CNC(=O)N2CCc3nc(-c4ccccc4)sc3C2)cc1	ZINC000853592002	GI	On-Demand	Anodyne	P2RY14	43	35
CN1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCC1=O	ZINC000853592008	EC	On-Demand	Anodyne	NOS2	103	40
Cc1nnc(CN(C)C(=O)NCc2ccnc(-n3ccnc3)c2)s1	ZINC000853592024	ED	On-Demand	Anodyne	NOS2	90	35
O=C(NCc1ccnc(-n2ccnc2)c1)N(Cc1ccccc1F)CC1CC1	ZINC000853592026	GH	On-Demand	Anodyne	NOS2	104	37
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592037	EF	On-Demand	Anodyne	NOS2	103	38
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853592055	GE	On-Demand	Anodyne	NOS2	109	43
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853592055	GE	On-Demand	Anodyne	NAMPT	16	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCN1Cc1ccccc1	ZINC000853592056	GE	On-Demand	Anodyne	NOS2	109	43
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCN1Cc1ccccc1	ZINC000853592056	GE	On-Demand	Anodyne	NAMPT	16	41
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1(O)CCC(F)(F)CC1	ZINC000853592062	FE	On-Demand	Anodyne	NOS2	91	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853592064	FE	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853592065	FE	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853592066	FE	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853592069	ED	On-Demand	Anodyne	NOS2	113	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853592070	ED	On-Demand	Anodyne	NOS2	113	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853592071	ED	On-Demand	Anodyne	NOS2	113	44
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2COC[C@H]2C1	ZINC000853592072	ED	On-Demand	Anodyne	NOS2	113	44
COc1cccc(C2(NC(=O)NCc3ccnc(-n4ccnc4)c3)CCC2)c1	ZINC000853592073	GG	On-Demand	Anodyne	NOS2	90	42
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1CCN(CC2CC2)CC1	ZINC000853592075	FE	On-Demand	Anodyne	NOS2	103	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1C[C@H](O)C12CCC2	ZINC000853592089	ED	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853592090	ED	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853592091	ED	On-Demand	Anodyne	NOS2	101	38
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853592092	ED	On-Demand	Anodyne	NOS2	101	38
CCC(CC)CCCN(C)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592100	EH	On-Demand	Anodyne	NOS2	100	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC2(COC2)C1	ZINC000853592106	DD	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N(CCN1CCOCC1)CC1CC1	ZINC000853592113	GD	On-Demand	Anodyne	CASR	44	37
O=C(NCc1ccnc(-n2ccnc2)c1)N(CCN1CCOCC1)CC1CC1	ZINC000853592113	GD	On-Demand	Anodyne	NOS2	105	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC1CCC(C2CCC2)CC1	ZINC000853592115	FG	On-Demand	Anodyne	NOS2	102	40
O=C(NCCOCCF)NCc1ccnc(-n2ccnc2)c1	ZINC000853592123	DD	On-Demand	Anodyne	NOS2	97	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CCC2)[C@@H]1c1ccncc1	ZINC000853592129	FG	On-Demand	Anodyne	NOS2	97	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC2(CCC2)[C@H]1c1ccncc1	ZINC000853592130	FG	On-Demand	Anodyne	NOS2	97	37
Cc1cccc2c1CCC[C@@H]2NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592134	FG	On-Demand	Anodyne	NOS2	97	36
Cc1cccc2c1CCC[C@H]2NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592135	FG	On-Demand	Anodyne	NOS2	97	36
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853592171	FF	On-Demand	Anodyne	NOS2	110	45
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853592171	FF	On-Demand	Anodyne	EPHX2	23	46
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853592171	FF	On-Demand	Anodyne	SCD1	15	42
CNC(=O)CC1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CCCCC1	ZINC000853592177	GE	On-Demand	Anodyne	NOS2	101	38
CC[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C1CC1	ZINC000853592190	CE	On-Demand	Anodyne	NOS2	103	39
CN(C)CCC[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)CCO1	ZINC000853592192	FD	On-Demand	Anodyne	NOS2	113	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853592195	FD	On-Demand	Anodyne	NOS2	113	43
CCSC1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1	ZINC000853592213	EE	On-Demand	Anodyne	NOS2	98	36
C#CCCN(CCOC)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592223	ED	On-Demand	Mild	NOS2	90	36
C=CCC1(NC(=O)NCc2ccnc(-n3ccnc3)c2)CCCC1	ZINC000853592224	EF	On-Demand	Mild	NOS2	91	35
CC(C)(C)OC(=O)C1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CCC1	ZINC000853592231	GF	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)NC1CCN([C@H]2CCOC2)CC1	ZINC000853592241	FD	On-Demand	Anodyne	NOS2	102	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC1CCN([C@@H]2CCOC2)CC1	ZINC000853592242	FD	On-Demand	Anodyne	NOS2	102	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](C2CCC2)C1	ZINC000853592248	EF	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](C2CCC2)C1	ZINC000853592249	EF	On-Demand	Anodyne	NOS2	112	43
O=C(NCC1=CCCC1)NCc1ccnc(-n2ccnc2)c1	ZINC000853592257	CE	On-Demand	Anodyne	NOS2	98	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(c2ccon2)CC1	ZINC000853592262	FE	On-Demand	Anodyne	NOS2	108	42
Cc1ccc(CC2CN(C(=O)NCc3ccnc(-n4ccnc4)c3)C2)cc1	ZINC000853592269	FF	On-Demand	Anodyne	NOS2	108	42
CN(C[C@@H]1CC1(C)C)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592271	DE	On-Demand	Anodyne	NOS2	105	38
NC(=O)CC1(CNC(=O)NCc2ccnc(-n3ccnc3)c2)CCCCC1	ZINC000853592276	FD	On-Demand	Anodyne	NOS2	93	36
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853592296	DE	On-Demand	Anodyne	NOS2	108	42
O=C(NCc1ccnc(-n2ccnc2)c1)N(CCC1CC1)CC1CC1	ZINC000853592300	EF	On-Demand	Anodyne	NOS2	103	39
O=C1CCCN1C[C@@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853592303	FD	On-Demand	Anodyne	NOS2	106	40
O=C1CCCN1C[C@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853592304	FD	On-Demand	Anodyne	NOS2	106	40
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H](c1ccncc1)C1(CO)CCC1	ZINC000853592305	GE	On-Demand	Anodyne	NOS2	96	37
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H](c1ccncc1)C1(CO)CCC1	ZINC000853592306	GE	On-Demand	Anodyne	NOS2	96	37
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@@H]1CC1CCC1	ZINC000853592309	FH	On-Demand	Anodyne	NOS2	108	45
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCCC[C@H]1CC1CCC1	ZINC000853592310	FH	On-Demand	Anodyne	NOS2	108	45
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@H](CC(F)(F)F)C1	ZINC000853592324	FE	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCO[C@@H](CC(F)(F)F)C1	ZINC000853592325	FE	On-Demand	Anodyne	NOS2	112	43
C[C@H]1c2ccccc2OCCN1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592332	FF	On-Demand	Anodyne	NOS2	112	42
CN1C[C@@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1=O	ZINC000853592337	EC	On-Demand	Anodyne	NOS2	100	40
CN1C[C@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1=O	ZINC000853592338	EC	On-Demand	Anodyne	NOS2	100	40
CC(C)(C)C(F)(F)CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592341	EF	On-Demand	Anodyne	NOS2	92	35
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@](C)(C(F)F)O1	ZINC000853592343	FE	On-Demand	Anodyne	NOS2	101	38
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@](C)(C(F)F)O1	ZINC000853592345	FE	On-Demand	Anodyne	NOS2	101	38
CC(C)(C)N1C[C@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1=O	ZINC000853592347	FD	On-Demand	Anodyne	NOS2	94	37
CC(C)(C)N1C[C@@H](CNC(=O)NCc2ccnc(-n3ccnc3)c2)CC1=O	ZINC000853592348	FD	On-Demand	Anodyne	NOS2	94	37
CN(CC(=O)N1CCCC1)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592351	ED	On-Demand	Anodyne	NOS2	112	41
O=C1C[C@H](c2cccc(F)c2)CN1CN1CCC(c2ccon2)CC1	ZINC000853592359	EF	On-Demand	Anodyne	CCR5	70	32
O=C1C[C@@H](c2cccc(F)c2)CN1CN1CCC(c2ccon2)CC1	ZINC000853592360	EF	On-Demand	Anodyne	CCR5	70	32
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCOC(C2CC2)(C2CC2)C1	ZINC000853592372	FE	On-Demand	Anodyne	NOS2	114	43
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2	ZINC000853592384	GD	On-Demand	Anodyne	NOS2	103	40
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592388	GD	On-Demand	Anodyne	NOS2	99	37
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)NCc2ccnc(-n3ccnc3)c2)O1	ZINC000853592392	FB	On-Demand	Reactive	NOS2	104	41
O=C(NCc1ccnc(-n2ccnc2)c1)NCC(O)(C1CC1)C1CC1	ZINC000853592399	ED	On-Demand	Anodyne	NOS2	105	38
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853592403	ED	On-Demand	Anodyne	NOS2	95	35
O=C(NCc1ccnc(-n2ccnc2)c1)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853592404	ED	On-Demand	Anodyne	NOS2	95	35
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1C[C@H](O)C1	ZINC000853592405	CC	On-Demand	Anodyne	NOS2	103	39
Cn1ncc2c(=O)n(CN3CCC(c4ccon4)CC3)nnc21	ZINC000853592424	DC	On-Demand	Anodyne	Q9M629_MAIZE	52	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853592439	GD	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853592439	GD	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853592439	GD	On-Demand	Anodyne	NAMPT	22	40
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853592440	GD	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853592440	GD	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853592440	GD	On-Demand	Anodyne	NAMPT	22	40
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@]1(C)CO	ZINC000853592442	ED	On-Demand	Anodyne	NOS2	105	40
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@]1(C)CO	ZINC000853592443	ED	On-Demand	Anodyne	NOS2	105	40
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592449	DF	On-Demand	Mild	NOS2	101	38
C=CCCC(C)(C)NC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592451	DF	On-Demand	Mild	NOS2	92	33
CN(c1ccccc1)[C@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853592454	GF	On-Demand	Anodyne	NOS2	119	48
CN(c1ccccc1)[C@@H]1CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853592455	GF	On-Demand	Anodyne	NOS2	119	48
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H](CO)CC1CC1	ZINC000853592457	ED	On-Demand	Anodyne	NOS2	100	37
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H](CO)CC1CC1	ZINC000853592458	ED	On-Demand	Anodyne	NOS2	100	37
CN(C[C@@H]1CCc2ccccc21)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592470	FG	On-Demand	Anodyne	NOS2	106	37
O=C1C(=O)N(CN2CCC(c3ccon3)CC2)c2ccc(-c3ccccc3)cc21	ZINC000853592478	GH	On-Demand	Anodyne	ALDH3A1	23	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853592489	FE	On-Demand	Anodyne	CCR3	35	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853592489	FE	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853592490	FE	On-Demand	Anodyne	CCR3	35	40
O=C(NCc1ccnc(-n2ccnc2)c1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853592490	FE	On-Demand	Anodyne	NOS2	104	40
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1CCC(O)CC1	ZINC000853592497	ED	On-Demand	Anodyne	NOS2	103	38
Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592498	GD	On-Demand	Anodyne	NOS2	97	35
CC[C@@](C)(NC(=O)NCc1ccnc(-n2ccnc2)c1)C1CC1	ZINC000853592502	DF	On-Demand	Anodyne	NOS2	104	38
C#C[C@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C1CCOCC1	ZINC000853592507	ED	On-Demand	Mild	NOS2	100	39
C#C[C@@H](NC(=O)NCc1ccnc(-n2ccnc2)c1)C1CCOCC1	ZINC000853592508	ED	On-Demand	Mild	NOS2	100	39
C[C@@]1(C#N)CCN(C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853592512	DD	On-Demand	Mild	NOS2	95	37
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853592516	ED	On-Demand	Anodyne	NOS2	103	41
O=C(NCCN1C[C@@H]2CCCCN2C1=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592532	GD	On-Demand	Anodyne	NOS2	106	43
O=C(NCCN1C[C@H]2CCCCN2C1=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592533	GD	On-Demand	Anodyne	NOS2	106	43
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@H](CC(F)(F)F)O1	ZINC000853592538	GF	On-Demand	Anodyne	NOS2	102	39
C[C@@H]1CN(C(=O)NCc2ccnc(-n3ccnc3)c2)C[C@@H](CC(F)(F)F)O1	ZINC000853592539	GF	On-Demand	Anodyne	NOS2	102	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@H](C2CCCCC2)C1	ZINC000853592541	FH	On-Demand	Anodyne	NOS2	111	42
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC[C@@H](C2CCCCC2)C1	ZINC000853592542	FH	On-Demand	Anodyne	NOS2	111	42
Fc1cccc(Cc2nn(CN3CCC(c4ccon4)CC3)c(=S)o2)c1	ZINC000853592558	FH	On-Demand	Anodyne	CCR5	40	34
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2C[C@H]2C1	ZINC000853592561	CD	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H]2C[C@H]2C1	ZINC000853592562	CD	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@H]2C[C@@H]2C1	ZINC000853592563	CD	On-Demand	Anodyne	NOS2	112	43
O=C(NCc1ccnc(-n2ccnc2)c1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853592564	CD	On-Demand	Anodyne	NOS2	112	43
C[C@@H]1N(C(=O)NCc2ccnc(-n3ccnc3)c2)c2ccccc2C1(C)C	ZINC000853592572	FH	On-Demand	Anodyne	NOS2	103	39
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853592576	FD	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853592577	FD	On-Demand	Anodyne	NOS2	105	41
O=C(NCc1ccnc(-n2ccnc2)c1)NC1CC(CO)C1	ZINC000853592591	DC	On-Demand	Anodyne	NOS2	101	38
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCc2ccnc(-n3ccnc3)c2)C1	ZINC000853592597	ED	On-Demand	Anodyne	NOS2	107	41
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21	ZINC000853592601	FF	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853592602	FF	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21	ZINC000853592603	FF	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccnc(-n2ccnc2)c1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853592604	FF	On-Demand	Anodyne	NOS2	82	33
O=C(NCc1ccnc(-n2ccnc2)c1)NCC1SCCS1	ZINC000853592606	ED	On-Demand	Anodyne	NOS2	101	37
CCC(CC)(CNC(=O)NCc1ccnc(-n2ccnc2)c1)c1ccc(F)cc1	ZINC000853592637	GH	On-Demand	Anodyne	NOS2	88	34
CN(CC1=CCSC1)C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853592655	EE	On-Demand	Anodyne	NOS2	98	35
O=C(NCCC1SCCS1)NCc1ccnc(-n2ccnc2)c1	ZINC000853592656	EE	On-Demand	Anodyne	NOS2	99	36
C[C@@H](Cn1cncn1)NC(=O)NNc1cc(F)cc(Cl)c1	ZINC000853592691	DD	On-Demand	Reactive	HIS3	80	36
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CC[C@H](CN2CCCC2=O)C1	ZINC000853592711	FE	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	35
O=C1C=C(c2ccc(Cl)cc2)CN1CN1CC[C@@H](CN2CCCC2=O)C1	ZINC000853592712	FE	On-Demand	Anodyne	Q8MHZ5_SHEEP	45	35
CON(C)CCNC(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000853592740	EE	On-Demand	Anodyne	ROCK1	16	43
CON(C)CCNC(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC000853592740	EE	On-Demand	Anodyne	ROCK2	19	43
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853592746	GD	On-Demand	Anodyne	CACNA1I	42	35
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853592747	GD	On-Demand	Anodyne	CACNA1I	42	35
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853592748	GD	On-Demand	Anodyne	CACNA1I	42	35
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853592749	GD	On-Demand	Anodyne	CACNA1I	42	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)Cn1cncn1	ZINC000853592762	DC	On-Demand	Mild	HIS3	75	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)Cn1cncn1	ZINC000853592763	DC	On-Demand	Mild	HIS3	75	35
c1ccc2c(c1)CCC1(CCN(Cn3cnnc3)CC1)O2	ZINC000853592780	CE	On-Demand	Anodyne	SCD	15	41
C#CCCN(CCOC)C(=O)N[C@H](C)Cn1cncn1	ZINC000853592782	CC	On-Demand	Mild	HIS3	81	38
C#CCCN(CCOC)C(=O)N[C@@H](C)Cn1cncn1	ZINC000853592783	CC	On-Demand	Mild	HIS3	81	38
C[C@@H](Cn1cncn1)NC(=O)N1CC[C@@H](C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853592817	GE	On-Demand	Anodyne	HIS3	54	34
C[C@@H]1CCN(C(=O)N[C@H](C)Cn2cncn2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853592818	GE	On-Demand	Anodyne	HIS3	54	34
Oc1cc2c(cc1CN1CCC3(CCc4ccccc4O3)CC1)OCO2	ZINC000853592821	FG	On-Demand	Clean	SIGMAR1	17	60
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC2(CCc3ccccc3O2)CC1	ZINC000853592866	GF	On-Demand	Anodyne	CHRNA7	18	50
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC2(CCc3ccccc3O2)CC1	ZINC000853592867	GF	On-Demand	Anodyne	CHRNA7	18	50
O=C1N(Cc2cccnc2)CCN1CN1CCC2(CCc3ccccc3O2)CC1	ZINC000853592881	GG	On-Demand	Anodyne	SCD	46	47
COC(=O)c1ccc(=O)n(CN2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853592883	FD	On-Demand	Anodyne	SCD	29	42
O=C1C[C@@H](c2ccc(Cl)cc2)N1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853592892	FH	On-Demand	Anodyne	GRIN2D	63	31
O=C1C[C@H](c2ccc(Cl)cc2)N1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853592893	FH	On-Demand	Anodyne	GRIN2D	63	31
Cn1c(-c2ccccc2F)nn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853592900	GF	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	34
Cn1c(-c2ccccc2F)nn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853592902	GF	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	34
C[C@@H](Cn1cncn1)NC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)OC(C)(C)C)C2	ZINC000853592907	GD	On-Demand	Anodyne	HIS3	66	36
C[C@@H](Cn1cncn1)NC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)OC(C)(C)C)C2	ZINC000853592913	GD	On-Demand	Anodyne	HIS3	66	36
Cn1ncc2c(=O)n(CN3CCC4(CCc5ccccc5O4)CC3)nnc21	ZINC000853592915	FD	On-Demand	Anodyne	Q9M629_MAIZE	55	37
COc1cc2c(cc1OC)N(CN1CC[C@@H](Oc3ccccc3)C1)C(=O)C2=O	ZINC000853592921	GE	On-Demand	Anodyne	ACHE	20	43
COc1cc2c(cc1OC)N(CN1CC[C@@H](Oc3ccccc3)C1)C(=O)C2=O	ZINC000853592921	GE	On-Demand	Anodyne	ADRA2C	43	35
COc1cc2c(cc1OC)N(CN1CC[C@@H](Oc3ccccc3)C1)C(=O)C2=O	ZINC000853592921	GE	On-Demand	Anodyne	CASP3	41	37
COc1cc2c(cc1OC)N(CN1CC[C@@H](Oc3ccccc3)C1)C(=O)C2=O	ZINC000853592921	GE	On-Demand	Anodyne	PDE3B	42	36
COc1cc2c(cc1OC)N(CN1CC[C@@H](Oc3ccccc3)C1)C(=O)C2=O	ZINC000853592921	GE	On-Demand	Anodyne	CASP7	54	37
COc1cc(CN2CC[C@@H](Oc3ccccc3)C2)c(O)cc1C	ZINC000853592962	DG	On-Demand	Clean	PDE3B	41	36
C[C@@H](Cn1cncn1)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853592973	DD	On-Demand	Reactive	HIS3	75	33
O=C1C(=O)N(CN2CCC(c3ccon3)CC2)C(=O)N1Cc1ccccc1	ZINC000853593031	FD	On-Demand	Anodyne	DRD4	16	40
C[C@@H](Cn1cncn1)NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853593059	FD	On-Demand	Anodyne	HIS3	82	39
O=C1C(=O)N(CN2CCC(c3ccon3)CC2)c2ccccc21	ZINC000853593114	DE	On-Demand	Anodyne	ALDH1A1	49	39
O=C1C(=O)N(CN2CCC(c3ccon3)CC2)c2ccccc21	ZINC000853593114	DE	On-Demand	Anodyne	ALDH3A1	41	52
COC(=O)c1cn(CN2CC[C@@H](Oc3ccccc3)C2)nn1	ZINC000853593150	DD	On-Demand	Anodyne	CHRM3	15	46
COC(=O)[C@@H]1CN(CN2CC[C@@H](Oc3ccccc3)C2)C(=O)O1	ZINC000853593164	DD	On-Demand	Anodyne	CHRM3	15	44
COC(=O)c1ncn(CN2CC[C@@H](Oc3ccccc3)C2)n1	ZINC000853593170	DD	On-Demand	Anodyne	DRD4	19	41
COC(=O)c1ncn(CN2CC[C@@H](Oc3ccccc3)C2)n1	ZINC000853593170	DD	On-Demand	Anodyne	CHRM3	18	44
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1	ZINC000853593200	GD	On-Demand	Anodyne	HIS3	54	34
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@H](c2nnc(S)n2C2CC2)C1	ZINC000853593202	GD	On-Demand	Anodyne	HIS3	54	34
CCOC(=O)c1cnn(CN2CC[C@@H](Oc3ccccc3)C2)c1C(F)F	ZINC000853593203	FG	On-Demand	Anodyne	CHRM3	15	43
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853593341	GE	On-Demand	Anodyne	CHRM3	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853593341	GE	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853593344	GE	On-Demand	Anodyne	CHRM3	15	42
CC(C)(C)OC(=O)NC[C@H]1CC(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853593344	GE	On-Demand	Anodyne	CACNA1I	45	32
O=C1CCCN1C[C@@H]1CCN(Cn2nnc3ccc(Cl)cc3c2=O)C1	ZINC000853593346	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	85	40
O=C1CCCN1C[C@H]1CCN(Cn2nnc3ccc(Cl)cc3c2=O)C1	ZINC000853593349	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	85	40
O=C1CCCN1C[C@@H]1CCN(Cn2nnc3ccccc3c2=O)C1	ZINC000853593498	EC	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	32
COC(=O)c1nn(CN2CC[C@H](CN3CCCC3=O)C2)c2ccccc12	ZINC000853593499	FD	On-Demand	Anodyne	HTR4	56	38
O=C1CCCN1C[C@H]1CCN(Cn2nnc3ccccc3c2=O)C1	ZINC000853593500	EC	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	32
COC(=O)c1nn(CN2CC[C@@H](CN3CCCC3=O)C2)c2ccccc12	ZINC000853593502	FD	On-Demand	Anodyne	HTR4	56	38
C[C@@H](Cn1cncn1)NC(=O)N1CC(O)(c2ccc(Br)cc2)C1	ZINC000853593514	GD	On-Demand	Anodyne	HIS3	79	35
O=C1CCCN1C[C@H]1CCN(Cn2c(-c3ccccc3)nsc2=S)C1	ZINC000853593585	FG	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	32
O=C1CCCN1C[C@@H]1CCN(Cn2c(-c3ccccc3)nsc2=S)C1	ZINC000853593587	FG	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	32
COC(=O)c1cccc(NNC(=O)N[C@@H](C)Cn2cncn2)c1C	ZINC000853593596	ED	On-Demand	Reactive	HIS3	74	38
O=C1CCCN1C[C@@H]1CCN(CN2CC[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853593599	FD	On-Demand	Anodyne	ACHE	18	49
O=C1CCCN1C[C@@H]1CCN(CN2CC[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853593599	FD	On-Demand	Anodyne	SIGMAR1	18	43
O=C1CCCN1C[C@H]1CCN(CN2CC[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853593601	FD	On-Demand	Anodyne	ACHE	18	49
O=C1CCCN1C[C@H]1CCN(CN2CC[C@@H](Cc3ccccc3)C2=O)C1	ZINC000853593601	FD	On-Demand	Anodyne	SIGMAR1	18	43
O=C1CCCN1C[C@H]1CCN(CN2CC[C@H](Cc3ccccc3)C2=O)C1	ZINC000853593602	FD	On-Demand	Anodyne	ACHE	18	49
O=C1CCCN1C[C@H]1CCN(CN2CC[C@H](Cc3ccccc3)C2=O)C1	ZINC000853593602	FD	On-Demand	Anodyne	SIGMAR1	18	43
O=C1CCCN1C[C@@H]1CCN(CN2CC[C@H](Cc3ccccc3)C2=O)C1	ZINC000853593603	FD	On-Demand	Anodyne	ACHE	18	49
O=C1CCCN1C[C@@H]1CCN(CN2CC[C@H](Cc3ccccc3)C2=O)C1	ZINC000853593603	FD	On-Demand	Anodyne	SIGMAR1	18	43
C[C@@H](Cn1cncn1)NC(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1	ZINC000853593744	FD	On-Demand	Anodyne	HIS3	75	33
O=C1C(=O)N(CN2CC[C@@H](CN3CCCC3=O)C2)c2ccccc21	ZINC000853593770	ED	On-Demand	Anodyne	ALDH1A1	41	38
O=C1C(=O)N(CN2CC[C@@H](CN3CCCC3=O)C2)c2ccccc21	ZINC000853593770	ED	On-Demand	Anodyne	ALDH3A1	39	47
O=C1C(=O)N(CN2CC[C@H](CN3CCCC3=O)C2)c2ccccc21	ZINC000853593771	ED	On-Demand	Anodyne	ALDH1A1	41	38
O=C1C(=O)N(CN2CC[C@H](CN3CCCC3=O)C2)c2ccccc21	ZINC000853593771	ED	On-Demand	Anodyne	ALDH3A1	39	47
CCn1c(-c2ccc(C)cc2)nn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853593858	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	36
CCn1c(-c2ccc(C)cc2)nn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853593859	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	36
CCn1c(-c2ccccc2)nn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853593965	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	36
CCn1c(-c2ccccc2)nn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853593968	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	52	36
COC(=O)c1cc(C(=O)OC)n(CN2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853594015	GE	On-Demand	Anodyne	SCD1	15	40
COC(=O)c1cc(C(=O)OC)n(CN2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853594015	GE	On-Demand	Anodyne	SCD	21	40
CC(C)(C)OC(=O)N1CCO[C@H]2CCN(c3cnc(F)cn3)C[C@H]21	ZINC000853594047	ED	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CCO[C@@H]2CCN(c3cnc(F)cn3)C[C@@H]21	ZINC000853594050	ED	On-Demand	Anodyne	GPR119	15	41
O=C1CCCN1C[C@H]1CCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000853594051	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	54	32
O=C1CCCN1C[C@@H]1CCN(Cn2nc(-c3ccccc3)ccc2=O)C1	ZINC000853594052	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	54	32
CC(C)(C)OC(=O)N1CCO[C@H]2CCN(c3cnc(F)cn3)C[C@@H]21	ZINC000853594053	ED	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CCO[C@@H]2CCN(c3cnc(F)cn3)C[C@H]21	ZINC000853594056	ED	On-Demand	Anodyne	GPR119	15	41
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853594082	FC	On-Demand	Anodyne	HIS3	64	35
C[C@@H](Cn1cncn1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853594085	FC	On-Demand	Anodyne	HIS3	64	35
COc1cccc([C@H]2CC(=O)N(CN3CC[C@@H](Oc4ccccc4)C3)C2)c1	ZINC000853594098	FG	On-Demand	Anodyne	HTR1A	17	41
COc1cccc([C@H]2CC(=O)N(CN3CC[C@@H](Oc4ccccc4)C3)C2)c1	ZINC000853594098	FG	On-Demand	Anodyne	EBP	17	40
O=C1CCCN1C[C@H]1CCN(CN2CC[C@H](CCc3ccccc3)C2=O)C1	ZINC000853594112	FE	On-Demand	Anodyne	ACHE	24	50
O=C1CCCN1C[C@@H]1CCN(CN2CC[C@H](CCc3ccccc3)C2=O)C1	ZINC000853594113	FE	On-Demand	Anodyne	ACHE	24	50
O=C1CCCN1C[C@H]1CCN(CN2CC[C@@H](CCc3ccccc3)C2=O)C1	ZINC000853594114	FE	On-Demand	Anodyne	ACHE	24	50
O=C1CCCN1C[C@@H]1CCN(CN2CC[C@@H](CCc3ccccc3)C2=O)C1	ZINC000853594116	FE	On-Demand	Anodyne	ACHE	24	50
O=C1CCCN1C[C@@H]1CCN(Cn2nc(-c3ccc(Cl)cc3)oc2=S)C1	ZINC000853594142	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	34
O=C1CCCN1C[C@H]1CCN(Cn2nc(-c3ccc(Cl)cc3)oc2=S)C1	ZINC000853594143	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	41	34
COC(=O)c1ccc2c(cnn2CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853594157	FF	On-Demand	Anodyne	MCHR1	17	44
O=C1CCCN1C[C@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000853594186	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	30
O=C1CCCN1C[C@@H]1CCN(Cn2[nH]c(-c3ccccc3)nc2=S)C1	ZINC000853594188	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	30
O=C1C(=O)N(CN2CCC3(CCc4ccccc4O3)CC2)c2ccccc21	ZINC000853594216	FG	On-Demand	Anodyne	ALDH1A1	50	40
O=C1C(=O)N(CN2CCC3(CCc4ccccc4O3)CC2)c2ccccc21	ZINC000853594216	FG	On-Demand	Anodyne	ALDH3A1	43	53
O=C1C(=O)N(CN2CCC3(CCc4ccccc4O3)CC2)c2ccccc21	ZINC000853594216	FG	On-Demand	Anodyne	CES1	15	41
c1cncc(-c2ccnn2CN2CCC3(CCc4ccccc4O3)CC2)c1	ZINC000853594256	FH	On-Demand	Anodyne	SCD	42	42
C[C@@H](Cn1cncn1)NC(=O)N[C@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853594296	FD	On-Demand	Anodyne	HIS3	75	35
C[C@@H](Cn1cncn1)NC(=O)N[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853594300	FD	On-Demand	Anodyne	HIS3	75	35
C[C@@H](Cn1cncn1)NC(=O)NNc1ccc(Cl)cc1Br	ZINC000853594326	FE	On-Demand	Reactive	HIS3	82	39
O=C1C(=O)N(CN2CCC3(COC3)C2)c2ccccc21	ZINC000853594452	CC	On-Demand	Anodyne	ALDH1A1	60	43
O=C1C(=O)N(CN2CCC3(COC3)C2)c2ccccc21	ZINC000853594452	CC	On-Demand	Anodyne	ALDH3A1	45	54
O=C1C(=O)N(CN2CCC3(COC3)C2)c2ccccc21	ZINC000853594452	CC	On-Demand	Anodyne	CES1	17	47
O=C1C[C@H](c2cccnc2)CN1CN1CCC2(CCc3ccccc3O2)CC1	ZINC000853594479	GG	On-Demand	Anodyne	SCD	41	41
O=C1C[C@@H](c2cccnc2)CN1CN1CCC2(CCc3ccccc3O2)CC1	ZINC000853594482	GG	On-Demand	Anodyne	SCD	41	41
O=C1CCCN1C[C@@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853594527	EC	On-Demand	Anodyne	Q8MHZ5_SHEEP	56	37
O=C1CCCN1C[C@H]1CCN(Cn2nnc3cc(F)ccc3c2=O)C1	ZINC000853594529	EC	On-Demand	Anodyne	Q8MHZ5_SHEEP	56	37
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853594536	FE	On-Demand	Anodyne	CHRNA7	19	50
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853594539	FE	On-Demand	Anodyne	CHRNA7	19	50
O=C1C[C@H](c2cccc(F)c2)CN1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853594545	FG	On-Demand	Anodyne	CCR5	85	37
O=C1C[C@@H](c2cccc(F)c2)CN1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853594546	FG	On-Demand	Anodyne	CCR5	85	37
CCOC(=O)c1cnn(CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853594552	DE	On-Demand	Anodyne	CHRM3	16	45
CCn1c(-c2cccc(C)c2)nn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853594598	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	34
CCn1c(-c2cccc(C)c2)nn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853594601	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	34
CCCCN1CCC(NC(=O)N2CCC(NC(=O)OC)CC2)CC1	ZINC000853594608	ED	On-Demand	Anodyne	HTR4	43	43
CCCCN1CCC(NC(=O)N2CCC(NC(=O)OC)CC2)CC1	ZINC000853594608	ED	On-Demand	Anodyne	EPHX2	18	40
O=C1CCCN1C[C@@H]1CCN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000853594629	EE	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	34
O=C1CCCN1C[C@H]1CCN(Cn2c(=O)oc3ccc(Cl)cc32)C1	ZINC000853594632	EE	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	34
O=c1c2cc(Cl)ccc2nnn1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853594698	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	58	32
Cc1ccn(CN2CC[C@@H](Oc3ccccc3)C2)c(=O)c1C#N	ZINC000853594734	DE	On-Demand	Mild	GRM2	18	40
Cc1nnc(-c2cccc(C#N)c2)n1CN1CC[C@H](CN2CCCC2=O)C1	ZINC000853594771	FE	On-Demand	Mild	Q8MHZ5_SHEEP	52	33
Cc1nnc(-c2cccc(C#N)c2)n1CN1CC[C@@H](CN2CCCC2=O)C1	ZINC000853594776	FE	On-Demand	Mild	Q8MHZ5_SHEEP	52	33
CCCC[C@@H]1NC(=O)N(CN2CCC3(CCc4ccccc4O3)CC2)C1=O	ZINC000853594870	FF	On-Demand	Anodyne	GHRL	62	40
CCCC[C@H]1NC(=O)N(CN2CCC3(CCc4ccccc4O3)CC2)C1=O	ZINC000853594873	FF	On-Demand	Anodyne	GHRL	62	40
COC(=O)[C@@H]1CC(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853594905	DD	On-Demand	Anodyne	CHRM3	16	47
COC(=O)c1cn(CN2CCC3(CCc4ccccc4O3)CC2)nn1	ZINC000853594919	ED	On-Demand	Anodyne	SCD1	15	42
COC(=O)c1cn(CN2CCC3(CCc4ccccc4O3)CC2)nn1	ZINC000853594919	ED	On-Demand	Anodyne	SCD	30	42
Cn1ncc2c(=O)n(CN3CC[C@@H](Oc4ccccc4)C3)nnc21	ZINC000853594927	EC	On-Demand	Anodyne	Q9M629_MAIZE	52	34
COc1ccc(-n2cnn(CN3CC[C@@H](Oc4ccccc4)C3)c2=S)cn1	ZINC000853594989	GF	On-Demand	Anodyne	OXTR	15	40
C[C@@H](Cn1cncn1)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853595155	EC	On-Demand	Anodyne	HIS3	74	34
Cn1c(-c2ccccc2)nn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853595183	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	33
Cn1c(-c2ccccc2)nn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853595186	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	33
COc1ccc(-c2nnn(CN3CC[C@@H](Oc4ccccc4)C3)n2)cc1OC	ZINC000853595287	GE	On-Demand	Anodyne	PDE3A	44	40
COc1ccc(-c2nnn(CN3CC[C@@H](Oc4ccccc4)C3)n2)cc1OC	ZINC000853595287	GE	On-Demand	Anodyne	PDE3B	45	40
O=C1CCCN1C[C@@H]1CCN(Cn2[nH]c(-c3ccc(Cl)cc3)nc2=S)C1	ZINC000853595365	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	55	35
O=C1CCCN1C[C@H]1CCN(Cn2[nH]c(-c3ccc(Cl)cc3)nc2=S)C1	ZINC000853595366	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	55	35
C[C@@H](Cn1cncn1)NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853595378	ED	On-Demand	Anodyne	HIS3	85	38
O=c1c(Cl)c(Cl)cnn1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853595390	EF	On-Demand	Anodyne	NPBWR1	47	36
O=C1C(=O)N(CN2CCC3(COC3)C2)C(=O)N1Cc1ccccc1	ZINC000853595402	EC	On-Demand	Anodyne	SIGMAR1	29	41
COc1ccc(-c2nnn(CN3CC[C@H](CN4CCCC4=O)C3)n2)cc1OC	ZINC000853595435	GD	On-Demand	Anodyne	SCARB1	21	40
COc1ccc(-c2nnn(CN3CC[C@@H](CN4CCCC4=O)C3)n2)cc1OC	ZINC000853595437	GD	On-Demand	Anodyne	SCARB1	21	40
O=C1CCCN1C[C@@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000853595460	FF	On-Demand	Anodyne	ACHE	32	53
O=C1CCCN1C[C@H]1CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000853595463	FF	On-Demand	Anodyne	ACHE	32	53
O=C1CCCN1C[C@H]1CCN(Cn2nc(-c3ccccc3F)ccc2=O)C1	ZINC000853595481	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	48	33
O=C1CCCN1C[C@@H]1CCN(Cn2nc(-c3ccccc3F)ccc2=O)C1	ZINC000853595482	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	48	33
O=[N+]([O-])c1ccc2c(cnn2CN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853595490	EG	On-Demand	Bother	F2RL3	45	32
Cn1ncc2c(=O)n(CN3CC[C@@H](CN4CCCC4=O)C3)nnc21	ZINC000853595491	EB	On-Demand	Anodyne	Q9M629_MAIZE	47	33
Cn1ncc2c(=O)n(CN3CC[C@H](CN4CCCC4=O)C3)nnc21	ZINC000853595493	EB	On-Demand	Anodyne	Q9M629_MAIZE	47	33
O=C1C(=O)N(CN2CCC3(COC3)C2)c2cc(OC(F)(F)F)ccc21	ZINC000853595548	FD	On-Demand	Anodyne	CHRM5	15	43
Cc1cc(-c2nnn(CN3CC[C@H](CN4CCCC4=O)C3)n2)ccc1F	ZINC000853595597	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	57	36
Cc1cc(-c2nnn(CN3CC[C@@H](CN4CCCC4=O)C3)n2)ccc1F	ZINC000853595598	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	57	36
Cc1ccc(-c2cnn(CN3CC[C@H](CN4CCCC4=O)C3)c2)cc1	ZINC000853595622	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	33
Cc1ccc(-c2cnn(CN3CC[C@@H](CN4CCCC4=O)C3)c2)cc1	ZINC000853595624	EF	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	33
O=c1c2ccccc2nnn1CN1CC[C@@H](Oc2ccccc2)C1	ZINC000853595629	DD	On-Demand	Anodyne	TNKS	48	34
O=C1C(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)c2ccccc21	ZINC000853595651	DE	On-Demand	Anodyne	ALDH1A1	61	44
O=C1C(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)c2ccccc21	ZINC000853595651	DE	On-Demand	Anodyne	ALDH3A1	43	54
O=C1C(=O)N(CN2CC[C@@H](Oc3ccccc3)C2)c2ccccc21	ZINC000853595651	DE	On-Demand	Anodyne	CES1	16	41
O=C1C(=O)N(CN2CCC3(COC3)C2)c2ccc(Br)cc21	ZINC000853595752	FD	On-Demand	Anodyne	ALDH1A1	27	45
O=C1C(=O)N(CN2CCC3(COC3)C2)c2ccc(Br)cc21	ZINC000853595752	FD	On-Demand	Anodyne	ALDH3A1	18	40
Cn1c(=S)n(CN2CC[C@@H](CN3CCCC3=O)C2)c2cc(Cl)ccc21	ZINC000853595773	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	35
Cn1c(=S)n(CN2CC[C@H](CN3CCCC3=O)C2)c2cc(Cl)ccc21	ZINC000853595774	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	43	35
O=C(c1ccccc1)c1ccc(O)c(CN2CC[C@H](CN3CCCC3=O)C2)c1O	ZINC000853595783	GF	On-Demand	Clean	ACHE	15	42
O=C(c1ccccc1)c1ccc(O)c(CN2CC[C@@H](CN3CCCC3=O)C2)c1O	ZINC000853595784	GF	On-Demand	Clean	ACHE	15	42
CCCCN1CCC(NC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)CC1	ZINC000853595828	FF	On-Demand	Anodyne	CCR3	15	40
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)CC1	ZINC000853595830	FF	On-Demand	Anodyne	CCR3	15	40
COc1ccc(-c2nn(CN3CC[C@@H](Oc4ccccc4)C3)c(=S)n2C)cc1	ZINC000853595867	GH	On-Demand	Anodyne	HRH3	15	40
O=C1CCCN1C[C@H]1CCN(Cn2nc(Cc3cccc(F)c3)oc2=S)C1	ZINC000853595926	GF	On-Demand	Anodyne	CCR5	57	34
O=C1CCCN1C[C@@H]1CCN(Cn2nc(Cc3cccc(F)c3)oc2=S)C1	ZINC000853595927	GF	On-Demand	Anodyne	CCR5	57	34
C[C@@H](Cn1cncn1)NC(=O)NNc1cccc2c1OC(F)(F)O2	ZINC000853596023	ED	On-Demand	Reactive	HIS3	66	35
O=C1CCCN1C[C@H]1CCN(CN2C[C@H](c3cccc(F)c3)CC2=O)C1	ZINC000853596070	FE	On-Demand	Anodyne	CCR5	71	38
O=C1CCCN1C[C@@H]1CCN(CN2C[C@H](c3cccc(F)c3)CC2=O)C1	ZINC000853596071	FE	On-Demand	Anodyne	CCR5	71	38
O=C1CCCN1C[C@H]1CCN(CN2C[C@@H](c3cccc(F)c3)CC2=O)C1	ZINC000853596072	FE	On-Demand	Anodyne	CCR5	71	38
O=C1CCCN1C[C@@H]1CCN(CN2C[C@@H](c3cccc(F)c3)CC2=O)C1	ZINC000853596073	FE	On-Demand	Anodyne	CCR5	71	38
O[C@]1(c2cnn[nH]2)CCCN(c2nc3ccccc3n3cccc23)C1	ZINC000853596078	EE	On-Demand	Anodyne	HTR3A	25	41
O[C@@]1(c2cnn[nH]2)CCCN(c2nc3ccccc3n3cccc23)C1	ZINC000853596079	EE	On-Demand	Anodyne	HTR3A	25	41
O=C1CCCN1C[C@H]1CCN(Cn2nccc2-c2ccc(F)c(Cl)c2)C1	ZINC000853596084	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	53	35
O=C1CCCN1C[C@@H]1CCN(Cn2nccc2-c2ccc(F)c(Cl)c2)C1	ZINC000853596085	GG	On-Demand	Anodyne	Q8MHZ5_SHEEP	53	35
O=C1CCCN1C[C@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853596106	GC	On-Demand	Anodyne	ACHE	34	55
O=C1CCCN1C[C@@H]1CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853596107	GC	On-Demand	Anodyne	ACHE	34	55
CON(C)CCNC(=O)N[C@H](C)Cn1cncn1	ZINC000853596112	CB	On-Demand	Anodyne	HIS3	83	39
CON(C)CCNC(=O)N[C@@H](C)Cn1cncn1	ZINC000853596113	CB	On-Demand	Anodyne	HIS3	83	39
Cc1ccccc1[C@@H]1CC(=O)N(CN2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853596117	FE	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	33
Cc1ccccc1[C@@H]1CC(=O)N(CN2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853596119	FE	On-Demand	Anodyne	Q8MHZ5_SHEEP	40	33
COc1ccccc1-n1cnn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853596130	GE	On-Demand	Anodyne	HTR1A	28	44
COc1ccccc1-n1cnn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853596130	GE	On-Demand	Anodyne	ADRA1D	26	42
COc1ccccc1-n1cnn(CN2CC[C@H](CN3CCCC3=O)C2)c1=S	ZINC000853596130	GE	On-Demand	Anodyne	ADRA1A	27	42
COc1ccccc1-n1cnn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853596131	GE	On-Demand	Anodyne	HTR1A	28	44
COc1ccccc1-n1cnn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853596131	GE	On-Demand	Anodyne	ADRA1D	26	42
COc1ccccc1-n1cnn(CN2CC[C@@H](CN3CCCC3=O)C2)c1=S	ZINC000853596131	GE	On-Demand	Anodyne	ADRA1A	27	42
C[C@]1(C#N)CCN(CN2C(=O)[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2=O)C1	ZINC000853596342	FD	On-Demand	Mild	SIGMAR1	37	45
C[C@@]1(C#N)CCN(CN2C(=O)[C@@H]3CN(Cc4ccccc4)C[C@@H]3C2=O)C1	ZINC000853596343	FD	On-Demand	Mild	SIGMAR1	37	45
C[C@@]1(C#N)CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000853596415	GD	On-Demand	Mild	SIGMAR1	16	42
C[C@]1(C#N)CCN(CN2C(=O)N[C@@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000853596416	GD	On-Demand	Mild	SIGMAR1	16	42
C[C@]1(C#N)CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000853596417	GD	On-Demand	Mild	SIGMAR1	16	42
C[C@@]1(C#N)CCN(CN2C(=O)N[C@]3(CCCN(Cc4ccccc4)C3)C2=O)C1	ZINC000853596418	GD	On-Demand	Mild	SIGMAR1	16	42
Cn1ncc2c(=O)n(CN3CC[C@](C)(C#N)C3)nnc21	ZINC000853596431	CB	On-Demand	Mild	Q9M629_MAIZE	53	36
Cn1ncc2c(=O)n(CN3CC[C@@](C)(C#N)C3)nnc21	ZINC000853596432	CB	On-Demand	Mild	Q9M629_MAIZE	53	36
C[C@@]1(C#N)CCN(CN2C(=O)C(=O)c3ccc(OC(F)(F)F)cc32)C1	ZINC000853596526	FE	On-Demand	Mild	CHRM5	15	45
C[C@]1(C#N)CCN(CN2C(=O)C(=O)c3ccc(OC(F)(F)F)cc32)C1	ZINC000853596527	FE	On-Demand	Mild	CHRM5	15	45
C[C@@]1(C#N)CCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853596687	EG	On-Demand	Mild	ALDH1A1	50	37
C[C@@]1(C#N)CCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853596687	EG	On-Demand	Mild	ALDH3A1	32	40
C[C@]1(C#N)CCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853596688	EG	On-Demand	Mild	ALDH1A1	50	37
C[C@]1(C#N)CCN(CN2C(=O)C(=O)c3cc(-c4ccccc4)ccc32)C1	ZINC000853596688	EG	On-Demand	Mild	ALDH3A1	32	40
CCCCN1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853596880	DG	On-Demand	Reactive	HTR4	38	41
CCCCN1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853596880	DG	On-Demand	Reactive	CCR3	34	40
CCCCN1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853596880	DG	On-Demand	Reactive	POLC	47	34
CCCCN1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853596880	DG	On-Demand	Reactive	SLC6A5	32	49
CCCCN1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853596880	DG	On-Demand	Reactive	EPHX2	37	41
CCCCN1CCC(NC(=O)N(C)CCN(C)C(=O)OC)CC1	ZINC000853596916	ED	On-Demand	Anodyne	HTR4	38	41
CCCCN1CCC(NC(=O)N(CCF)CCOC)CC1	ZINC000853596965	DD	On-Demand	Anodyne	HTR4	33	41
CCCCN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853597386	DG	On-Demand	Reactive	DRD2	25	42
CCCCN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853597386	DG	On-Demand	Reactive	HTR4	40	41
CCCCN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853597386	DG	On-Demand	Reactive	SIGMAR1	17	43
CCCCN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853597386	DG	On-Demand	Reactive	CCR3	74	45
CCCCN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853597386	DG	On-Demand	Reactive	MCHR1	26	41
C[C@]1(C#N)CCN(CN2C[C@@H]3CN(Cc4ccccc4)CC[C@@H]3C2=O)C1	ZINC000853597387	FE	On-Demand	Mild	SIGMAR1	41	41
C[C@@]1(C#N)CCN(CN2C[C@@H]3CN(Cc4ccccc4)CC[C@@H]3C2=O)C1	ZINC000853597388	FE	On-Demand	Mild	SIGMAR1	41	41
Cn1ncc2c(=O)n(CN3CCC4(COC4)C3)nnc21	ZINC000853597438	CB	On-Demand	Anodyne	Q9M629_MAIZE	54	36
CCCCN1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1	ZINC000853597609	GF	On-Demand	Clean	CCR3	18	43
CCCCN1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1	ZINC000853597609	GF	On-Demand	Clean	EPHX2	21	42
CCCCN1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1	ZINC000853597609	GF	On-Demand	Clean	MCHR1	16	48
C=C1C[C@@H]2CC[C@H](C1)N2CN1Cc2ccc(OC)cc2C1=O	ZINC000853597711	CF	On-Demand	Mild	ADAM17	43	48
C[C@]1(C#N)CCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853597748	DD	On-Demand	Mild	CHRNA7	15	57
C[C@@]1(C#N)CCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853597751	DD	On-Demand	Mild	CHRNA7	15	57
C[C@]1(C#N)CCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853597753	DD	On-Demand	Mild	CHRNA7	15	57
C[C@@]1(C#N)CCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)C1	ZINC000853597756	DD	On-Demand	Mild	CHRNA7	15	57
C=C1C[C@@H]2CC[C@H](C1)N2CN1C[C@@H](Cc2ccccc2)OC1=O	ZINC000853597834	DG	On-Demand	Mild	LUCI_PHOPY	57	32
C=C1C[C@@H]2CC[C@H](C1)N2CN1C[C@H](Cc2ccccc2)OC1=O	ZINC000853597835	DG	On-Demand	Mild	LUCI_PHOPY	57	32
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597954	EF	On-Demand	Anodyne	CHRM1	15	40
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597954	EF	On-Demand	Anodyne	DRD2	21	43
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597954	EF	On-Demand	Anodyne	DRD4	23	44
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597954	EF	On-Demand	Anodyne	HTR4	63	40
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597954	EF	On-Demand	Anodyne	SIGMAR1	34	44
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597954	EF	On-Demand	Anodyne	EPHX2	31	41
CCCCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597954	EF	On-Demand	Anodyne	CYP2J2	47	35
CCCCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597955	EF	On-Demand	Anodyne	CHRM1	15	40
CCCCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597955	EF	On-Demand	Anodyne	DRD2	21	43
CCCCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597955	EF	On-Demand	Anodyne	DRD4	23	44
CCCCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597955	EF	On-Demand	Anodyne	HTR4	63	40
CCCCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597955	EF	On-Demand	Anodyne	SIGMAR1	34	44
CCCCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597955	EF	On-Demand	Anodyne	EPHX2	31	41
CCCCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597955	EF	On-Demand	Anodyne	CYP2J2	47	35
CCCCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597956	EF	On-Demand	Anodyne	CHRM1	15	40
CCCCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597956	EF	On-Demand	Anodyne	DRD2	21	43
CCCCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597956	EF	On-Demand	Anodyne	DRD4	23	44
CCCCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597956	EF	On-Demand	Anodyne	HTR4	63	40
CCCCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597956	EF	On-Demand	Anodyne	SIGMAR1	34	44
CCCCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597956	EF	On-Demand	Anodyne	EPHX2	31	41
CCCCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853597956	EF	On-Demand	Anodyne	CYP2J2	47	35
CCCCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597957	EF	On-Demand	Anodyne	CHRM1	15	40
CCCCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597957	EF	On-Demand	Anodyne	DRD2	21	43
CCCCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597957	EF	On-Demand	Anodyne	DRD4	23	44
CCCCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597957	EF	On-Demand	Anodyne	HTR4	63	40
CCCCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597957	EF	On-Demand	Anodyne	SIGMAR1	34	44
CCCCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597957	EF	On-Demand	Anodyne	EPHX2	31	41
CCCCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853597957	EF	On-Demand	Anodyne	CYP2J2	47	35
CCCCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597973	GH	On-Demand	Anodyne	HTR4	62	43
CCCCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597973	GH	On-Demand	Anodyne	ADRB3	15	40
CCCCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597973	GH	On-Demand	Anodyne	TACR2	74	43
CCCCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597973	GH	On-Demand	Anodyne	SIGMAR1	23	43
CCCCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597973	GH	On-Demand	Anodyne	TACR3	41	37
CCCCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597973	GH	On-Demand	Anodyne	EPHX2	25	46
CCCCN1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597973	GH	On-Demand	Anodyne	MCHR1	20	44
CCCCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597974	GH	On-Demand	Anodyne	HTR4	62	43
CCCCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597974	GH	On-Demand	Anodyne	ADRB3	15	40
CCCCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597974	GH	On-Demand	Anodyne	TACR2	74	43
CCCCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597974	GH	On-Demand	Anodyne	SIGMAR1	23	43
CCCCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597974	GH	On-Demand	Anodyne	TACR3	41	37
CCCCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597974	GH	On-Demand	Anodyne	EPHX2	25	46
CCCCN1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853597974	GH	On-Demand	Anodyne	MCHR1	20	44
CCCCN1CCC(NC(=O)NCCS(=O)(=O)CC(F)(F)F)CC1	ZINC000853598013	FD	On-Demand	Anodyne	EPHX2	23	45
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccccc2)c2c(C)onc2c1=O	ZINC000853598038	FH	On-Demand	Mild	GRM7	53	33
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(C)c2ccccc2c1=O	ZINC000853598047	CF	On-Demand	Mild	HRH1	33	41
C=C1C[C@@H]2CC[C@H](C1)N2Cn1cnc2c(NC(C)C)ncnc21	ZINC000853598075	DF	On-Demand	Mild	ADORA1	16	43
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21	ZINC000853598092	FG	On-Demand	Mild	CHRM5	16	44
O=C(CNC(=O)N1CC[C@H](O)C(F)(F)C1)N1CCN(c2ccccc2)CC1	ZINC000853598120	GC	On-Demand	Anodyne	ADAM10	34	42
O=C(CNC(=O)N1CC[C@@H](O)C(F)(F)C1)N1CCN(c2ccccc2)CC1	ZINC000853598121	GC	On-Demand	Anodyne	ADAM10	34	42
C=C1C[C@@H]2CC[C@H](C1)N2CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O	ZINC000853598162	FG	On-Demand	Mild	SIGMAR1	40	44
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccc(F)c(F)c2)c2ccccc2c1=O	ZINC000853598192	GI	On-Demand	Mild	HRH1	17	40
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1COC2(CCC2)C1	ZINC000853598209	FD	On-Demand	Anodyne	ADAM10	33	41
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1COC2(CCC2)C1	ZINC000853598210	FD	On-Demand	Anodyne	ADAM10	33	41
O=C1C(=O)N(CN2CCC3(COC3)C2)c2ccc(-c3ccccc3)cc21	ZINC000853598236	EF	On-Demand	Anodyne	ALDH1A1	53	36
O=C1C(=O)N(CN2CCC3(COC3)C2)c2ccc(-c3ccccc3)cc21	ZINC000853598236	EF	On-Demand	Anodyne	ALDH3A1	36	44
CCCCN1CCC(NC(=O)NCCc2nnc(S)n2C2CC2)CC1	ZINC000853598250	FE	On-Demand	Anodyne	HTR4	33	43
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC2(COC2)C1	ZINC000853598278	DC	On-Demand	Anodyne	CHRNA7	17	57
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC2(COC2)C1	ZINC000853598279	DC	On-Demand	Anodyne	CHRNA7	17	57
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1CN1CCC2(COC2)C1	ZINC000853598283	FC	On-Demand	Anodyne	SIGMAR1	42	39
CCCCN1CCC(NC(=O)NNc2cccc(C(=O)OC)c2C)CC1	ZINC000853598334	FF	On-Demand	Reactive	HTR4	64	43
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853598399	ED	On-Demand	Anodyne	ADAM10	35	42
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853598400	ED	On-Demand	Anodyne	ADAM10	35	42
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(C)c2cc([N+](=O)[O-])ccc21	ZINC000853598430	DG	On-Demand	Mild	F2RL3	46	33
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1ncccn1	ZINC000853598482	FC	On-Demand	Anodyne	HTR1A	21	43
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1ncccn1	ZINC000853598482	FC	On-Demand	Anodyne	HTR7	33	41
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NCc1ncccn1	ZINC000853598482	FC	On-Demand	Anodyne	PRNP	45	35
C=C1C[C@@H]2CC[C@H](C1)N2Cn1c(=O)oc2ccc(C)cc21	ZINC000853598497	CG	On-Demand	Mild	MIF	19	49
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	HTR1A	23	40
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	DRD2	30	42
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	DRD4	31	50
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	HTR2A	25	50
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	DRD3	38	40
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	HTR4	82	44
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	CHRM3	23	40
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	SIGMAR1	26	47
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	SLC6A5	20	42
CCCCN1CCC(NC(=O)NC[C@H](O)c2cccc3ccccc23)CC1	ZINC000853598565	FG	On-Demand	Anodyne	CCR8	47	34
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	HTR1A	23	40
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	DRD2	30	42
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	DRD4	31	50
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	HTR2A	25	50
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	DRD3	38	40
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	HTR4	82	44
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	CHRM3	23	40
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	SIGMAR1	26	47
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	SLC6A5	20	42
CCCCN1CCC(NC(=O)NC[C@@H](O)c2cccc3ccccc23)CC1	ZINC000853598567	FG	On-Demand	Anodyne	CCR8	47	34
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccc(OC)cc2)c2ccccc2c1=O	ZINC000853598568	GI	On-Demand	Mild	HRH1	22	42
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccc(OC)cc2)c2ccccc2c1=O	ZINC000853598568	GI	On-Demand	Mild	AXL	22	41
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccc(OC)cc2)c2ccccc2c1=O	ZINC000853598568	GI	On-Demand	Mild	MERTK	22	41
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CCC2(COC2)C1	ZINC000853598608	FD	On-Demand	Anodyne	SIGMAR1	49	42
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853598684	GD	On-Demand	Anodyne	SSTR1	40	38
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853598687	GD	On-Demand	Anodyne	SSTR1	40	38
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853598690	GD	On-Demand	Anodyne	SSTR1	40	38
O=C(NCC(=O)N1CCN(c2ccccc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853598695	GD	On-Demand	Anodyne	SSTR1	40	38
C=C1C[C@@H]2CC[C@H](C1)N2CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853598749	DE	On-Demand	Mild	CHRNA7	17	59
C=C1C[C@@H]2CC[C@H](C1)N2CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853598751	DE	On-Demand	Mild	CHRNA7	17	59
CCCCN1CCC(NC(=O)NCCc2nnc(S)n2C(C)C)CC1	ZINC000853598891	FE	On-Demand	Anodyne	HTR4	42	39
CCCCN1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853598903	CD	On-Demand	Anodyne	HTR4	46	44
CCCCN1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853598903	CD	On-Demand	Anodyne	SLC6A5	17	41
CCCCN1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853598903	CD	On-Demand	Anodyne	EPHX2	22	47
CCCCN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853598919	EG	On-Demand	Reactive	HTR4	44	43
CCCCN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853598919	EG	On-Demand	Reactive	SLC6A5	20	43
CCCCN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853598919	EG	On-Demand	Reactive	EPHX2	26	46
CCCCN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853598919	EG	On-Demand	Reactive	CXCR3	15	42
CCCCN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853598919	EG	On-Demand	Reactive	CACNA1I	42	34
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nnc2c(cnn2C)c1=O	ZINC000853598924	CC	On-Demand	Mild	Q9M629_MAIZE	56	37
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2cc(Br)ccc21	ZINC000853598993	FG	On-Demand	Mild	ALDH1A1	24	48
COC(=O)N(C)CCNC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000853599035	GF	On-Demand	Anodyne	NR1I2	43	36
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4ccccc4C3)C2)cc1	ZINC000853599088	FG	On-Demand	Clean	MTNR1A	19	47
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4ccccc4C3)C2)cc1	ZINC000853599088	FG	On-Demand	Clean	MTNR1B	23	47
C[C@@]1(C#N)CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000853599089	DG	On-Demand	Mild	SIGMAR1	20	46
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4ccccc4C3)C2)cc1	ZINC000853599090	FG	On-Demand	Clean	MTNR1A	19	47
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4ccccc4C3)C2)cc1	ZINC000853599090	FG	On-Demand	Clean	MTNR1B	23	47
C[C@]1(C#N)CCN(Cn2ccn(Cc3ccccc3)c2=S)C1	ZINC000853599091	DG	On-Demand	Mild	SIGMAR1	20	46
NC(=O)C[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853599110	ED	On-Demand	Anodyne	SIRT3	75	40
NC(=O)C[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853599110	ED	On-Demand	Anodyne	SIRT2	62	38
NC(=O)C[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853599110	ED	On-Demand	Anodyne	SIRT1	56	36
NC(=O)C[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853599112	ED	On-Demand	Anodyne	SIRT3	75	40
NC(=O)C[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853599112	ED	On-Demand	Anodyne	SIRT2	62	38
NC(=O)C[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853599112	ED	On-Demand	Anodyne	SIRT1	56	36
CON(C)CCNC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000853599137	DD	On-Demand	Anodyne	HTR1D	19	40
CON(C)CCNC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000853599137	DD	On-Demand	Anodyne	NQO2	35	45
CON(C)CCNC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000853599137	DD	On-Demand	Anodyne	MPO	40	35
CON(C)CCNC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000853599137	DD	On-Demand	Anodyne	MTNR1A	32	50
CON(C)CCNC(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000853599137	DD	On-Demand	Anodyne	MTNR1B	17	46
C#CCCN(CCOC)C(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000853599212	GG	On-Demand	Mild	NR1I2	41	35
C=C1C[C@@H]2CC[C@H](C1)N2Cn1nnc(-c2ccc(OC)c(OC)c2)n1	ZINC000853599367	EE	On-Demand	Mild	SCARB1	23	43
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853599410	CE	On-Demand	Mild	ALDH1A1	63	45
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853599410	CE	On-Demand	Mild	ALDH3A1	43	47
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853599410	CE	On-Demand	Mild	CES1	19	45
CON(C)CCNC(=O)NCC1(c2ccc(F)cc2)CCC1	ZINC000853599419	DE	On-Demand	Anodyne	KCNA3	45	36
COCCN(CCF)C(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000853599429	GG	On-Demand	Anodyne	NR1I2	43	36
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000853599431	EE	On-Demand	Mild	CTSG	15	47
COCCN(CCF)C(=O)NCCc1c[nH]c2cc(C)ccc12	ZINC000853599483	DF	On-Demand	Anodyne	MPO	44	34
C[C@@]1(C#N)CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853599537	CD	On-Demand	Mild	ALDH1A1	59	44
C[C@@]1(C#N)CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853599537	CD	On-Demand	Mild	ALDH3A1	42	51
C[C@@]1(C#N)CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853599537	CD	On-Demand	Mild	CES1	16	42
C[C@]1(C#N)CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853599538	CD	On-Demand	Mild	ALDH1A1	59	44
C[C@]1(C#N)CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853599538	CD	On-Demand	Mild	ALDH3A1	42	51
C[C@]1(C#N)CCN(CN2C(=O)C(=O)c3ccccc32)C1	ZINC000853599538	CD	On-Demand	Mild	CES1	16	42
C[C@@]1(C#N)CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853599649	ED	On-Demand	Mild	SIGMAR1	21	48
C[C@]1(C#N)CCN(CN2C(=O)C(=O)N(Cc3ccccc3)C2=O)C1	ZINC000853599650	ED	On-Demand	Mild	SIGMAR1	21	48
COC(=O)N(C)CCNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853599658	GC	On-Demand	Anodyne	SSTR1	40	40
COC(=O)N(C)CCNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000853599658	GC	On-Demand	Anodyne	ADAM10	31	40
CON(C)CCNC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000853599669	FE	On-Demand	Anodyne	CCR4	41	32
CON(C)CCNC(=O)NCc1cccc(Cn2cnc3ccccc32)c1	ZINC000853599669	FE	On-Demand	Anodyne	NR1I2	45	38
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCn2ncc(Br)c2C1	ZINC000853599670	GD	On-Demand	Anodyne	CHRNA7	17	49
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCn2ncc(Br)c2C1	ZINC000853599672	GD	On-Demand	Anodyne	CHRNA7	17	49
O=C(NCCCc1ccc(Cl)cc1)NCCc1nnc(S)n1C1CC1	ZINC000853599733	GG	On-Demand	Anodyne	SCNN1A	44	33
COCCN(CCF)C(=O)NCCN1CCCc2ccccc21	ZINC000853599805	DE	On-Demand	Anodyne	DRD4	41	34
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853599813	FF	On-Demand	Mild	SLC27A4	50	32
C=C1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853599814	FF	On-Demand	Mild	SLC27A4	50	32
O=C(NCc1cccc(Cn2cnc3ccccc32)c1)NCC1SCCS1	ZINC000853599871	GH	On-Demand	Anodyne	NR1I2	44	38
C#C[C@H](NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1)C1CCOCC1	ZINC000853599932	GD	On-Demand	Mild	ADAM10	29	41
C#C[C@@H](NC(=O)NCC(=O)N1CCN(c2ccccc2)CC1)C1CCOCC1	ZINC000853599933	GD	On-Demand	Mild	ADAM10	29	41
O=C(NCc1cccc(Cn2cnc3ccccc32)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853599946	GH	On-Demand	Anodyne	NR1I2	42	35
O=C(NCc1cccc(Cn2cnc3ccccc32)c1)N[C@H]1COC2(CCC2)C1	ZINC000853599947	GH	On-Demand	Anodyne	NR1I2	42	35
C[C@@H]1CCN(C(=O)N[C@H]2CCc3ccccc3C2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853599968	GF	On-Demand	Anodyne	EPHX2	15	48
C[C@@H]1CCN(C(=O)N[C@@H]2CCc3ccccc3C2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853599970	GF	On-Demand	Anodyne	EPHX2	15	48
Cn1ncc2c(=O)n(CN3CCn4ncc(Br)c4C3)nnc21	ZINC000853600073	FB	On-Demand	Anodyne	Q9M629_MAIZE	53	35
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@@H]1CCc2ccccc2C1	ZINC000853600129	FF	On-Demand	Anodyne	ADRB3	19	42
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@@H]1CCc2ccccc2C1	ZINC000853600130	FF	On-Demand	Anodyne	ADRB3	19	42
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@H]1CCc2ccccc2C1	ZINC000853600131	FF	On-Demand	Anodyne	ADRB3	19	42
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@H]1CCc2ccccc2C1	ZINC000853600132	FF	On-Demand	Anodyne	ADRB3	19	42
O=C(NCC1(c2ccc(F)cc2)CCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853600190	FH	On-Demand	Anodyne	KCNA3	45	37
O=C(NCC1(c2ccc(F)cc2)CCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853600191	FH	On-Demand	Anodyne	KCNA3	45	37
O=C(NCC1(c2ccc(F)cc2)CCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853600192	FH	On-Demand	Anodyne	KCNA3	45	37
O=C(NCC1(c2ccc(F)cc2)CCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853600193	FH	On-Demand	Anodyne	KCNA3	45	37
NC(=O)C[C@@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600194	CD	On-Demand	Anodyne	SIRT3	54	36
NC(=O)C[C@@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600194	CD	On-Demand	Anodyne	SIRT2	44	35
NC(=O)C[C@@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600194	CD	On-Demand	Anodyne	SIRT1	40	31
NC(=O)C[C@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600195	CD	On-Demand	Anodyne	SIRT3	54	36
NC(=O)C[C@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600195	CD	On-Demand	Anodyne	SIRT2	44	35
NC(=O)C[C@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600195	CD	On-Demand	Anodyne	SIRT1	40	31
O=C1C(=O)N(CN2CCn3ncc(Br)c3C2)c2ccccc21	ZINC000853600237	FD	On-Demand	Anodyne	ALDH1A1	56	39
O=C1C(=O)N(CN2CCn3ncc(Br)c3C2)c2ccccc21	ZINC000853600237	FD	On-Demand	Anodyne	ALDH3A1	41	52
O=C1C(=O)N(CN2CCn3ncc(Br)c3C2)c2ccccc21	ZINC000853600237	FD	On-Demand	Anodyne	CES1	15	42
NC(=O)C[C@@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)CC1	ZINC000853600273	FH	On-Demand	Anodyne	SIRT3	52	34
NC(=O)C[C@@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)CC1	ZINC000853600273	FH	On-Demand	Anodyne	SIRT2	43	31
NC(=O)C[C@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)CC1	ZINC000853600274	FH	On-Demand	Anodyne	SIRT3	52	34
NC(=O)C[C@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)CC1	ZINC000853600274	FH	On-Demand	Anodyne	SIRT2	43	31
C#CCCN(CCOC)C(=O)NCC1(c2ccc(F)cc2)CCC1	ZINC000853600351	EF	On-Demand	Mild	KCNA3	41	33
Cn1c(S)nnc1CCNC(=O)NCCCc1ccc(Cl)cc1	ZINC000853600444	FE	On-Demand	Anodyne	SCNN1A	42	33
COCCN(CCF)C(=O)NCC1(c2ccc(F)cc2)CCC1	ZINC000853600450	EF	On-Demand	Anodyne	KCNA3	44	35
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCc2nccnc2C1	ZINC000853600475	DE	On-Demand	Anodyne	P2RY14	42	31
CC(C)(C)OC(=O)C[C@@H]1CCCN(c2cnc(F)cn2)CC1	ZINC000853600515	DF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)C[C@H]1CCCN(c2cnc(F)cn2)CC1	ZINC000853600516	DF	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)C[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853600526	GH	On-Demand	Anodyne	SIRT3	66	41
CC(C)(C)OC(=O)C[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853600526	GH	On-Demand	Anodyne	SIRT2	56	41
CC(C)(C)OC(=O)C[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853600526	GH	On-Demand	Anodyne	SIRT1	54	37
CC(C)(C)OC(=O)C[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853600527	GH	On-Demand	Anodyne	SIRT3	66	41
CC(C)(C)OC(=O)C[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853600527	GH	On-Demand	Anodyne	SIRT2	56	41
CC(C)(C)OC(=O)C[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853600527	GH	On-Demand	Anodyne	SIRT1	54	37
CC(C)(C)OC(=O)C[C@@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600573	DF	On-Demand	Anodyne	SIRT3	46	36
CC(C)(C)OC(=O)C[C@@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600573	DF	On-Demand	Anodyne	GPR119	19	43
CC(C)(C)OC(=O)C[C@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600574	DF	On-Demand	Anodyne	SIRT3	46	36
CC(C)(C)OC(=O)C[C@H]1CCCN(c2cc(F)ncn2)CC1	ZINC000853600574	DF	On-Demand	Anodyne	GPR119	19	43
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853600705	FF	On-Demand	Anodyne	BIRC3	49	39
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853600706	FF	On-Demand	Anodyne	BIRC3	49	39
CC[C@@H](O)CNC(=O)N[C@H]1CCOc2c(C)cccc21	ZINC000853600768	CD	On-Demand	Anodyne	TRAR	40	30
CC[C@@H](O)CNC(=O)N[C@H]1CCOc2c(C)cccc21	ZINC000853600768	CD	On-Demand	Anodyne	LASR	41	33
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853600801	CF	On-Demand	Anodyne	RBP4	46	32
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853600803	CF	On-Demand	Anodyne	RBP4	46	32
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853600805	CF	On-Demand	Anodyne	RBP4	46	32
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CC[C@H]2C[C@H]2C1	ZINC000853600807	CF	On-Demand	Anodyne	RBP4	46	32
Cc1cc(C)c2c(c1)N(CN1CCC[C@@H](C(=O)NC(C)C)C1)C(=O)C2=O	ZINC000853600809	FE	On-Demand	Anodyne	EPHX2	22	42
Cc1cccc2c1OCC[C@@H]2NC(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853600864	FG	On-Demand	Anodyne	CCR3	47	37
Cc1cc(C)c(O)c(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1	ZINC000853600865	DF	On-Demand	Clean	SLC6A1	75	35
Cc1cc(C)c(O)c(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1	ZINC000853600865	DF	On-Demand	Clean	EPHX2	15	41
Cc1cccc2c1OCC[C@@H]2NC(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853600867	FG	On-Demand	Anodyne	CCR3	47	37
CCOc1ccc(-c2nnn(CN3C[C@H]4CC[C@@H](C4)C3)n2)cc1	ZINC000853600868	DE	On-Demand	Anodyne	CACNA2D1	44	33
CCOc1ccc(-c2nnn(CN3C[C@H]4CC[C@@H](C4)C3)n2)cc1	ZINC000853600868	DE	On-Demand	Anodyne	CACNA2D2	53	33
C=CCN1CCN(CN2CCC[C@H](C(=O)NC(C)C)C2)C1=O	ZINC000853600892	DD	On-Demand	Mild	SLC6A1	46	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000853600932	FF	On-Demand	Mild	KCNA3	42	36
COc1ccc(-n2ccn(CN3CCC[C@@H](C(=O)NC(C)C)C3)c2=S)cc1	ZINC000853600967	GG	On-Demand	Anodyne	SLC6A1	42	33
Cn1c(S)nnc1CCNC(=O)NCCCNC(=O)c1ccccc1	ZINC000853601025	FC	On-Demand	Anodyne	DRD3	19	40
Cc1cccc2c1OCC[C@@H]2NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853601066	FF	On-Demand	Anodyne	PYGL	31	45
Cc1cccc2c1OCC[C@@H]2NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853601066	FF	On-Demand	Anodyne	PYGM	29	45
Cc1cccc2c1OCC[C@@H]2NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853601067	FF	On-Demand	Anodyne	PYGL	31	45
Cc1cccc2c1OCC[C@@H]2NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853601067	FF	On-Demand	Anodyne	PYGM	29	45
Cc1cccc2c1OCC[C@@H]2NC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853601116	FF	On-Demand	Anodyne	CASR	50	38
Cc1ccc(-c2cnn(CN3CCC[C@@H](C(=O)NC(C)C)C3)c2)cc1	ZINC000853601129	EG	On-Demand	Anodyne	SLC6A1	45	36
O=C1C(=O)N(CN2C[C@H]3CC[C@@H](C3)C2)c2cc(OC(F)(F)F)ccc21	ZINC000853601141	FF	On-Demand	Anodyne	CHRM5	17	46
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCOc2ccccc2[C@H]1C	ZINC000853601198	FH	On-Demand	Anodyne	BDKRB1	15	40
Cc1ccn(CN2CCC[C@H](C(=O)NC(C)C)C2)c(=O)c1C#N	ZINC000853601203	DD	On-Demand	Mild	SLC6A1	84	36
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCOc2ccccc2[C@@H]1C	ZINC000853601204	FH	On-Demand	Anodyne	BDKRB1	15	40
COc1cccc([C@H]2CC(=O)N(CN3CCC[C@H](C(=O)NC(C)C)C3)C2)c1	ZINC000853601217	FE	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@H]2CC(=O)N(CN3CCC[C@H](C(=O)NC(C)C)C3)C2)c1	ZINC000853601217	FE	On-Demand	Anodyne	SLC6A1	40	37
COCCn1cnn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853601231	ED	On-Demand	Anodyne	SLC6A1	109	35
COc1cc2c(cc1OC)N(CN1CCC[C@@H](C(=O)NC(C)C)C1)C(=O)C2=O	ZINC000853601249	GD	On-Demand	Anodyne	CASP7	51	35
Cn1ncc2c(=O)n(CN3CC[C@@H]3c3ccc(Br)cc3)nnc21	ZINC000853601256	GD	On-Demand	Anodyne	Q9M629_MAIZE	59	36
Cn1ncc2c(=O)n(CN3CC[C@H]3c3ccc(Br)cc3)nnc21	ZINC000853601258	GD	On-Demand	Anodyne	Q9M629_MAIZE	59	36
Cc1ccccc1[C@@H]1CC(=O)N(CN2CCC[C@@H](C(=O)NC(C)C)C2)C1	ZINC000853601282	FF	On-Demand	Anodyne	SLC6A1	115	38
COc1ccccc1-c1nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c(=S)o1	ZINC000853601318	GG	On-Demand	Anodyne	SLC6A1	67	37
COc1cc(CN2CCC[C@@H](C(=O)NC(C)C)C2)c(O)c(C(C)(C)C)c1	ZINC000853601328	FG	On-Demand	Clean	SSTR2	18	40
CON(C)CCNC(=O)NCCCNC(=O)c1ccccc1	ZINC000853601335	DC	On-Demand	Anodyne	DRD4	40	31
CON(C)CCNC(=O)NCCCNC(=O)c1ccccc1	ZINC000853601335	DC	On-Demand	Anodyne	CTSG	16	40
CON(C)CCNC(=O)NCCCNC(=O)c1ccccc1	ZINC000853601335	DC	On-Demand	Anodyne	CTRB1	29	40
CC(C)(C)C(=O)NCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853601341	FF	On-Demand	Reactive	LCK	25	40
CC(C)(C)C(=O)NCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853601341	FF	On-Demand	Reactive	CSNK1D	44	46
Cn1ncc2c(=O)n(CN3C[C@H]4CC[C@@H](C4)C3)nnc21	ZINC000853601364	CC	On-Demand	Anodyne	Q9M629_MAIZE	56	38
C=CCN1CCN(CN2CCC[C@@H](C(=O)NC(C)C)C2)C1=O	ZINC000853601380	DD	On-Demand	Mild	SLC6A1	46	32
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853601434	FF	On-Demand	Anodyne	ACHE	23	40
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853601434	FF	On-Demand	Anodyne	SIGMAR1	51	47
Cc1cccc2c1OCC[C@@H]2NC(=O)NC/C=C/CO	ZINC000853601492	CD	On-Demand	Anodyne	LUXR	50	32
Cc1cccc2c1OCC[C@@H]2NC(=O)NC/C=C/CO	ZINC000853601492	CD	On-Demand	Anodyne	TRAR	41	32
Cc1cccc2c1OCC[C@@H]2NC(=O)NC/C=C\CO	ZINC000853601493	CD	On-Demand	Anodyne	LUXR	50	32
Cc1cccc2c1OCC[C@@H]2NC(=O)NC/C=C\CO	ZINC000853601493	CD	On-Demand	Anodyne	TRAR	41	32
O=C1C(=O)N(CN2C[C@H]3CC[C@@H](C3)C2)c2ccc(Br)cc21	ZINC000853601496	EF	On-Demand	Anodyne	ALDH1A1	29	50
O=C1C(=O)N(CN2C[C@H]3CC[C@@H](C3)C2)c2ccc(Br)cc21	ZINC000853601496	EF	On-Demand	Anodyne	CASP7	41	38
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853601545	FF	On-Demand	Anodyne	L3MBTL3	59	38
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853601546	FF	On-Demand	Anodyne	L3MBTL3	59	38
COc1cc(CN2CCC[C@H](C(=O)NC(C)C)C2)c(O)cc1C	ZINC000853601598	DE	On-Demand	Clean	SLC6A1	89	38
O=C1N(CN2C[C@H]3CC[C@@H](C3)C2)CCN1c1ccccc1	ZINC000853601689	CF	On-Demand	Anodyne	DRD3	15	56
Cc1ccn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c(=O)c1C#N	ZINC000853601699	DD	On-Demand	Mild	SLC6A1	84	36
COc1cccc([C@H]2CC(=O)N(CN3CCC[C@@H](C(=O)NC(C)C)C3)C2)c1	ZINC000853601715	FE	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@H]2CC(=O)N(CN3CCC[C@@H](C(=O)NC(C)C)C3)C2)c1	ZINC000853601715	FE	On-Demand	Anodyne	SLC6A1	40	37
COC(=O)c1nn(CN2CCNC(=O)[C@@H]2c2cccc(C)c2)c2ccccc12	ZINC000853601749	GE	On-Demand	Anodyne	ELANE	18	50
COC(=O)c1nn(CN2CCNC(=O)[C@H]2c2cccc(C)c2)c2ccccc12	ZINC000853601752	GE	On-Demand	Anodyne	ELANE	18	50
CCn1c(-c2ccccc2)nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853601823	GG	On-Demand	Anodyne	SLC6A1	107	35
CCn1c(-c2ccccc2)nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853601823	GG	On-Demand	Anodyne	PDE8B	15	40
COc1ccc(-c2nn(CN3C[C@H]4CC[C@@H](C4)C3)c(=O)c3ccccc23)cc1	ZINC000853601824	GH	On-Demand	Anodyne	HRH1	22	42
COc1ccc(-c2nn(CN3C[C@H]4CC[C@@H](C4)C3)c(=O)c3ccccc23)cc1	ZINC000853601824	GH	On-Demand	Anodyne	AXL	22	41
COc1ccc(-c2nn(CN3C[C@H]4CC[C@@H](C4)C3)c(=O)c3ccccc23)cc1	ZINC000853601824	GH	On-Demand	Anodyne	MERTK	22	41
Cc1cc(C)c2c(c1)N(CN1CCC[C@H](C(=O)NC(C)C)C1)C(=O)C2=O	ZINC000853601864	FE	On-Demand	Anodyne	EPHX2	22	42
Cc1cc(C)c(O)c(CN2CCC[C@H](C(=O)NC(C)C)C2)c1	ZINC000853601881	DF	On-Demand	Clean	SLC6A1	75	35
Cc1cc(C)c(O)c(CN2CCC[C@H](C(=O)NC(C)C)C2)c1	ZINC000853601881	DF	On-Demand	Clean	EPHX2	15	41
COc1ccc(-n2ccn(CN3CCC[C@H](C(=O)NC(C)C)C3)c2=S)cc1	ZINC000853601906	GG	On-Demand	Anodyne	SLC6A1	42	33
Cc1ccc(-c2cnn(CN3CCC[C@H](C(=O)NC(C)C)C3)c2)cc1	ZINC000853601937	EG	On-Demand	Anodyne	SLC6A1	45	36
COc1ccccc1N1CC[C@@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601938	ED	On-Demand	Anodyne	HTR1A	73	46
COc1ccccc1N1CC[C@@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601938	ED	On-Demand	Anodyne	DRD2	57	46
COc1ccccc1N1CC[C@@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601938	ED	On-Demand	Anodyne	DRD4	35	42
COc1ccccc1N1CC[C@@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601938	ED	On-Demand	Anodyne	ADRA1D	53	41
COc1ccccc1N1CC[C@@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601938	ED	On-Demand	Anodyne	ADRA1A	49	41
COc1ccccc1N1CC[C@@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601938	ED	On-Demand	Anodyne	DRD3	62	42
COc1ccccc1N1CC[C@@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601938	ED	On-Demand	Anodyne	HTR7	48	42
COc1ccccc1N1CC[C@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601939	ED	On-Demand	Anodyne	HTR1A	73	46
COc1ccccc1N1CC[C@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601939	ED	On-Demand	Anodyne	DRD2	57	46
COc1ccccc1N1CC[C@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601939	ED	On-Demand	Anodyne	DRD4	35	42
COc1ccccc1N1CC[C@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601939	ED	On-Demand	Anodyne	ADRA1D	53	41
COc1ccccc1N1CC[C@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601939	ED	On-Demand	Anodyne	ADRA1A	49	41
COc1ccccc1N1CC[C@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601939	ED	On-Demand	Anodyne	DRD3	62	42
COc1ccccc1N1CC[C@H](CNC(=O)NCCN(C)OC)C1	ZINC000853601939	ED	On-Demand	Anodyne	HTR7	48	42
O=C1C(=O)N(CN2CCc3nccnc3C2)c2ccccc21	ZINC000853601947	CD	On-Demand	Anodyne	ALDH1A1	61	46
O=C1C(=O)N(CN2CCc3nccnc3C2)c2ccccc21	ZINC000853601947	CD	On-Demand	Anodyne	ALDH3A1	43	53
O=C1C(=O)N(CN2CCc3nccnc3C2)c2ccccc21	ZINC000853601947	CD	On-Demand	Anodyne	CES1	17	44
O=C1C(=O)N(CN2CCc3nccnc3C2)c2ccc(Br)cc21	ZINC000853601954	FD	On-Demand	Anodyne	ALDH1A1	24	48
COCC1(NC(=O)N[C@H]2CCOc3c(C)cccc32)CCCC1	ZINC000853601958	DG	On-Demand	Anodyne	TRAR	40	34
CCN1CC[C@H](N(CC)C(=O)N[C@H]2CCOc3c(C)cccc32)C1	ZINC000853602002	EF	On-Demand	Anodyne	CCR5	15	40
CCN1CC[C@@H](N(CC)C(=O)N[C@H]2CCOc3c(C)cccc32)C1	ZINC000853602003	EF	On-Demand	Anodyne	CCR5	15	40
O=C(NCCCNC(=O)c1ccccc1)NCCc1nnc(S)n1C1CC1	ZINC000853602096	GD	On-Demand	Anodyne	PLD1	45	34
O=C(NCCCNC(=O)c1ccccc1)NCCc1nnc(S)n1C1CC1	ZINC000853602096	GD	On-Demand	Anodyne	PLD2	41	34
Cc1ccccc1[C@@]1(C)NC(=O)N(CN2CCC[C@@H](C(=O)NC(C)C)C2)C1=O	ZINC000853602216	GD	On-Demand	Anodyne	SLC6A1	73	36
COc1cc(CN2CCC[C@@H](C(=O)NC(C)C)C2)c(O)cc1C	ZINC000853602217	DE	On-Demand	Clean	SLC6A1	89	38
COc1ccc(-c2nnn(CN3CCC[C@@H](C(=O)NC(C)C)C3)n2)cc1OC	ZINC000853602282	GD	On-Demand	Anodyne	STK17B	42	39
COc1ccc(-c2nnn(CN3CCC[C@@H](C(=O)NC(C)C)C3)n2)cc1OC	ZINC000853602282	GD	On-Demand	Anodyne	SCARB1	44	54
COCCn1cnn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853602378	ED	On-Demand	Anodyne	SLC6A1	109	35
COc1cc2c(cc1OC)N(CN1CCC[C@H](C(=O)NC(C)C)C1)C(=O)C2=O	ZINC000853602390	GD	On-Demand	Anodyne	CASP7	51	35
Cc1ccccc1[C@@H]1CC(=O)N(CN2CCC[C@H](C(=O)NC(C)C)C2)C1	ZINC000853602408	FF	On-Demand	Anodyne	SLC6A1	115	38
COCCN(CCF)C(=O)NCCCNC(=O)c1ccccc1	ZINC000853602410	ED	On-Demand	Anodyne	DRD3	28	42
O=C(NCCCNC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853602411	FD	On-Demand	Anodyne	PLD1	48	34
O=C(NCCCNC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853602411	FD	On-Demand	Anodyne	PLD2	46	34
COc1ccccc1-c1nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c(=S)o1	ZINC000853602428	GG	On-Demand	Anodyne	SLC6A1	67	37
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602429	GF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602429	GF	On-Demand	Anodyne	DRD2	54	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602429	GF	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602429	GF	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602429	GF	On-Demand	Anodyne	DRD3	57	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602429	GF	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602430	GF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602430	GF	On-Demand	Anodyne	DRD2	54	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602430	GF	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602430	GF	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602430	GF	On-Demand	Anodyne	DRD3	57	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602430	GF	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602431	GF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602431	GF	On-Demand	Anodyne	DRD2	54	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602431	GF	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602431	GF	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602431	GF	On-Demand	Anodyne	DRD3	57	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853602431	GF	On-Demand	Anodyne	HTR7	43	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602432	GF	On-Demand	Anodyne	HTR1A	64	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602432	GF	On-Demand	Anodyne	DRD2	54	43
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602432	GF	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602432	GF	On-Demand	Anodyne	ADRA1D	43	35
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602432	GF	On-Demand	Anodyne	DRD3	57	41
COc1ccccc1N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853602432	GF	On-Demand	Anodyne	HTR7	43	41
COc1cc(CN2CCC[C@H](C(=O)NC(C)C)C2)c(O)c(C(C)(C)C)c1	ZINC000853602439	FG	On-Demand	Clean	SSTR2	18	40
C=CCc1cc(OC)cc(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1O	ZINC000853602475	EF	On-Demand	Mild	SLC6A1	55	34
CC[C@H](C)N(CC)C(=O)N[C@H]1CCOc2c(C)cccc21	ZINC000853602486	CH	On-Demand	Anodyne	TRAR	49	30
CC[C@H](C)N(CC)C(=O)N[C@H]1CCOc2c(C)cccc21	ZINC000853602486	CH	On-Demand	Anodyne	LASR	40	30
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCC(c2ccon2)CC1	ZINC000853602496	EG	On-Demand	Anodyne	SMO	37	41
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853602497	DD	On-Demand	Anodyne	GALR1	48	38
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853602497	DD	On-Demand	Anodyne	GHRL	40	33
COC(=O)c1ccc2c(cnn2CN2CCC[C@@H](C(=O)NC(C)C)C2)c1	ZINC000853602536	FE	On-Demand	Anodyne	SLC6A1	59	32
COCCN(CCF)C(=O)NCCNC(=O)c1cccc(Br)c1	ZINC000853602547	GD	On-Demand	Anodyne	DRD4	44	33
Cc1cc(-c2nnn(CN3CCC[C@@H](C(=O)NC(C)C)C3)n2)ccc1F	ZINC000853602581	FD	On-Demand	Anodyne	SLC6A1	73	33
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853602741	FE	On-Demand	Mild	HTR1A	60	43
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853602741	FE	On-Demand	Mild	DRD2	47	43
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853602741	FE	On-Demand	Mild	DRD4	25	40
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853602741	FE	On-Demand	Mild	DRD3	53	39
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853602741	FE	On-Demand	Mild	ACKR3	60	31
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000853602750	FE	On-Demand	Mild	HTR1A	60	43
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000853602750	FE	On-Demand	Mild	DRD2	47	43
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000853602750	FE	On-Demand	Mild	DRD4	25	40
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000853602750	FE	On-Demand	Mild	DRD3	53	39
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2ccccc2OC)C1	ZINC000853602750	FE	On-Demand	Mild	ACKR3	60	31
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	HTR1A	77	44
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	DRD2	69	44
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	DRD4	51	44
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	ADRA1D	67	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	ADRA1A	62	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	ADRA1B	53	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	DRD3	73	44
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	HTR7	53	44
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	CCR3	50	38
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	CACNA1I	76	36
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602770	GH	On-Demand	Reactive	ACKR3	44	30
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	HTR1A	77	44
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	DRD2	69	44
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	DRD4	51	44
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	ADRA1D	67	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	ADRA1A	62	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	ADRA1B	53	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	DRD3	73	44
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	HTR7	53	44
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	CCR3	50	38
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	CACNA1I	76	36
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853602775	GH	On-Demand	Reactive	ACKR3	44	30
Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853602830	FE	On-Demand	Mild	LGMN	40	35
Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853602830	FE	On-Demand	Mild	MCHR1	28	43
Cc1cccc2c1OCC[C@@H]2NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853602837	GF	On-Demand	Anodyne	SIGMAR1	16	40
Cc1cccc2c1OCC[C@@H]2NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853602837	GF	On-Demand	Anodyne	BDKRB1	34	41
Cc1cccc2c1OCC[C@@H]2NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853602837	GF	On-Demand	Anodyne	MCHR1	18	43
Cc1cccc2c1OCC[C@@H]2NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853602841	GF	On-Demand	Anodyne	SIGMAR1	16	40
Cc1cccc2c1OCC[C@@H]2NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853602841	GF	On-Demand	Anodyne	BDKRB1	34	41
Cc1cccc2c1OCC[C@@H]2NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853602841	GF	On-Demand	Anodyne	MCHR1	18	43
COC(=O)c1ccc(CNC(=O)N[C@H]2CCOc3c(C)cccc32)c(F)c1	ZINC000853602858	FG	On-Demand	Anodyne	BDKRB1	28	41
CON(C)CCNC(=O)NCCNC(=O)c1cccc(Br)c1	ZINC000853602887	FC	On-Demand	Anodyne	DRD4	44	34
CCn1c(-c2ccccc2)nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853602904	GG	On-Demand	Anodyne	SLC6A1	107	35
CCn1c(-c2ccccc2)nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853602904	GG	On-Demand	Anodyne	PDE8B	15	40
O=c1c2ccccc2sn1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853602972	CF	On-Demand	Anodyne	CASP3	25	40
C#CCCN(CCOC)C(=O)NCC1(c2ccccc2OC)CC1	ZINC000853602983	EE	On-Demand	Mild	KCNA3	45	37
COc1ccccc1-n1cnn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603008	GF	On-Demand	Anodyne	HTR1A	44	42
COc1ccccc1-n1cnn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603008	GF	On-Demand	Anodyne	DRD2	30	42
COc1ccccc1-n1cnn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603008	GF	On-Demand	Anodyne	SLC6A1	67	38
CCn1c(-c2ccco2)nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603012	GF	On-Demand	Anodyne	SLC6A1	82	33
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853603056	FH	On-Demand	Anodyne	EPHX2	21	46
Cc1cccc2c1OCC[C@@H]2NC(=O)N(C)CC(=O)N1CCCC1	ZINC000853603087	EE	On-Demand	Anodyne	LUXR	41	30
Cc1cccc2c1OCC[C@@H]2NC(=O)N1[C@H]2CC[C@H]1CC(=O)C2	ZINC000853603112	DF	On-Demand	Anodyne	LUXR	45	31
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853603156	GH	On-Demand	Anodyne	EPHX2	18	40
CNC(=O)c1nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c(=O)c2ccccc12	ZINC000853603192	GC	On-Demand	Anodyne	SLC6A1	66	33
COCCn1c(C)c(C)n(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603211	FE	On-Demand	Anodyne	SLC6A1	56	33
Cc1cccc2c1OCC[C@@H]2NC(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853603309	GJ	On-Demand	Anodyne	KCNH2	41	40
O=c1c2ccccc2c(-c2ccc(F)c(F)c2)nn1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853603312	GI	On-Demand	Anodyne	HRH1	17	40
O=C1C(=O)N(CN2C[C@H]3CC[C@@H](C3)C2)C(=O)N1Cc1ccccc1	ZINC000853603395	ED	On-Demand	Anodyne	CTSG	16	49
Cc1ccccc1[C@@]1(C)NC(=O)N(CN2CCC[C@H](C(=O)NC(C)C)C2)C1=O	ZINC000853603408	GD	On-Demand	Anodyne	SLC6A1	73	36
CC[C@@](C)(NC(=O)N[C@H]1CCOc2c(C)cccc21)C1CC1	ZINC000853603461	DH	On-Demand	Anodyne	LUXR	46	32
CC[C@@](C)(NC(=O)N[C@H]1CCOc2c(C)cccc21)C1CC1	ZINC000853603461	DH	On-Demand	Anodyne	TRAR	40	30
COc1ccc(-c2nnn(CN3C[C@H]4CC[C@@H](C4)C3)n2)cc1OC	ZINC000853603467	EE	On-Demand	Anodyne	SCARB1	26	43
COc1ccc(-c2nnn(CN3CCC[C@H](C(=O)NC(C)C)C3)n2)cc1OC	ZINC000853603486	GD	On-Demand	Anodyne	STK17B	42	39
COc1ccc(-c2nnn(CN3CCC[C@H](C(=O)NC(C)C)C3)n2)cc1OC	ZINC000853603486	GD	On-Demand	Anodyne	SCARB1	44	54
O=C(NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)N[C@H]1C=CCC1	ZINC000853603510	GG	On-Demand	Anodyne	EPHX2	20	43
O=C(NC[C@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)N[C@@H]1C=CCC1	ZINC000853603511	GG	On-Demand	Anodyne	EPHX2	20	43
O=C(NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)N[C@H]1C=CCC1	ZINC000853603513	GG	On-Demand	Anodyne	EPHX2	20	43
O=C(NC[C@@H](c1ccc(C(F)(F)F)cc1)N1CCOCC1)N[C@@H]1C=CCC1	ZINC000853603515	GG	On-Demand	Anodyne	EPHX2	20	43
C=CCn1c(-c2ccco2)nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603530	GG	On-Demand	Mild	SLC6A1	90	35
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	HTR1A	67	45
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	DRD2	53	45
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	DRD4	33	43
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	ADRA1D	59	38
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	ADRA1A	54	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	ADRA1B	45	38
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	DRD3	59	43
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	HTR7	45	43
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603532	FG	On-Demand	Reactive	ACKR3	44	30
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	HTR1A	67	45
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	DRD2	53	45
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	DRD4	33	43
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	ADRA1D	59	38
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	ADRA1A	54	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	ADRA1B	45	38
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	DRD3	59	43
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	HTR7	45	43
COc1ccccc1N1CC[C@H](CNC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853603535	FG	On-Demand	Reactive	ACKR3	44	30
COC(=O)c1nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c2ccccc12	ZINC000853603536	FE	On-Demand	Anodyne	SLC6A1	96	35
COC(=O)c1nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c2ccccc12	ZINC000853603536	FE	On-Demand	Anodyne	HTR4	48	40
C=CCc1cc(OC)cc(CN2CCC[C@H](C(=O)NC(C)C)C2)c1O	ZINC000853603548	EF	On-Demand	Mild	SLC6A1	55	34
Cc1onc2c(=O)n(CN3C[C@H]4CC[C@@H](C4)C3)nc(-c3ccccc3)c12	ZINC000853603553	FG	On-Demand	Anodyne	GRM7	65	35
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853603561	EF	On-Demand	Anodyne	CPT1A	74	38
Cc1cccc2c1OCC[C@@H]2NC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853603564	EF	On-Demand	Anodyne	CPT1A	74	38
COC(=O)c1ccc2c(cnn2CN2CCC[C@H](C(=O)NC(C)C)C2)c1	ZINC000853603572	FE	On-Demand	Anodyne	SLC6A1	59	32
CCn1c(-c2ccccn2)nn(CN2CCC[C@@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603748	GF	On-Demand	Anodyne	SLC6A1	57	32
Cc1cc(-c2nnn(CN3CCC[C@H](C(=O)NC(C)C)C3)n2)ccc1F	ZINC000853603775	FD	On-Demand	Anodyne	SLC6A1	73	33
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1CCc2nccnc2C1	ZINC000853603803	EC	On-Demand	Anodyne	GHRL	40	33
Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853603847	FE	On-Demand	Mild	LGMN	40	35
Cc1nnc(-c2cccc(C#N)c2)n1CN1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853603847	FE	On-Demand	Mild	MCHR1	28	43
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	HTR1A	79	45
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	DRD2	65	45
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	DRD4	45	44
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	ADRA1D	66	40
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	HTR2A	21	41
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	ADRA1A	63	40
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	ADRA1B	51	39
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	DRD3	73	44
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	HTR7	53	41
COc1ccccc1N1CC[C@@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603848	FG	On-Demand	Reactive	ACKR3	58	32
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	HTR1A	79	45
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	DRD2	65	45
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	DRD4	45	44
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	ADRA1D	66	40
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	HTR2A	21	41
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	ADRA1A	63	40
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	ADRA1B	51	39
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	DRD3	73	44
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	HTR7	53	41
COc1ccccc1N1CC[C@H](CNC(=O)NNc2cc(F)ccc2C)C1	ZINC000853603849	FG	On-Demand	Reactive	ACKR3	58	32
CCn1c(-c2ccccn2)nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603861	GF	On-Demand	Anodyne	SLC6A1	57	32
O=C(NCCCNC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853603862	FD	On-Demand	Anodyne	PLD1	49	34
O=C(NCCCNC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853603862	FD	On-Demand	Anodyne	PLD2	45	34
O=C(NCCCNC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853603862	FD	On-Demand	Anodyne	L3MBTL3	17	40
O=C(NCCCNC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853603863	FD	On-Demand	Anodyne	PLD1	49	34
O=C(NCCCNC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853603863	FD	On-Demand	Anodyne	PLD2	45	34
O=C(NCCCNC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853603863	FD	On-Demand	Anodyne	L3MBTL3	17	40
COc1ccccc1N1CC[C@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603889	GD	On-Demand	Anodyne	HTR1A	66	43
COc1ccccc1N1CC[C@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603889	GD	On-Demand	Anodyne	DRD2	49	42
COc1ccccc1N1CC[C@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603889	GD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603889	GD	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603889	GD	On-Demand	Anodyne	HTR7	45	38
COc1ccccc1N1CC[C@@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603891	GD	On-Demand	Anodyne	HTR1A	66	43
COc1ccccc1N1CC[C@@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603891	GD	On-Demand	Anodyne	DRD2	49	42
COc1ccccc1N1CC[C@@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603891	GD	On-Demand	Anodyne	DRD4	31	41
COc1ccccc1N1CC[C@@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603891	GD	On-Demand	Anodyne	DRD3	60	39
COc1ccccc1N1CC[C@@H](CNC(=O)NCCc2nnc(S)n2C)C1	ZINC000853603891	GD	On-Demand	Anodyne	HTR7	45	38
O=C1O[C@]2(CN3CCC2CC3)CN1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853603896	DD	On-Demand	Anodyne	CHRNA7	19	61
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1C[C@H]2CC[C@@H](C2)C1	ZINC000853603900	DD	On-Demand	Anodyne	CHRNA7	19	61
COc1ccccc1-n1cnn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603906	GF	On-Demand	Anodyne	HTR1A	44	42
COc1ccccc1-n1cnn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603906	GF	On-Demand	Anodyne	DRD2	30	42
COc1ccccc1-n1cnn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603906	GF	On-Demand	Anodyne	SLC6A1	67	38
CCn1c(-c2ccco2)nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853603919	GF	On-Demand	Anodyne	SLC6A1	82	33
C#CCCN(CCOC)C(=O)NCCCNC(=O)c1ccccc1	ZINC000853603951	ED	On-Demand	Mild	DRD3	26	42
CNC(=O)c1nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c(=O)c2ccccc12	ZINC000853603997	GC	On-Demand	Anodyne	SLC6A1	66	33
COCCn1c(C)c(C)n(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853604011	FE	On-Demand	Anodyne	SLC6A1	56	33
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCCNC(=O)c1ccccc1	ZINC000853604014	FD	On-Demand	Mild	ECR	43	35
C#CCCN(CCOC)C(=O)NCCNC(=O)c1cccc(Br)c1	ZINC000853604026	GD	On-Demand	Mild	DRD4	43	33
C=CCn1c(-c2ccco2)nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c1=S	ZINC000853604064	GG	On-Demand	Mild	SLC6A1	90	35
COC(=O)c1nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c2ccccc12	ZINC000853604068	FE	On-Demand	Anodyne	SLC6A1	96	35
COC(=O)c1nn(CN2CCC[C@H](C(=O)NC(C)C)C2)c2ccccc12	ZINC000853604068	FE	On-Demand	Anodyne	HTR4	48	40
Cc1cccc2c1OCC[C@@H]2NC(=O)NC1CC(CO)C1	ZINC000853604225	CD	On-Demand	Anodyne	LUXR	43	32
COc1cccc(OC)c1CNC(=O)NCCN1CCO[C@H](C)C1	ZINC000853604363	ED	On-Demand	Anodyne	HTR1A	25	42
COc1cccc(OC)c1CNC(=O)NCCN1CCO[C@H](C)C1	ZINC000853604363	ED	On-Demand	Anodyne	DRD4	43	32
COc1cccc(OC)c1CNC(=O)NCCN1CCO[C@H](C)C1	ZINC000853604363	ED	On-Demand	Anodyne	DRD3	40	38
COc1cccc(OC)c1CNC(=O)NCCN1CCO[C@@H](C)C1	ZINC000853604364	ED	On-Demand	Anodyne	HTR1A	25	42
COc1cccc(OC)c1CNC(=O)NCCN1CCO[C@@H](C)C1	ZINC000853604364	ED	On-Demand	Anodyne	DRD4	43	32
COc1cccc(OC)c1CNC(=O)NCCN1CCO[C@@H](C)C1	ZINC000853604364	ED	On-Demand	Anodyne	DRD3	40	38
COc1ccc(N2CC[C@H](NC(=O)NCCN3CCO[C@H](C)C3)C2)cc1	ZINC000853604397	FD	On-Demand	Clean	DRD4	45	36
COc1ccc(N2CC[C@H](NC(=O)NCCN3CCO[C@@H](C)C3)C2)cc1	ZINC000853604398	FD	On-Demand	Clean	DRD4	45	36
COc1cccc([C@]2(C)CCN(C(=O)NCCN3CCO[C@@H](C)C3)C2)c1	ZINC000853604434	FE	On-Demand	Anodyne	DRD4	49	37
COc1cccc([C@]2(C)CCN(C(=O)NCCN3CCO[C@H](C)C3)C2)c1	ZINC000853604435	FE	On-Demand	Anodyne	DRD4	49	37
COc1ccc(-c2nnn(CN(CCC3CC3)CC3CC3)n2)cc1OC	ZINC000853604482	FF	On-Demand	Anodyne	SCARB1	22	43
O=C1C(=O)N(CN(CCC2CC2)CC2CC2)C(=O)N1Cc1ccccc1	ZINC000853604496	FE	On-Demand	Anodyne	ACHE	17	41
CNC(=O)c1nn(CN2CCCC[C@H]2CC2CCC2)c(=O)c2ccccc12	ZINC000853604515	FF	On-Demand	Anodyne	HRH1	45	41
CNC(=O)c1nn(CN2CCCC[C@@H]2CC2CCC2)c(=O)c2ccccc12	ZINC000853604517	FF	On-Demand	Anodyne	HRH1	45	41
C[C@@H]1CN(CCNC(=O)NCc2cccnc2N2CCCC2)CCO1	ZINC000853604537	ED	On-Demand	Anodyne	SCN10A	16	40
C[C@@H]1CN(CCNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)CCO1	ZINC000853604552	EC	On-Demand	Anodyne	PYGL	32	44
C[C@@H]1CN(CCNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)CCO1	ZINC000853604552	EC	On-Demand	Anodyne	PYGM	28	44
C[C@@H]1CN(CCNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)CCO1	ZINC000853604554	EC	On-Demand	Anodyne	PYGL	32	44
C[C@@H]1CN(CCNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)CCO1	ZINC000853604554	EC	On-Demand	Anodyne	PYGM	28	44
CON(C)CCNC(=O)N[C@@H](C)c1ccc(OCCC(C)C)cc1	ZINC000853604578	EF	On-Demand	Anodyne	ACACA	21	41
CON(C)CCNC(=O)N[C@@H](C)c1ccc(OCCC(C)C)cc1	ZINC000853604578	EF	On-Demand	Anodyne	ACACB	21	41
CON(C)CCNC(=O)N[C@H](C)c1ccc(OCCC(C)C)cc1	ZINC000853604579	EF	On-Demand	Anodyne	ACACA	21	41
CON(C)CCNC(=O)N[C@H](C)c1ccc(OCCC(C)C)cc1	ZINC000853604579	EF	On-Demand	Anodyne	ACACB	21	41
C[C@@H]1CN(CCNC(=O)NCCc2ccc(C#N)cc2)CCO1	ZINC000853604611	DD	On-Demand	Mild	GPBAR1	31	41
O=C1C(=O)N(CN(CCC2CC2)CC2CC2)c2ccccc21	ZINC000853604692	CF	On-Demand	Anodyne	ALDH1A1	60	43
O=C1C(=O)N(CN(CCC2CC2)CC2CC2)c2ccccc21	ZINC000853604692	CF	On-Demand	Anodyne	ALDH3A1	40	42
O=C1C(=O)N(CN(CCC2CC2)CC2CC2)c2ccccc21	ZINC000853604692	CF	On-Demand	Anodyne	CES1	17	47
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853604782	CE	On-Demand	Anodyne	ALDH1A1	64	46
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853604782	CE	On-Demand	Anodyne	ALDH3A1	44	47
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853604782	CE	On-Demand	Anodyne	CES1	19	45
COC[C@H](NC(=O)NCCN1CCO[C@H](C)C1)c1cccc(OC)c1	ZINC000853604816	FD	On-Demand	Anodyne	DRD4	49	37
COC[C@H](NC(=O)NCCN1CCO[C@H](C)C1)c1cccc(OC)c1	ZINC000853604816	FD	On-Demand	Anodyne	CASR	19	41
COC[C@@H](NC(=O)NCCN1CCO[C@H](C)C1)c1cccc(OC)c1	ZINC000853604818	FD	On-Demand	Anodyne	DRD4	49	37
COC[C@@H](NC(=O)NCCN1CCO[C@H](C)C1)c1cccc(OC)c1	ZINC000853604818	FD	On-Demand	Anodyne	CASR	19	41
COC[C@@H](NC(=O)NCCN1CCO[C@@H](C)C1)c1cccc(OC)c1	ZINC000853604820	FD	On-Demand	Anodyne	DRD4	49	37
COC[C@@H](NC(=O)NCCN1CCO[C@@H](C)C1)c1cccc(OC)c1	ZINC000853604820	FD	On-Demand	Anodyne	CASR	19	41
COC[C@H](NC(=O)NCCN1CCO[C@@H](C)C1)c1cccc(OC)c1	ZINC000853604822	FD	On-Demand	Anodyne	DRD4	49	37
COC[C@H](NC(=O)NCCN1CCO[C@@H](C)C1)c1cccc(OC)c1	ZINC000853604822	FD	On-Demand	Anodyne	CASR	19	41
COc1ccc(-c2nnn(CN3[C@H]4CC[C@H]3CC(C)C4)n2)cc1OC	ZINC000853604841	EF	On-Demand	Anodyne	SCARB1	26	44
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853604870	EE	On-Demand	Anodyne	GALR1	47	37
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853604870	EE	On-Demand	Anodyne	GHRL	52	34
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853604871	EE	On-Demand	Anodyne	GALR1	47	37
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853604871	EE	On-Demand	Anodyne	GHRL	52	34
Cc1onc2c(=O)n(CN(CCC3CC3)CC3CC3)nc(-c3ccccc3)c12	ZINC000853604897	GH	On-Demand	Anodyne	GRM7	40	31
C[C@@H]1CN(CCNC(=O)NC[C@@H]2CCN2Cc2ccccc2)CCO1	ZINC000853605032	ED	On-Demand	Anodyne	SIGMAR1	28	42
C[C@@H]1CN(CCNC(=O)NC[C@H]2CCN2Cc2ccccc2)CCO1	ZINC000853605036	ED	On-Demand	Anodyne	SIGMAR1	28	42
CON(C)CCNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000853605216	GC	On-Demand	Anodyne	DRD4	24	40
CON(C)CCNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000853605216	GC	On-Demand	Anodyne	CCR1	23	40
CON(C)CCNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1	ZINC000853605216	GC	On-Demand	Anodyne	SSTR1	35	45
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853605218	FF	On-Demand	Bother	SLC27A4	51	33
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853605220	FF	On-Demand	Bother	SLC27A4	51	33
C[C@@H]1CN(CCNC(=O)NCCc2ccnc3ccccc23)CCO1	ZINC000853605237	ED	On-Demand	Anodyne	HNMT	48	36
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCCC[C@H]1CC1CCC1	ZINC000853605395	EF	On-Demand	Anodyne	CHRNA7	17	55
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCCC[C@H]1CC1CCC1	ZINC000853605396	EF	On-Demand	Anodyne	CHRNA7	17	55
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCCC[C@@H]1CC1CCC1	ZINC000853605397	EF	On-Demand	Anodyne	CHRNA7	17	55
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCCC[C@@H]1CC1CCC1	ZINC000853605398	EF	On-Demand	Anodyne	CHRNA7	17	55
CC1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccc(F)c(F)c2)c2ccccc2c1=O	ZINC000853605451	GJ	On-Demand	Anodyne	HRH1	23	41
COc1ccc(-c2nn(CN3[C@H]4CC[C@H]3CC(C)C4)c(=O)c3ccccc23)cc1	ZINC000853605528	GI	On-Demand	Anodyne	HRH1	22	42
COc1ccc(-c2nn(CN3[C@H]4CC[C@H]3CC(C)C4)c(=O)c3ccccc23)cc1	ZINC000853605528	GI	On-Demand	Anodyne	AXL	22	41
COc1ccc(-c2nn(CN3[C@H]4CC[C@H]3CC(C)C4)c(=O)c3ccccc23)cc1	ZINC000853605528	GI	On-Demand	Anodyne	MERTK	22	41
C[C@@H]1CN(CCNC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)CCO1	ZINC000853605595	FD	On-Demand	Anodyne	OPRM1	19	41
C[C@@H]1CN(CCNC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)CCO1	ZINC000853605595	FD	On-Demand	Anodyne	OPRD1	15	40
C[C@@H]1CN(CCNC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)CCO1	ZINC000853605596	FD	On-Demand	Anodyne	OPRM1	19	41
C[C@@H]1CN(CCNC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)CCO1	ZINC000853605596	FD	On-Demand	Anodyne	OPRD1	15	40
C[C@@H]1CN(CCNC(=O)NC[C@H](O)c2cccc3ccccc23)CCO1	ZINC000853605610	FD	On-Demand	Anodyne	PTGDS	37	40
C[C@@H]1CN(CCNC(=O)NC[C@@H](O)c2cccc3ccccc23)CCO1	ZINC000853605611	FD	On-Demand	Anodyne	PTGDS	37	40
O=C1[C@H](c2ccc([N+](=O)[O-])cc2)CCN1CN(CCC1CC1)CC1CC1	ZINC000853605648	FG	On-Demand	Bother	SLC27A4	43	34
O=C1[C@@H](c2ccc([N+](=O)[O-])cc2)CCN1CN(CCC1CC1)CC1CC1	ZINC000853605650	FG	On-Demand	Bother	SLC27A4	43	34
C[C@@H]1CN(CCNC(=O)NC(C)(C2CC2)C2CC2)CCO1	ZINC000853605784	CD	On-Demand	Anodyne	CACNA1H	23	40
COc1ccccc1-n1cnn(CN2CCc3nccnc3C2)c1=S	ZINC000853605831	FE	On-Demand	Anodyne	HTR1A	56	38
CC1C[C@@H]2CC[C@H](C1)N2Cn1cnc2c(NC(C)C)ncnc21	ZINC000853605924	DF	On-Demand	Anodyne	ADORA1	19	43
C[C@@H]1CN(CCNC(=O)NCc2ccc(Cl)c(Cl)c2)CCO1	ZINC000853605988	EF	On-Demand	Anodyne	SIGMAR1	15	45
C[C@@H]1CN(CCNC(=O)NCc2ccc(Cl)c(Cl)c2)CCO1	ZINC000853605988	EF	On-Demand	Anodyne	P2RX7	19	43
C[C@@H]1CN(CCNC(=O)NCc2ccc(Cl)c(Cl)c2)CCO1	ZINC000853605988	EF	On-Demand	Anodyne	CCR3	33	54
C[C@@H]1CN(CCNC(=O)NCc2ccc(Cl)c(Cl)c2)CCO1	ZINC000853605988	EF	On-Demand	Anodyne	RPA1	40	30
C[C@@H]1CN(CCNC(=O)NNc2cc(F)cc(Cl)c2)CCO1	ZINC000853605991	ED	On-Demand	Reactive	CACNA1H	27	41
C[C@@H]1CN(CCNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)CCO1	ZINC000853605998	GC	On-Demand	Anodyne	CCR3	22	49
C[C@@H]1CN(CCNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)CCO1	ZINC000853606001	GC	On-Demand	Anodyne	CCR3	22	49
CC[C@H](C)NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000853606002	JD	On-Demand	Bother	COLA	43	30
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000853606004	JD	On-Demand	Bother	COLA	43	30
C[C@@H]1CN(CCNC(=O)NCC2CCN(Cc3ccncc3)CC2)CCO1	ZINC000853606025	GD	On-Demand	Anodyne	ACHE	28	44
C[C@@H]1CN(CCNC(=O)NCC2CCN(Cc3ccncc3)CC2)CCO1	ZINC000853606025	GD	On-Demand	Anodyne	HTR4	51	38
C[C@@H]1CN(CCNC(=O)NCC2CCN(Cc3ccncc3)CC2)CCO1	ZINC000853606025	GD	On-Demand	Anodyne	SIGMAR1	17	41
C[C@@H]1CN(CCNC(=O)NCC2CCN(Cc3ccncc3)CC2)CCO1	ZINC000853606025	GD	On-Demand	Anodyne	SSTR5	46	33
C[C@@H]1CN(CCNC(=O)NCC2CCN(Cc3ccncc3)CC2)CCO1	ZINC000853606025	GD	On-Demand	Anodyne	CCR3	36	42
C[C@@H]1CN(CCNC(=O)NCC2CCN(Cc3ccncc3)CC2)CCO1	ZINC000853606025	GD	On-Demand	Anodyne	CACNA1I	67	40
C[C@@H]1CN(CCNC(=O)N2CC[C@H]2c2ccc(F)cc2)CCO1	ZINC000853606059	DE	On-Demand	Anodyne	ADRA1D	17	41
C[C@@H]1CN(CCNC(=O)N2CC[C@H]2c2ccc(F)cc2)CCO1	ZINC000853606059	DE	On-Demand	Anodyne	ADRA1A	28	41
C[C@@H]1CN(CCNC(=O)N2CC[C@H]2c2ccc(F)cc2)CCO1	ZINC000853606059	DE	On-Demand	Anodyne	ADRA1B	19	41
C[C@@H]1CN(CCNC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCO1	ZINC000853606060	DE	On-Demand	Anodyne	ADRA1D	17	41
C[C@@H]1CN(CCNC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCO1	ZINC000853606060	DE	On-Demand	Anodyne	ADRA1A	28	41
C[C@@H]1CN(CCNC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCO1	ZINC000853606060	DE	On-Demand	Anodyne	ADRA1B	19	41
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2cc(Br)ccc21	ZINC000853606261	FG	On-Demand	Anodyne	ALDH1A1	28	48
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2cc(Br)ccc21	ZINC000853606261	FG	On-Demand	Anodyne	CASP7	46	37
CC1C[C@@H]2CC[C@H](C1)N2Cn1nnc2c(cnn2C)c1=O	ZINC000853606316	CC	On-Demand	Anodyne	Q9M629_MAIZE	59	38
O=C1[C@H]2CCN(Cc3ccccc3)C[C@H]2CN1CN1CCc2nccnc2C1	ZINC000853606322	GD	On-Demand	Anodyne	SIGMAR1	34	44
Cc1cc(F)ccc1C[C@@H](C)NC(=O)NCCN1CCO[C@@H](C)C1	ZINC000853606441	EE	On-Demand	Anodyne	CCR3	48	34
Cc1cc(F)ccc1C[C@H](C)NC(=O)NCCN1CCO[C@@H](C)C1	ZINC000853606442	EE	On-Demand	Anodyne	CCR3	48	34
Cc1cc(F)ccc1C[C@@H](C)NC(=O)NCCN1CCO[C@H](C)C1	ZINC000853606443	EE	On-Demand	Anodyne	CCR3	48	34
Cc1cc(F)ccc1C[C@H](C)NC(=O)NCCN1CCO[C@H](C)C1	ZINC000853606444	EE	On-Demand	Anodyne	CCR3	48	34
C[C@@H]1CN(CCNC(=O)NCC2CCN(CC3CC3)CC2)CCO1	ZINC000853606455	ED	On-Demand	Anodyne	CACNA1I	41	33
C[C@@H]1CN(CCNC(=O)N(CCN2CCOCC2)CC2CC2)CCO1	ZINC000853606457	FC	On-Demand	Anodyne	CASR	42	34
C[C@@H]1CN(CCNC(=O)N2CC[C@@H](Oc3ccccc3)C2)CCO1	ZINC000853606549	ED	On-Demand	Anodyne	EPHX2	22	43
Cn1ncc2c(=O)n(CN3CCCC[C@@H]3CC3CCC3)nnc21	ZINC000853606556	DD	On-Demand	Anodyne	Q9M629_MAIZE	52	34
Cn1ncc2c(=O)n(CN3CCCC[C@H]3CC3CCC3)nnc21	ZINC000853606557	DD	On-Demand	Anodyne	Q9M629_MAIZE	52	34
O=C(NCc1ccc(OC2CCCCC2)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853606568	FH	On-Demand	Anodyne	EPHX2	24	44
O=C(NCc1ccc(OC2CCCCC2)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853606569	FH	On-Demand	Anodyne	EPHX2	24	44
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)N[C@H]1C=CCC1	ZINC000853606606	FE	On-Demand	Anodyne	SSTR1	23	41
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)N[C@@H]1C=CCC1	ZINC000853606607	FE	On-Demand	Anodyne	SSTR1	23	41
CC1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000853606637	EE	On-Demand	Anodyne	CTSG	15	46
CC1C[C@@H]2CC[C@H](C1)N2Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853606681	DG	On-Demand	Bother	F2RL3	44	31
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCCN1CCO[C@@H](C)C1	ZINC000853606758	ED	On-Demand	Anodyne	HTR1A	19	41
COc1ccccc1[C@@H]1C[C@H]1NC(=O)NCCN1CCO[C@H](C)C1	ZINC000853606759	ED	On-Demand	Anodyne	HTR1A	19	41
C[C@@H]1CN(CCNC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)CCO1	ZINC000853606835	FE	On-Demand	Anodyne	KCNH2	41	40
Cc1onc2c(=O)n(CN3[C@H]4CC[C@H]3CC(C)C4)nc(-c3ccccc3)c12	ZINC000853606979	FH	On-Demand	Anodyne	GRM7	65	33
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCc2nccnc2C1	ZINC000853606986	EC	On-Demand	Anodyne	CHRNA7	19	53
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCc2nccnc2C1	ZINC000853606988	EC	On-Demand	Anodyne	CHRNA7	19	53
CC1C[C@@H]2CC[C@H](C1)N2Cn1c(=O)n(C)c2ccccc21	ZINC000853607002	CF	On-Demand	Anodyne	HTR4	16	40
CON(C)CCNC(=O)N[C@@H]1CCCOc2ccccc21	ZINC000853607005	CD	On-Demand	Anodyne	BIRC3	40	33
CON(C)CCNC(=O)N[C@H]1CCCOc2ccccc21	ZINC000853607007	CD	On-Demand	Anodyne	BIRC3	40	33
O=C(NNc1nc2ccc(Cl)cc2s1)NC1CCSCC1	ZINC000853607105	EG	On-Demand	Reactive	LCK	26	47
O=C(NNc1nc2ccc(Cl)cc2s1)NC1CCSCC1	ZINC000853607105	EG	On-Demand	Reactive	CSNK1D	31	41
O=C1C(=O)N(CN2CCc3nccnc3C2)c2cc(OC(F)(F)F)ccc21	ZINC000853607227	GD	On-Demand	Anodyne	CHRM5	16	44
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NCc1ncccn1	ZINC000853607242	GD	On-Demand	Anodyne	HTR7	18	42
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NCc1ncccn1	ZINC000853607242	GD	On-Demand	Anodyne	CCR1	30	41
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NCc1ncccn1	ZINC000853607242	GD	On-Demand	Anodyne	AKT3	49	35
O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NCc1ncccn1	ZINC000853607242	GD	On-Demand	Anodyne	SSTR1	21	40
CCOc1ccc(-c2nnn(CN3CCc4nccnc4C3)n2)cc1	ZINC000853607247	ED	On-Demand	Anodyne	CACNA2D2	55	33
O=C(NCc1ccc(OC2CCCCC2)cc1)NCc1ncccn1	ZINC000853607294	EG	On-Demand	Anodyne	EPHX2	23	43
CC1C[C@@H]2CC[C@H](C1)N2CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853607451	DE	On-Demand	Anodyne	CHRNA7	18	62
CC1C[C@@H]2CC[C@H](C1)N2CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853607452	DE	On-Demand	Anodyne	CHRNA7	18	62
C[C@@H]1CN(CCNC(=O)NCc2cc(Cl)cc(Cl)c2)CCO1	ZINC000853607469	EF	On-Demand	Anodyne	CACNA1H	23	45
C[C@@H]1CN(CCNC(=O)NCc2cc(Cl)cc(Cl)c2)CCO1	ZINC000853607469	EF	On-Demand	Anodyne	CACNA1I	50	37
C#CCNC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000853607471	IC	On-Demand	Mild	COLA	48	31
C#CCNC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000853607472	IC	On-Demand	Mild	COLA	48	31
C[C@@H]1CN(CCNC(=O)N[C@H]2CCN(C(C)(C)C)C2)CCO1	ZINC000853607479	DC	On-Demand	Anodyne	CACNA1H	17	44
C[C@@H]1CN(CCNC(=O)N[C@@H]2CCN(C(C)(C)C)C2)CCO1	ZINC000853607481	DC	On-Demand	Anodyne	CACNA1H	17	44
O=C1O[C@@]2(CN3CCC2CC3)CN1CN(CCC1CC1)CC1CC1	ZINC000853607684	EE	On-Demand	Anodyne	CHRNA7	16	56
O=C1O[C@]2(CN3CCC2CC3)CN1CN(CCC1CC1)CC1CC1	ZINC000853607685	EE	On-Demand	Anodyne	CHRNA7	16	56
C[C@@H]1CN(CCNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)CCO1	ZINC000853607777	GD	On-Demand	Anodyne	SLC6A1	57	33
C[C@@H]1CN(CCNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)CCO1	ZINC000853607777	GD	On-Demand	Anodyne	SSTR3	27	42
C[C@@H]1CN(CCNC(=O)NCc2cc(F)ccc2OC(F)F)CCO1	ZINC000853607779	FD	On-Demand	Anodyne	P2RX7	21	40
Cn1ncc2c(=O)n(CN(CCC3CC3)CC3CC3)nnc21	ZINC000853607786	DC	On-Demand	Anodyne	Q9M629_MAIZE	54	36
COc1cccc(C2(NC(=O)NCCN3CCO[C@@H](C)C3)CCC2)c1	ZINC000853607821	EE	On-Demand	Anodyne	DRD4	49	37
COc1cccc(C2(NC(=O)NCCN3CCO[C@H](C)C3)CCC2)c1	ZINC000853607822	EE	On-Demand	Anodyne	DRD4	49	37
C[C@@H]1CN(CCNC(=O)NC[C@H]2CN(C)CCN2Cc2ccccc2)CCO1	ZINC000853607833	GC	On-Demand	Anodyne	SIGMAR1	16	42
C[C@@H]1CN(CCNC(=O)NC[C@@H]2CN(C)CCN2Cc2ccccc2)CCO1	ZINC000853607834	GC	On-Demand	Anodyne	SIGMAR1	16	42
C[C@@H]1CN(CCNC(=O)NCCc2nsc3ccccc23)CCO1	ZINC000853607870	ED	On-Demand	Anodyne	HTR1A	18	41
O=C1C(=O)N(CN2CCC(N3CCOC3=O)CC2)c2ccccc21	ZINC000853608005	ED	On-Demand	Anodyne	ALDH1A1	50	40
O=C1C(=O)N(CN2CCC(N3CCOC3=O)CC2)c2ccccc21	ZINC000853608005	ED	On-Demand	Anodyne	ALDH3A1	43	53
O=C1C(=O)N(CN2CCC(N3CCOC3=O)CC2)c2ccccc21	ZINC000853608005	ED	On-Demand	Anodyne	CES1	15	40
CON(C)CCNC(=O)NCCCNC(=O)c1cccc(Br)c1	ZINC000853608013	GD	On-Demand	Anodyne	DRD4	43	33
COCC[C@@H](C)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853608063	DD	On-Demand	Reactive	CACNA1D	49	33
COCC[C@H](C)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853608064	DD	On-Demand	Reactive	CACNA1D	49	33
Cc1ccc2c(c1Br)CN(Cn1nnc3c(cnn3C)c1=O)C2	ZINC000853608065	GD	On-Demand	Anodyne	Q9M629_MAIZE	51	33
O=C(CC1CCCCC1)NCCNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853608132	GE	On-Demand	Reactive	TBXA2R	16	41
COCC[C@H](C)NC(=O)N[C@H](C(C)C)[C@H](O)c1ccc(Cl)cc1	ZINC000853608142	EG	On-Demand	Anodyne	UTS2	44	35
COCC[C@H](C)NC(=O)N[C@H](C(C)C)[C@@H](O)c1ccc(Cl)cc1	ZINC000853608143	EG	On-Demand	Anodyne	UTS2	44	35
COCC[C@H](C)NC(=O)N[C@@H](C(C)C)[C@@H](O)c1ccc(Cl)cc1	ZINC000853608144	EG	On-Demand	Anodyne	UTS2	44	35
COCC[C@H](C)NC(=O)N[C@@H](C(C)C)[C@H](O)c1ccc(Cl)cc1	ZINC000853608145	EG	On-Demand	Anodyne	UTS2	44	35
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCCCc2ccccc21	ZINC000853608497	EH	On-Demand	Anodyne	BIRC2	42	39
O=C(N[C@@H]1CCCCc2ccccc21)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853608499	EH	On-Demand	Anodyne	BIRC2	42	39
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCCCc2ccccc21	ZINC000853608501	EH	On-Demand	Anodyne	BIRC2	42	39
O=C(N[C@@H]1CCCCc2ccccc21)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853608503	EH	On-Demand	Anodyne	BIRC2	42	39
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1CCC(N2CCOC2=O)CC1	ZINC000853608523	FD	On-Demand	Anodyne	GHRL	47	33
COCC[C@@H](C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853608578	EG	On-Demand	Reactive	CSNK1D	44	47
COCC[C@H](C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853608579	EG	On-Demand	Reactive	CSNK1D	44	47
CON(C)CCNC(=O)N[C@H]1CCCCc2ccccc21	ZINC000853608757	CE	On-Demand	Anodyne	XIAP	24	41
CON(C)CCNC(=O)N[C@H]1CCCCc2ccccc21	ZINC000853608757	CE	On-Demand	Anodyne	BIRC3	34	41
CON(C)CCNC(=O)N[C@H]1CCCCc2ccccc21	ZINC000853608757	CE	On-Demand	Anodyne	BIRC2	51	41
CON(C)CCNC(=O)N[C@@H]1CCCCc2ccccc21	ZINC000853608759	CE	On-Demand	Anodyne	XIAP	24	41
CON(C)CCNC(=O)N[C@@H]1CCCCc2ccccc21	ZINC000853608759	CE	On-Demand	Anodyne	BIRC3	34	41
CON(C)CCNC(=O)N[C@@H]1CCCCc2ccccc21	ZINC000853608759	CE	On-Demand	Anodyne	BIRC2	51	41
CON(C)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000853608849	EF	On-Demand	Anodyne	LTA4H	54	44
CON(C)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000853608849	EF	On-Demand	Anodyne	FAAH	15	43
CON(C)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000853608849	EF	On-Demand	Anodyne	NPY5R	25	43
CON(C)CCNC(=O)NCc1ccc(Oc2ccccc2)cc1	ZINC000853608849	EF	On-Demand	Anodyne	PDS	49	36
CN1CCC[C@H](CNc2cc(F)ncn2)[C@H]1c1ccccc1	ZINC000853608939	DG	On-Demand	Anodyne	CHRNA10	46	34
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000853609062	GG	On-Demand	Anodyne	XIAP	21	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000853609062	GG	On-Demand	Anodyne	BIRC2	40	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000853609064	GG	On-Demand	Anodyne	XIAP	21	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H]2CCCCc3ccccc32)C1	ZINC000853609064	GG	On-Demand	Anodyne	BIRC2	40	37
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000853609065	GG	On-Demand	Anodyne	XIAP	21	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000853609065	GG	On-Demand	Anodyne	BIRC2	40	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000853609066	GG	On-Demand	Anodyne	XIAP	21	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H]2CCCCc3ccccc32)C1	ZINC000853609066	GG	On-Demand	Anodyne	BIRC2	40	37
CON(C)CCNC(=O)N[C@@H](C)Cc1ccc(Cl)cc1Cl	ZINC000853609095	EF	On-Demand	Anodyne	UGCG	17	42
CON(C)CCNC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl	ZINC000853609096	EF	On-Demand	Anodyne	UGCG	17	42
O=C1C(=O)N(CN2CCC3(C=Cc4ccccc4O3)CC2)c2ccccc21	ZINC000853609169	FG	On-Demand	Anodyne	ALDH1A1	41	38
O=C1C(=O)N(CN2CCC3(C=Cc4ccccc4O3)CC2)c2ccccc21	ZINC000853609169	FG	On-Demand	Anodyne	ALDH3A1	40	50
Cn1c(=O)n(CN2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c2ccccc21	ZINC000853609185	GE	On-Demand	Anodyne	OPRL1	15	40
Cn1ncc2c(=O)n(CN3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)nnc21	ZINC000853609319	GC	On-Demand	Anodyne	Q9M629_MAIZE	55	34
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC2(C=Cc3ccccc3O2)CC1	ZINC000853609376	GF	On-Demand	Anodyne	CHRNA7	17	47
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC2(C=Cc3ccccc3O2)CC1	ZINC000853609378	GF	On-Demand	Anodyne	CHRNA7	17	47
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2cc(F)ncn2)C1	ZINC000853609415	EF	On-Demand	Anodyne	PREP	54	41
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2cc(F)ncn2)C1	ZINC000853609418	EF	On-Demand	Anodyne	PREP	54	41
Cn1ncc2c(=O)n(CN3CCOc4cc(Br)ccc4C3)nnc21	ZINC000853609430	GD	On-Demand	Anodyne	Q9M629_MAIZE	63	39
CN(C[C@@H]1CCc2ccccc21)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000853609627	FG	On-Demand	Bother	SSTR1	17	41
O=S1(=O)N=C(Cl)c2ccc(NCc3c(F)cccc3N3CCCC3)cc21	ZINC000853609749	GH	On-Demand	Anodyne	KCNQ2	43	33
CN(C[C@@H]1CCc2ccccc21)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853609763	GH	On-Demand	Bother	SSTR1	18	44
CN(C[C@@H]1CCc2ccccc21)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853609765	GH	On-Demand	Bother	SSTR1	18	44
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC(N2CCOC2=O)CC1	ZINC000853610031	FC	On-Demand	Anodyne	CHRNA7	16	55
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC(N2CCOC2=O)CC1	ZINC000853610033	FC	On-Demand	Anodyne	CHRNA7	16	55
CN(C[C@@H]1CCc2ccccc21)CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000853610039	GF	On-Demand	Anodyne	SIGMAR1	15	41
Cn1ncc2c(=O)n(CN3CCC(N4CCOC4=O)CC3)nnc21	ZINC000853610055	EB	On-Demand	Anodyne	Q9M629_MAIZE	63	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853610143	GD	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853610143	GD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853610145	GD	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853610145	GD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853610146	GD	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853610146	GD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853610147	GD	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853610147	GD	On-Demand	Anodyne	GPR119	40	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCN([C@H]3CCOC3)CC2)CC1	ZINC000853610166	GD	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCN([C@@H]3CCOC3)CC2)CC1	ZINC000853610168	GD	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCn3c(O)nnc3C2)CC1	ZINC000853610174	GD	On-Demand	Anodyne	GPR119	41	39
C[C@@H](CCNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)N(C)C	ZINC000853610185	FE	On-Demand	Anodyne	CHRNA3	24	40
C[C@@H](CCNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)N(C)C	ZINC000853610185	FE	On-Demand	Anodyne	CHRNA4	19	40
C[C@@H](CCNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)N(C)C	ZINC000853610185	FE	On-Demand	Anodyne	CACNA1I	47	33
C[C@@H](CCNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)N(C)C	ZINC000853610185	FE	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@](C)(C3CC3)C2)CC1	ZINC000853610207	GF	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCO[C@@](C)(C3CC3)C2)CC1	ZINC000853610209	GF	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(c3ccco3)CC2)CC1	ZINC000853610246	GH	On-Demand	Anodyne	CACNA1I	47	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(c3ccco3)CC2)CC1	ZINC000853610246	GH	On-Demand	Anodyne	GPR119	45	42
COC(=O)[C@@H]1CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H]1C	ZINC000853610269	GE	On-Demand	Anodyne	CACNA1I	46	33
COC(=O)[C@@H]1CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C[C@@H]1C	ZINC000853610269	GE	On-Demand	Anodyne	GPR119	40	40
C#Cc1cccnc1N1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000853610470	EG	On-Demand	Mild	PREP	55	41
C#Cc1cccnc1N1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000853610472	EG	On-Demand	Mild	PREP	55	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)CC1	ZINC000853610482	GF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)CC1	ZINC000853610482	GF	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CC1	ZINC000853610484	GF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CC1	ZINC000853610484	GF	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC(S(C)(=O)=O)C2)CC1	ZINC000853610515	GD	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC(S(C)(=O)=O)C2)CC1	ZINC000853610515	GD	On-Demand	Anodyne	GPR119	50	44
COC(=O)c1nn(CN2CCC(N3CCOC3=O)CC2)c2ccccc12	ZINC000853610616	FD	On-Demand	Anodyne	HTR4	58	35
CN(C[C@@H]1CCc2ccccc21)CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853610618	FF	On-Demand	Anodyne	GHRL	67	38
CN(C[C@@H]1CCc2ccccc21)CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853610619	FF	On-Demand	Anodyne	GHRL	67	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC(O)(C2CC2)C2CC2)CC1	ZINC000853610707	GE	On-Demand	Anodyne	CACNA1I	44	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC(O)(C2CC2)C2CC2)CC1	ZINC000853610707	GE	On-Demand	Anodyne	GPR119	34	40
O=C(CCCc1ccccc1)N[C@H]1CCCN(c2cnc(F)cn2)C1	ZINC000853610763	EF	On-Demand	Anodyne	PREP	64	41
O=C(CCCc1ccccc1)N[C@@H]1CCCN(c2cnc(F)cn2)C1	ZINC000853610765	EF	On-Demand	Anodyne	PREP	64	41
Cn1ncc2c(=O)n(CN3CCC[C@H](C4CCCCC4)C3)nnc21	ZINC000853610796	ED	On-Demand	Anodyne	Q9M629_MAIZE	53	35
Cn1ncc2c(=O)n(CN3CCC[C@@H](C4CCCCC4)C3)nnc21	ZINC000853610797	ED	On-Demand	Anodyne	Q9M629_MAIZE	53	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@@]3(C)COC[C@@]3(C)C2)CC1	ZINC000853610803	GF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@@]3(C)COC[C@@]3(C)C2)CC1	ZINC000853610803	GF	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC000853610864	GH	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC000853610864	GH	On-Demand	Anodyne	CACNA1I	49	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC000853610864	GH	On-Demand	Anodyne	GPR119	52	50
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]2c2ccc(F)cc2)CC1	ZINC000853610865	GH	On-Demand	Anodyne	GRIN2B	19	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]2c2ccc(F)cc2)CC1	ZINC000853610865	GH	On-Demand	Anodyne	CACNA1I	49	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]2c2ccc(F)cc2)CC1	ZINC000853610865	GH	On-Demand	Anodyne	GPR119	52	50
CN1C[C@H](CNC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000853610876	FD	On-Demand	Anodyne	CACNA1I	57	38
CN1C[C@H](CNC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000853610876	FD	On-Demand	Anodyne	GPR119	39	42
CN1C[C@@H](CNC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000853610877	FD	On-Demand	Anodyne	CACNA1I	57	38
CN1C[C@@H](CNC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CC1=O	ZINC000853610877	FD	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H](C2CC2)C(C)(C)CO)CC1	ZINC000853610889	GF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H](C2CC2)C(C)(C)CO)CC1	ZINC000853610889	GF	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H](C2CC2)C(C)(C)CO)CC1	ZINC000853610890	GF	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H](C2CC2)C(C)(C)CO)CC1	ZINC000853610890	GF	On-Demand	Anodyne	GPR119	32	41
CN(C[C@@H]1CCc2ccccc21)CN1C(=O)C(=O)c2ccccc21	ZINC000853610944	DF	On-Demand	Anodyne	ALDH1A1	50	40
CN(C[C@@H]1CCc2ccccc21)CN1C(=O)C(=O)c2ccccc21	ZINC000853610944	DF	On-Demand	Anodyne	ALDH3A1	38	40
CN(C[C@@H]1CCc2ccccc21)CN1C(=O)C(=O)c2ccccc21	ZINC000853610944	DF	On-Demand	Anodyne	CES1	16	40
CON(C)CCNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611008	ED	On-Demand	Anodyne	CACNA1I	48	35
CON(C)CCNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611008	ED	On-Demand	Anodyne	GPR119	36	43
CN1CCC[C@H](CNc2ncnc(F)c2Br)[C@H]1c1ccccc1	ZINC000853611103	GH	On-Demand	Anodyne	CHRNA10	43	36
CON(C)CCNC(=O)NCCCOc1ccc(C)cc1	ZINC000853611127	CD	On-Demand	Anodyne	DRD4	15	44
CON(C)CCNC(=O)NCCCOc1ccc(C)cc1	ZINC000853611127	CD	On-Demand	Anodyne	HRH2	21	40
CON(C)CCNC(=O)NCCCOc1ccc(C)cc1	ZINC000853611127	CD	On-Demand	Anodyne	LTA4H	21	40
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611176	FE	On-Demand	Anodyne	CACNA1I	42	32
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611176	FE	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(O)(CO)CC2)CC1	ZINC000853611188	FD	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(O)(CO)CC2)CC1	ZINC000853611188	FD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)CC1	ZINC000853611189	GE	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)CC1	ZINC000853611190	GE	On-Demand	Anodyne	CACNA1I	43	34
CN(C[C@@H]1CCc2ccccc21)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853611194	FF	On-Demand	Anodyne	CHRNA7	17	51
CN(C[C@@H]1CCc2ccccc21)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853611196	FF	On-Demand	Anodyne	CHRNA7	17	51
C#Cc1cccnc1N1CCC(n2ncc(C(=O)OCC)c2C)CC1	ZINC000853611202	EF	On-Demand	Mild	P2RY12	32	40
CN(C[C@@H]1CCc2ccccc21)Cn1nnc2c(cnn2C)c1=O	ZINC000853611229	DD	On-Demand	Anodyne	Q9M629_MAIZE	57	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)CC1	ZINC000853611365	GE	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)CC1	ZINC000853611365	GE	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)C(F)(F)C2)CC1	ZINC000853611366	GE	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](O)C(F)(F)C2)CC1	ZINC000853611366	GE	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](Cn3ccnn3)C2)CC1	ZINC000853611374	GD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H](Cn3ccnn3)C2)CC1	ZINC000853611375	GD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853611426	GG	On-Demand	Anodyne	CACNA1I	51	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853611426	GG	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853611427	GG	On-Demand	Anodyne	CACNA1I	51	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853611427	GG	On-Demand	Anodyne	GPR119	47	46
CN1CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	ZINC000853611443	FD	On-Demand	Anodyne	CACNA1I	47	36
CN1CCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CCC1=O	ZINC000853611443	FD	On-Demand	Anodyne	GPR119	39	42
CC[C@@](C)(NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1)C1CC1	ZINC000853611479	FH	On-Demand	Anodyne	CACNA1I	44	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC/C=C\CO)CC1	ZINC000853611482	ED	On-Demand	Anodyne	CACNA1I	44	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC/C=C/CO)CC1	ZINC000853611483	ED	On-Demand	Anodyne	CACNA1I	44	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3C[C@H]3C2)CC1	ZINC000853611490	EF	On-Demand	Anodyne	CACNA1I	49	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3C[C@H]3C2)CC1	ZINC000853611490	EF	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3C[C@H]3C2)CC1	ZINC000853611491	EF	On-Demand	Anodyne	CACNA1I	49	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3C[C@H]3C2)CC1	ZINC000853611491	EF	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000853611492	EF	On-Demand	Anodyne	CACNA1I	49	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000853611492	EF	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3C[C@@H]3C2)CC1	ZINC000853611493	EF	On-Demand	Anodyne	CACNA1I	49	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3C[C@@H]3C2)CC1	ZINC000853611493	EF	On-Demand	Anodyne	GPR119	45	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853611505	FG	On-Demand	Anodyne	CACNA1I	49	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853611505	FG	On-Demand	Anodyne	GPR119	36	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853611506	FG	On-Demand	Anodyne	CACNA1I	49	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853611506	FG	On-Demand	Anodyne	GPR119	36	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)CC1	ZINC000853611516	FD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)CC1	ZINC000853611516	FD	On-Demand	Anodyne	GPR119	35	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC2(C#N)CCCCC2)CC1	ZINC000853611517	GG	On-Demand	Mild	CACNA1I	44	39
O=C1C(=O)N(CN2CCO[C@@H](CC(F)(F)F)C2)c2ccccc21	ZINC000853611542	ED	On-Demand	Anodyne	ALDH1A1	48	38
O=C1C(=O)N(CN2CCO[C@@H](CC(F)(F)F)C2)c2ccccc21	ZINC000853611542	ED	On-Demand	Anodyne	ALDH3A1	40	48
O=C1C(=O)N(CN2CCO[C@H](CC(F)(F)F)C2)c2ccccc21	ZINC000853611543	ED	On-Demand	Anodyne	ALDH1A1	48	38
O=C1C(=O)N(CN2CCO[C@H](CC(F)(F)F)C2)c2ccccc21	ZINC000853611543	ED	On-Demand	Anodyne	ALDH3A1	40	48
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H](CO)C2CCC2)CC1	ZINC000853611570	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H](CO)C2CCC2)CC1	ZINC000853611571	FE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853611592	GG	On-Demand	Anodyne	CACNA1I	61	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853611592	GG	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853611593	GG	On-Demand	Anodyne	CACNA1I	61	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853611593	GG	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853611594	GG	On-Demand	Anodyne	CACNA1I	61	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853611594	GG	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853611595	GG	On-Demand	Anodyne	CACNA1I	61	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853611595	GG	On-Demand	Anodyne	GPR119	47	44
CN(Cc1cn(C)nn1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611605	FD	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@@H](CO)CC2CC2)CC1	ZINC000853611638	FE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@@H](CO)CC2CC2)CC1	ZINC000853611638	FE	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@H](CO)CC2CC2)CC1	ZINC000853611639	FE	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@H](CO)CC2CC2)CC1	ZINC000853611639	FE	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@@H]2CCC(=O)N2)CC1	ZINC000853611655	FD	On-Demand	Anodyne	CACNA1I	49	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC[C@@H]2CCC(=O)N2)CC1	ZINC000853611655	FD	On-Demand	Anodyne	GPR119	41	45
CC[C@H](C)N(CC)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611681	EG	On-Demand	Anodyne	CACNA1I	47	33
CC[C@H](C)N(CC)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611681	EG	On-Demand	Anodyne	GPR119	37	44
CN(CC1=CCCOC1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611690	FF	On-Demand	Anodyne	GPR119	33	43
C[C@@H]1CN(CCNC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)[C@H](C)CO1	ZINC000853611701	GE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@@H]3CCCC[C@@H]32)CC1	ZINC000853611713	FG	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@@H]3CCCC[C@@H]32)CC1	ZINC000853611713	FG	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCCCc2nc[nH]n2)CC1	ZINC000853611755	FD	On-Demand	Anodyne	CACNA1I	44	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCCCc2nc[nH]n2)CC1	ZINC000853611755	FD	On-Demand	Anodyne	GPR119	43	43
CCOC(=O)c1nccc(N2CCN(c3ccc(CC)c(Cl)c3)CC2)n1	ZINC000853611763	FG	On-Demand	Anodyne	SORD	60	38
CC[C@@H](O)CNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611766	ED	On-Demand	Anodyne	CACNA1I	49	35
CC[C@@H](O)CNC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611766	ED	On-Demand	Anodyne	GPR119	34	45
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(CO)(CO)C2)CC1	ZINC000853611783	FD	On-Demand	Anodyne	CACNA1I	41	31
CCN1CC[C@H](N(CC)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853611803	GF	On-Demand	Anodyne	CACNA1I	49	34
CCN1CC[C@@H](N(CC)C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853611804	GF	On-Demand	Anodyne	CACNA1I	49	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@@H](CC#N)C2)CC1	ZINC000853611843	FF	On-Demand	Mild	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@@H](CC#N)C2)CC1	ZINC000853611843	FF	On-Demand	Mild	GPR119	34	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@H](CC#N)C2)CC1	ZINC000853611844	FF	On-Demand	Mild	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC[C@H](CC#N)C2)CC1	ZINC000853611844	FF	On-Demand	Mild	GPR119	34	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853611846	GD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853611846	GD	On-Demand	Anodyne	GPR119	38	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853611847	GD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853611847	GD	On-Demand	Anodyne	GPR119	38	44
C=CC[C@H]1CCCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853611855	FH	On-Demand	Mild	CACNA1I	46	33
C=CC[C@@H]1CCCN(C(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853611856	FH	On-Demand	Mild	CACNA1I	46	33
COCC1(NC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)CCCC1	ZINC000853611861	FF	On-Demand	Anodyne	CACNA1I	43	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)CC1	ZINC000853611900	GD	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)CC1	ZINC000853611905	FF	On-Demand	Anodyne	CACNA1I	48	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)CC1	ZINC000853611905	FF	On-Demand	Anodyne	GPR119	40	42
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853611948	FH	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(c3ccon3)CC2)CC1	ZINC000853611953	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(c3ccon3)CC2)CC1	ZINC000853611953	GG	On-Demand	Anodyne	GPR119	49	43
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC(c3ccon3)CC2)CC1	ZINC000853611953	GG	On-Demand	Anodyne	SMO	31	43
CN(CC(=O)N1CCCC1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853612056	GD	On-Demand	Anodyne	PREP	18	42
CN(CC(=O)N1CCCC1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853612056	GD	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853612061	FD	On-Demand	Anodyne	EPHX2	19	48
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853612061	FD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC3CC2(C)C3)CC1	ZINC000853612135	EF	On-Demand	Anodyne	CACNA1I	41	32
Cn1ncc2c(=O)n(CN3CCO[C@H](CC(F)(F)F)C3)nnc21	ZINC000853612136	EC	On-Demand	Anodyne	Q9M629_MAIZE	61	36
Cn1ncc2c(=O)n(CN3CCO[C@@H](CC(F)(F)F)C3)nnc21	ZINC000853612137	EC	On-Demand	Anodyne	Q9M629_MAIZE	61	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@]2(C)CC2(C)C)CC1	ZINC000853612276	EG	On-Demand	Anodyne	CACNA1I	49	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@]2(C)CC2(C)C)CC1	ZINC000853612276	EG	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@]2(C)CC2(C)C)CC1	ZINC000853612277	EG	On-Demand	Anodyne	CACNA1I	49	37
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@@]2(C)CC2(C)C)CC1	ZINC000853612277	EG	On-Demand	Anodyne	GPR119	36	40
C=CCCC(C)(C)NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853612308	FH	On-Demand	Mild	CACNA1I	43	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC(C)(C2CC2)C2CC2)CC1	ZINC000853612416	FH	On-Demand	Anodyne	CACNA1I	49	36
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC(C)(C2CC2)C2CC2)CC1	ZINC000853612416	FH	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853612565	FD	On-Demand	Anodyne	CACNA1I	47	35
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853612566	FD	On-Demand	Anodyne	CACNA1I	47	35
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853612756	FH	On-Demand	Mild	CACNA1I	48	34
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853612756	FH	On-Demand	Mild	GPR119	40	40
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853612965	FD	On-Demand	Anodyne	HTR1A	25	41
COC(=O)c1ccc(=O)n(CN2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853612965	FD	On-Demand	Anodyne	ADRA1D	19	44
C[C@@H](NC(=O)NCC1=CCCC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613033	FG	On-Demand	Anodyne	GPR119	17	40
C[C@H](NC(=O)NCC1=CCCC1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613034	FG	On-Demand	Anodyne	GPR119	17	40
C[C@H](NC(=O)NCC1=CCCC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613035	FG	On-Demand	Anodyne	GPR119	17	40
C[C@@H](NC(=O)NCC1=CCCC1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613036	FG	On-Demand	Anodyne	GPR119	17	40
CON(C)CCNC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613061	ED	On-Demand	Anodyne	CACNA1I	41	32
CON(C)CCNC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613062	ED	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC2CCC(O)CC2)CC1	ZINC000853613088	FE	On-Demand	Anodyne	CACNA1I	50	38
CC(C)(C)OC(=O)N1CCC(CNC(=O)NCC2CCC(O)CC2)CC1	ZINC000853613088	FE	On-Demand	Anodyne	GPR119	40	43
Cc1ccncc1CCNC(=O)N[C@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613089	GG	On-Demand	Anodyne	GPR119	24	41
Cc1ccncc1CCNC(=O)N[C@@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613092	GG	On-Demand	Anodyne	GPR119	24	41
Cc1ccncc1CCNC(=O)N[C@H](C)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613095	GG	On-Demand	Anodyne	GPR119	24	41
Cc1ccncc1CCNC(=O)N[C@@H](C)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613097	GG	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC/C=C\CO)C1	ZINC000853613140	ED	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC/C=C/CO)C1	ZINC000853613141	ED	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC/C=C/CO)C1	ZINC000853613143	ED	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC/C=C\CO)C1	ZINC000853613145	ED	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N(CCC2CC2)CC2CC2)CC1	ZINC000853613176	GH	On-Demand	Anodyne	CACNA1I	51	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N(CCC2CC2)CC2CC2)CC1	ZINC000853613176	GH	On-Demand	Anodyne	GPR119	34	41
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCO[C@@H](CC(F)(F)F)C1	ZINC000853613199	FD	On-Demand	Anodyne	CHRNA7	15	51
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCO[C@H](CC(F)(F)F)C1	ZINC000853613201	FD	On-Demand	Anodyne	CHRNA7	15	51
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCO[C@H](CC(F)(F)F)C1	ZINC000853613203	FD	On-Demand	Anodyne	CHRNA7	15	51
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCO[C@@H](CC(F)(F)F)C1	ZINC000853613206	FD	On-Demand	Anodyne	CHRNA7	15	51
CN(CC1=CCSC1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853613208	FF	On-Demand	Anodyne	CACNA1I	48	35
CN(CC1=CCSC1)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853613208	FF	On-Demand	Anodyne	GPR119	34	40
CN(CC(=O)N1CCCC1)C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613322	GD	On-Demand	Anodyne	PREP	19	42
CN(CC(=O)N1CCCC1)C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613323	GD	On-Demand	Anodyne	PREP	19	42
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613324	FH	On-Demand	Mild	CACNA1I	40	31
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853613325	FH	On-Demand	Mild	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCC(c3ccon3)CC2)C1	ZINC000853613375	GG	On-Demand	Anodyne	SMO	25	43
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCC(c3ccon3)CC2)C1	ZINC000853613376	GG	On-Demand	Anodyne	SMO	25	43
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)C1	ZINC000853613415	GH	On-Demand	Anodyne	CACNA1I	42	41
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)C1	ZINC000853613415	GH	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)C1	ZINC000853613416	GH	On-Demand	Anodyne	CACNA1I	42	41
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC[C@@H]2c2ccc(F)cc2)C1	ZINC000853613416	GH	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H]2c2ccc(F)cc2)C1	ZINC000853613417	GH	On-Demand	Anodyne	CACNA1I	42	41
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H]2c2ccc(F)cc2)C1	ZINC000853613417	GH	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3COC[C@@H]3C2)CC1	ZINC000853613443	FE	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3COC[C@@H]3C2)CC1	ZINC000853613443	FE	On-Demand	Anodyne	GPR119	41	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3COC[C@@H]3C2)CC1	ZINC000853613444	FE	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3COC[C@@H]3C2)CC1	ZINC000853613444	FE	On-Demand	Anodyne	GPR119	41	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3COC[C@H]3C2)CC1	ZINC000853613445	FE	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@@H]3COC[C@H]3C2)CC1	ZINC000853613445	FE	On-Demand	Anodyne	GPR119	41	44
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3COC[C@H]3C2)CC1	ZINC000853613446	FE	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CC[C@H]3COC[C@H]3C2)CC1	ZINC000853613446	FE	On-Demand	Anodyne	GPR119	41	44
C=C[C@H](CO)NC(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853613451	ED	On-Demand	Mild	CACNA1I	42	33
C[C@@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@H](CC(F)(F)F)O1	ZINC000853613496	EC	On-Demand	Anodyne	Q9M629_MAIZE	54	35
C[C@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@@H](CC(F)(F)F)O1	ZINC000853613498	EC	On-Demand	Anodyne	Q9M629_MAIZE	54	35
C[C@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@H](CC(F)(F)F)O1	ZINC000853613499	EC	On-Demand	Anodyne	Q9M629_MAIZE	54	35
C[C@@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@@H](CC(F)(F)F)O1	ZINC000853613500	EC	On-Demand	Anodyne	Q9M629_MAIZE	54	35
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC[C@H]2c2ccc(F)cc2)C1	ZINC000853613618	GH	On-Demand	Anodyne	CACNA1I	42	41
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CC[C@H]2c2ccc(F)cc2)C1	ZINC000853613618	GH	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853613655	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853613657	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853613659	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853613660	GG	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCC3(COC3)C2)CC1	ZINC000853613829	FE	On-Demand	Anodyne	CACNA1I	40	31
CN(C[C@@H]1CC1(C)C)C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853613842	FG	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2C[C@H](O)C2)CC1	ZINC000853613902	ED	On-Demand	Anodyne	EPHX2	20	47
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2C[C@H](O)C2)CC1	ZINC000853613902	ED	On-Demand	Anodyne	CACNA1I	44	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N[C@H]2C[C@H](O)C2)CC1	ZINC000853613902	ED	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC2CC(CO)C2)CC1	ZINC000853613922	ED	On-Demand	Anodyne	EPHX2	18	47
CC(C)(C)OC(=O)N1CCC(CNC(=O)NC2CC(CO)C2)CC1	ZINC000853613922	ED	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCC2CCC(O)CC2)C1	ZINC000853614003	FE	On-Demand	Anodyne	CACNA1I	45	34
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCC2CCC(O)CC2)C1	ZINC000853614004	FE	On-Demand	Anodyne	CACNA1I	45	34
COC(=O)c1ncn(CN2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853614012	ED	On-Demand	Anodyne	HTR1A	35	42
COC(=O)c1ncn(CN2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853614012	ED	On-Demand	Anodyne	ADRA1D	27	44
COC(=O)c1ncn(CN2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853614012	ED	On-Demand	Anodyne	HTR7	17	40
COC(=O)[C@@H]1CC(=O)N(CN2CCN(c3ccc(C)cc3C)CC2)C1	ZINC000853614022	ED	On-Demand	Anodyne	HTR1A	15	40
COC(=O)[C@@H]1CC(=O)N(CN2CCN(c3ccc(C)cc3C)CC2)C1	ZINC000853614022	ED	On-Demand	Anodyne	ADRA1D	16	45
CC[C@@H](O)CNC(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614047	ED	On-Demand	Anodyne	CACNA1I	41	32
CC[C@@H](O)CNC(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614048	ED	On-Demand	Anodyne	CACNA1I	41	32
C[C@H](NC(=O)NCCCc1nc[nH]n1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614053	GE	On-Demand	Anodyne	SSTR2	50	36
C[C@@H](NC(=O)NCCCc1nc[nH]n1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614054	GE	On-Demand	Anodyne	SSTR2	50	36
C[C@H](NC(=O)NCCCc1nc[nH]n1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614055	GE	On-Demand	Anodyne	SSTR2	50	36
C[C@@H](NC(=O)NCCCc1nc[nH]n1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614056	GE	On-Demand	Anodyne	SSTR2	50	36
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N(CCC2CC2)CC2CC2)C1	ZINC000853614070	GH	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N(CCC2CC2)CC2CC2)C1	ZINC000853614071	GH	On-Demand	Anodyne	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853614078	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853614079	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853614080	GG	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853614081	GG	On-Demand	Anodyne	CACNA1I	43	34
C[C@@H](NC(=O)N1CC(S(C)(=O)=O)C1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614112	GD	On-Demand	Anodyne	GPR119	22	40
C[C@@H](NC(=O)N1CC(S(C)(=O)=O)C1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853614113	GD	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@H]3CC[C@@H](C3)C2)CC1	ZINC000853614274	FG	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2C[C@H]3CC[C@@H](C3)C2)CC1	ZINC000853614274	FG	On-Demand	Anodyne	GPR119	33	42
COC[C@@]1(C)CC(=O)N(CN2CCN(c3ccc(C)cc3C)CC2)C1	ZINC000853614324	EE	On-Demand	Anodyne	ADRA1D	15	49
COC[C@]1(C)CC(=O)N(CN2CCN(c3ccc(C)cc3C)CC2)C1	ZINC000853614325	EE	On-Demand	Anodyne	ADRA1D	15	49
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NC(C)(C2CC2)C2CC2)C1	ZINC000853614491	FH	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NC(C)(C2CC2)C2CC2)C1	ZINC000853614492	FH	On-Demand	Anodyne	CACNA1I	42	33
COc1cccc([C@H]2CC(=O)N(CN3CCN(C(=O)c4cccn4C)CC3)C2)c1	ZINC000853614652	GD	On-Demand	Anodyne	DRD4	42	32
Cn1cccc1C(=O)N1CCN(Cn2nnc3c(cnn3C)c2=O)CC1	ZINC000853614675	FB	On-Demand	Anodyne	Q9M629_MAIZE	51	34
Cn1cc(-c2ccc(=O)n(CN3CCO[C@H](CC(F)(F)F)C3)n2)cn1	ZINC000853614732	FD	On-Demand	Anodyne	MET	15	47
Cn1cc(-c2ccc(=O)n(CN3CCO[C@@H](CC(F)(F)F)C3)n2)cn1	ZINC000853614734	FD	On-Demand	Anodyne	MET	15	47
CS(=O)(=O)NCC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853614810	FD	On-Demand	Anodyne	SIRT3	64	45
CS(=O)(=O)NCC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853614810	FD	On-Demand	Anodyne	SIRT2	55	45
CS(=O)(=O)NCC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853614810	FD	On-Demand	Anodyne	SIRT1	55	45
COC(=O)[C@@]1(C(F)(F)F)CCN(c2ncnc3ccc(C(C)C)cc23)C1	ZINC000853614883	FH	On-Demand	Anodyne	PDGFRB	56	45
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H]3C[C@H]3C2)C1	ZINC000853615150	EF	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@@H]3C[C@H]3C2)C1	ZINC000853615154	EF	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@H]3C[C@@H]3C2)C1	ZINC000853615156	EF	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CC[C@@H]3C[C@@H]3C2)C1	ZINC000853615159	EF	On-Demand	Anodyne	CACNA1I	45	32
CN(CCN1CCN(Cc2ccccc2)CC1)c1cnc(F)cn1	ZINC000853615266	ED	On-Demand	Anodyne	DRD4	33	40
CN(CCN1CCN(Cc2ccccc2)CC1)c1cnc(F)cn1	ZINC000853615266	ED	On-Demand	Anodyne	SIGMAR1	56	44
CN1CCN(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CCC1=O	ZINC000853615437	FD	On-Demand	Anodyne	CACNA1I	41	33
CN1CCN(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CCC1=O	ZINC000853615438	FD	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)NCC(O)(C2CC2)C2CC2)C1	ZINC000853615457	GE	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)NCC(O)(C2CC2)C2CC2)C1	ZINC000853615458	GE	On-Demand	Anodyne	CACNA1I	40	32
Cn1cccc1C(=O)N1CCN(Cn2c(=O)oc3ccc(Cl)cc32)CC1	ZINC000853615646	FE	On-Demand	Anodyne	TSPO	17	48
Cn1cccc1C(=O)N1CCN(CN2C[C@]3(CN4CCC3CC4)OC2=O)CC1	ZINC000853615668	GC	On-Demand	Anodyne	CHRNA7	18	51
Cn1cccc1C(=O)N1CCN(CN2C[C@@]3(CN4CCC3CC4)OC2=O)CC1	ZINC000853615669	GC	On-Demand	Anodyne	CHRNA7	18	51
COC(=O)[C@@]1(C(F)(F)F)CCN(c2cc(Nc3ccccc3)ncn2)C1	ZINC000853615687	FG	On-Demand	Anodyne	GALR2	43	38
CN(CCN1CCN(Cc2ccccc2)CC1)c1cc(F)ncn1	ZINC000853615691	ED	On-Demand	Anodyne	SIGMAR1	61	43
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@@]2(C)CC2(C)C)C1	ZINC000853615860	EG	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N[C@]2(C)CC2(C)C)C1	ZINC000853615862	EG	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@]2(C)CC2(C)C)C1	ZINC000853615865	EG	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N[C@@]2(C)CC2(C)C)C1	ZINC000853615867	EG	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCc3nccnc3C2)CC1	ZINC000853615891	GE	On-Demand	Anodyne	CACNA1I	48	35
CC(C)(C)OC(=O)N1CCC(CNC(=O)N2CCc3nccnc3C2)CC1	ZINC000853615891	GE	On-Demand	Anodyne	GPR119	52	47
C#Cc1cccnc1N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000853616017	EE	On-Demand	Mild	DRD4	30	45
C#Cc1cccnc1N1CCN([C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000853616017	EE	On-Demand	Mild	SLC18A3	19	43
C#Cc1cccnc1N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000853616019	EE	On-Demand	Mild	DRD4	30	45
C#Cc1cccnc1N1CCN([C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000853616019	EE	On-Demand	Mild	SLC18A3	19	43
Fc1cnc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cn1	ZINC000853616041	EE	On-Demand	Anodyne	SLC18A3	25	45
Fc1cnc(N2CCN([C@H]3CCN(Cc4ccccc4)C3)CC2)cn1	ZINC000853616041	EE	On-Demand	Anodyne	CXCR3	16	40
Fc1cnc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cn1	ZINC000853616042	EE	On-Demand	Anodyne	SLC18A3	25	45
Fc1cnc(N2CCN([C@@H]3CCN(Cc4ccccc4)C3)CC2)cn1	ZINC000853616042	EE	On-Demand	Anodyne	CXCR3	16	40
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853616196	FG	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853616197	FG	On-Demand	Anodyne	CACNA1I	40	31
COC(=O)[C@@]1(C(F)(F)F)CCN(c2nc3ccccc3n3cccc23)C1	ZINC000853616230	FG	On-Demand	Anodyne	HTR3A	26	42
C=CC[C@H]1CCCN(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616332	FH	On-Demand	Mild	CACNA1I	41	32
C=CC[C@@H]1CCCN(C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616334	FH	On-Demand	Mild	CACNA1I	41	32
C=CC[C@H]1CCCN(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616335	FH	On-Demand	Mild	CACNA1I	41	32
C=CC[C@@H]1CCCN(C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616337	FH	On-Demand	Mild	CACNA1I	41	32
Cn1cccc1C(=O)N1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000853616360	FD	On-Demand	Bother	F2RL3	44	32
CCN1CC[C@@H](N(CC)C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616445	GF	On-Demand	Anodyne	CACNA1I	41	31
CCN1CC[C@@H](N(CC)C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616446	GF	On-Demand	Anodyne	CACNA1I	41	31
CCN1CC[C@H](N(CC)C(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616447	GF	On-Demand	Anodyne	CACNA1I	41	31
CCN1CC[C@H](N(CC)C(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853616448	GF	On-Demand	Anodyne	CACNA1I	41	31
CN1C[C@H](CNC(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853616531	FD	On-Demand	Anodyne	CACNA1I	53	35
CN1C[C@H](CNC(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853616532	FD	On-Demand	Anodyne	CACNA1I	53	35
CN1C[C@@H](CNC(=O)NC[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853616534	FD	On-Demand	Anodyne	CACNA1I	53	35
CN1C[C@@H](CNC(=O)NC[C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853616536	FD	On-Demand	Anodyne	CACNA1I	53	35
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)C1	ZINC000853616569	FF	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)C1	ZINC000853616570	FF	On-Demand	Anodyne	CACNA1I	40	31
Cn1ncc2c(=O)n(CN3CCn4c(nnc4C(C)(C)C)C3)nnc21	ZINC000853616605	EB	On-Demand	Anodyne	Q9M629_MAIZE	51	33
COCCCOc1ccc(Nc2ncnc(F)c2Br)cc1OC	ZINC000853616724	GH	On-Demand	Anodyne	EGFR	74	48
COCCCOc1ccc(Nc2ncnc(F)c2Br)cc1OC	ZINC000853616724	GH	On-Demand	Anodyne	ERBB2	41	44
COCCCOc1ccc(Nc2ncnc(F)c2Br)cc1OC	ZINC000853616724	GH	On-Demand	Anodyne	FLT1	19	43
COCCCOc1ccc(Nc2ncnc(F)c2Br)cc1OC	ZINC000853616724	GH	On-Demand	Anodyne	MKNK1	16	41
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCC[C@H](CC#N)C2)C1	ZINC000853616766	FF	On-Demand	Mild	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCC[C@@H](CC#N)C2)C1	ZINC000853616767	FF	On-Demand	Mild	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCC[C@H](CC#N)C2)C1	ZINC000853616768	FF	On-Demand	Mild	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCC[C@@H](CC#N)C2)C1	ZINC000853616769	FF	On-Demand	Mild	CACNA1I	41	32
CC[C@H](Nc1ncnc(F)c1Br)c1ccc(OC)c(OC)c1	ZINC000853617003	FH	On-Demand	Anodyne	EGFR	19	41
CC[C@@H](Nc1ncnc(F)c1Br)c1ccc(OC)c(OC)c1	ZINC000853617004	FH	On-Demand	Anodyne	EGFR	19	41
COCCCOc1ccc(Nc2cc(F)ncn2)cc1OC	ZINC000853617037	DF	On-Demand	Anodyne	EGFR	32	42
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCC[C@H](CCF)C2)C1	ZINC000853617038	FG	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCC[C@@H](CCF)C2)C1	ZINC000853617039	FG	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCC[C@H](CCF)C2)C1	ZINC000853617040	FG	On-Demand	Anodyne	CACNA1I	53	33
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCC[C@@H](CCF)C2)C1	ZINC000853617041	FG	On-Demand	Anodyne	CACNA1I	53	33
CN(Cc1cn(C)nn1)C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853617105	FD	On-Demand	Anodyne	CACNA1I	40	31
CN(Cc1cn(C)nn1)C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853617107	FD	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)N2CCc3nccnc3C2)C1	ZINC000853617163	GE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)N2CCc3nccnc3C2)C1	ZINC000853617164	GE	On-Demand	Anodyne	CACNA1I	41	32
CN(CC1=CCSC1)C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853617217	FF	On-Demand	Anodyne	CACNA1I	41	32
CN(CC1=CCSC1)C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853617218	FF	On-Demand	Anodyne	CACNA1I	41	32
CS(=O)(=O)NCC1CCN(c2cc(F)ncn2)CC1	ZINC000853617234	CC	On-Demand	Anodyne	SIRT3	25	40
CS(=O)(=O)NCC1CCN(c2cc(F)ncn2)CC1	ZINC000853617234	CC	On-Demand	Anodyne	SIRT2	24	40
CS(=O)(=O)NCC1CCN(c2cc(F)ncn2)CC1	ZINC000853617234	CC	On-Demand	Anodyne	SIRT1	18	40
O=C(COC(=O)c1ccc(COc2ccc3ccccc3c2)o1)NCCc1cccc2cccnc12	ZINC000853617455	JK	On-Demand	Anodyne	MTNR1A	37	40
Cc1nnc(CN(C)CN2C(=O)C(=O)c3ccc(OC(F)(F)F)cc32)s1	ZINC000853617529	GE	On-Demand	Anodyne	CHRM5	15	41
Cc1cc(C(F)(F)F)c(NC[C@H]2CCN(C(N)=O)C2)nn1	ZINC000853617568	DD	On-Demand	Anodyne	SFRP1	44	30
Cc1cc(C(F)(F)F)c(NC[C@@H]2CCN(C(N)=O)C2)nn1	ZINC000853617569	DD	On-Demand	Anodyne	SFRP1	44	30
NC(=O)N1CC[C@H](CNc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853617629	EF	On-Demand	Anodyne	GRIN2B	39	46
NC(=O)N1CC[C@H](CNc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853617629	EF	On-Demand	Anodyne	VCP	37	41
NC(=O)N1CC[C@@H](CNc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853617630	EF	On-Demand	Anodyne	GRIN2B	39	46
NC(=O)N1CC[C@@H](CNc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853617630	EF	On-Demand	Anodyne	VCP	37	41
NC(=O)N1CC[C@H](CN=c2nc(-c3ccncc3)[nH]c3ccccc23)C1	ZINC000853617637	ED	On-Demand	Anodyne	PARP2	45	38
NC(=O)N1CC[C@@H](CN=c2nc(-c3ccncc3)[nH]c3ccccc23)C1	ZINC000853617638	ED	On-Demand	Anodyne	PARP2	45	38
COC(=O)Nc1cccc(CNc2cc(C(F)(F)F)cc(C)n2)c1	ZINC000853617658	EI	On-Demand	Anodyne	HTR1D	15	40
COC(=O)Nc1cccc(CNc2cc(C(F)(F)F)cc(C)n2)c1	ZINC000853617658	EI	On-Demand	Anodyne	AGPAT2	22	40
COC(=O)Nc1cccc(CNc2nccnc2OC2CCC2)c1	ZINC000853617663	EG	On-Demand	Anodyne	PDE4A	19	40
C#CCCCOc1cccnc1NCc1cccc(NC(=O)OC)c1	ZINC000853617710	EH	On-Demand	Mild	PPIA	41	43
COC(=O)N(C)CCNC(=O)NC(C)(C)c1ccccc1	ZINC000853617750	CD	On-Demand	Anodyne	AMY2	54	34
Cc1nnc(CN(C)CN2C(=O)C(=O)c3ccccc32)s1	ZINC000853617755	DD	On-Demand	Anodyne	ALDH1A1	58	41
Cc1nnc(CN(C)CN2C(=O)C(=O)c3ccccc32)s1	ZINC000853617755	DD	On-Demand	Anodyne	ALDH3A1	38	41
Cc1nnc(CN(C)CN2C(=O)C(=O)c3ccccc32)s1	ZINC000853617755	DD	On-Demand	Anodyne	CES1	17	41
NC(=O)N1CC[C@H](CNc2ccc(C(F)(F)F)c(Cl)n2)C1	ZINC000853617766	DF	On-Demand	Anodyne	SFRP1	47	33
NC(=O)N1CC[C@@H](CNc2ccc(C(F)(F)F)c(Cl)n2)C1	ZINC000853617767	DF	On-Demand	Anodyne	SFRP1	47	33
Cc1nnc(CN(C)CN2C(=O)N[C@H](Cc3ccccc3)C2=O)s1	ZINC000853617777	ED	On-Demand	Anodyne	GALR1	45	34
Cc1nnc(CN(C)CN2C(=O)N[C@H](Cc3ccccc3)C2=O)s1	ZINC000853617777	ED	On-Demand	Anodyne	GHRL	47	34
Cc1nnc(CN(C)CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)s1	ZINC000853617778	ED	On-Demand	Anodyne	GALR1	45	34
Cc1nnc(CN(C)CN2C(=O)N[C@@H](Cc3ccccc3)C2=O)s1	ZINC000853617778	ED	On-Demand	Anodyne	GHRL	47	34
COC(=O)Nc1cccc(CNc2nc(N)c3cnn(C(C)(C)C)c3n2)c1	ZINC000853617783	FF	On-Demand	Anodyne	DRTS_TRYCR	45	31
CCOc1ccccc1[C@H](CC)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853617862	GG	On-Demand	Anodyne	HCN1	48	34
CCOc1ccccc1[C@H](CC)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853617862	GG	On-Demand	Anodyne	HCN4	42	34
CCOc1ccccc1[C@@H](CC)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853617863	GG	On-Demand	Anodyne	HCN1	48	34
CCOc1ccccc1[C@@H](CC)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853617863	GG	On-Demand	Anodyne	HCN4	42	34
C[C@@H](NC(=O)NCCc1nnc(S)n1C)c1ccc(Oc2ccccc2)cc1	ZINC000853617976	GG	On-Demand	Anodyne	ACACA	28	46
C[C@@H](NC(=O)NCCc1nnc(S)n1C)c1ccc(Oc2ccccc2)cc1	ZINC000853617976	GG	On-Demand	Anodyne	ACACB	28	46
COC(=O)Nc1cccc(CNc2cc(CO)cc(C)n2)c1	ZINC000853617983	DF	On-Demand	Anodyne	HTR1D	17	41
NC(=O)N1CC[C@H](CNc2nn3cc(-c4ccccc4)nc3s2)C1	ZINC000853617992	EE	On-Demand	Anodyne	P2RY12	94	35
NC(=O)N1CC[C@H](CNc2nn3cc(-c4ccccc4)nc3s2)C1	ZINC000853617992	EE	On-Demand	Anodyne	GRIN2B	23	44
NC(=O)N1CC[C@H](CNc2nn3cc(-c4ccccc4)nc3s2)C1	ZINC000853617992	EE	On-Demand	Anodyne	VCP	60	37
NC(=O)N1CC[C@@H](CNc2nn3cc(-c4ccccc4)nc3s2)C1	ZINC000853617994	EE	On-Demand	Anodyne	P2RY12	94	35
NC(=O)N1CC[C@@H](CNc2nn3cc(-c4ccccc4)nc3s2)C1	ZINC000853617994	EE	On-Demand	Anodyne	GRIN2B	23	44
NC(=O)N1CC[C@@H](CNc2nn3cc(-c4ccccc4)nc3s2)C1	ZINC000853617994	EE	On-Demand	Anodyne	VCP	60	37
Cn1cccc1C(=O)N1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1	ZINC000853617998	FD	On-Demand	Bother	F2RL3	46	34
NC(=O)N1CC[C@@H](CNc2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853618020	FG	On-Demand	Anodyne	CACNA1I	61	33
NC(=O)N1CC[C@H](CNc2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853618021	FG	On-Demand	Anodyne	CACNA1I	61	33
CC(=O)c1ccc(N2C[C@@H](N3CCCC3)C[C@H]2C)c(I)c1	ZINC000853618041	GH	On-Demand	Anodyne	L3MBTL3	72	35
CC(=O)c1ccc(N2C[C@H](N3CCCC3)C[C@H]2C)c(I)c1	ZINC000853618042	GH	On-Demand	Anodyne	L3MBTL3	72	35
CC(=O)c1ccc(N2C[C@H](N3CCCC3)C[C@@H]2C)c(I)c1	ZINC000853618043	GH	On-Demand	Anodyne	L3MBTL3	72	35
CC(=O)c1ccc(N2C[C@@H](N3CCCC3)C[C@@H]2C)c(I)c1	ZINC000853618044	GH	On-Demand	Anodyne	L3MBTL3	72	35
CC(=O)c1ccc(N(C)C2C[C@@H]3CC[C@H](C2)N3C)c(I)c1	ZINC000853618107	GH	On-Demand	Anodyne	GLRA1	45	35
NC(=O)N1CC[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000853618126	DE	On-Demand	Bother	NMT1	28	40
NC(=O)N1CC[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000853618127	DE	On-Demand	Bother	NMT1	28	40
CCOC(=O)c1nccc(N2CCC([C@@H](O)c3ccccc3C)CC2)n1	ZINC000853618196	FF	On-Demand	Anodyne	SORD	77	35
CCOC(=O)c1nccc(N2CCC([C@H](O)c3ccccc3C)CC2)n1	ZINC000853618197	FF	On-Demand	Anodyne	SORD	77	35
Cc1ccccc1[C@H](O)C1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853618263	GH	On-Demand	Anodyne	SCD1	54	40
Cc1ccccc1[C@H](O)C1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853618263	GH	On-Demand	Anodyne	SCD	30	40
Cc1ccccc1[C@@H](O)C1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853618264	GH	On-Demand	Anodyne	SCD1	54	40
Cc1ccccc1[C@@H](O)C1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853618264	GH	On-Demand	Anodyne	SCD	30	40
Fc1cnc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cn1	ZINC000853618266	DF	On-Demand	Anodyne	SIGMAR1	29	40
Fc1cnc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cn1	ZINC000853618267	DF	On-Demand	Anodyne	SIGMAR1	29	40
C#Cc1cccnc1N1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000853618284	DG	On-Demand	Mild	DCK	56	46
CCNc1nccnc1NCc1cccc(NC(=O)OC)c1	ZINC000853618337	DF	On-Demand	Anodyne	ROCK2	21	40
N#Cc1ccc(OC2CCN(c3cc(F)ncn3)CC2)c(F)c1	ZINC000853618405	DF	On-Demand	Mild	PDE3A	30	41
N#Cc1ccc(OC2CCN(c3cc(F)ncn3)CC2)c(F)c1	ZINC000853618405	DF	On-Demand	Mild	DCK	70	51
N#Cc1ccc(OC2CCN(c3cc(F)ncn3)CC2)c(F)c1	ZINC000853618405	DF	On-Demand	Mild	PDE3B	33	41
Cc1nnc(CN(C)CN2C[C@@H]3CN(Cc4ccccc4)CC[C@@H]3C2=O)s1	ZINC000853618457	GE	On-Demand	Anodyne	SIGMAR1	23	41
Fc1cc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)ncn1	ZINC000853618555	DF	On-Demand	Anodyne	SIGMAR1	33	40
Fc1cc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)ncn1	ZINC000853618557	DF	On-Demand	Anodyne	SIGMAR1	33	40
CN(CC1=CCSC1)CN1C(=O)C(=O)c2cc(Br)ccc21	ZINC000853618765	FF	On-Demand	Anodyne	ALDH1A1	15	44
Cc1nnc(CN(C)CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)s1	ZINC000853618793	FE	On-Demand	Bother	SLC27A4	42	32
Cc1nnc(CN(C)CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)s1	ZINC000853618794	FE	On-Demand	Bother	SLC27A4	42	32
CCOc1cc(NCc2cccc(NC(=O)OC)c2)nc(C)n1	ZINC000853618856	DF	On-Demand	Anodyne	HTR1D	17	40
C#CCCCOc1cccnc1N1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000853618956	GH	On-Demand	Mild	DCK	52	43
Cn1cccc1C(=O)N1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853618962	FC	On-Demand	Anodyne	ALDH1A1	57	44
Cn1cccc1C(=O)N1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853618962	FC	On-Demand	Anodyne	ALDH3A1	43	54
Cn1cccc1C(=O)N1CCN(CN2C(=O)C(=O)c3ccccc32)CC1	ZINC000853618962	FC	On-Demand	Anodyne	CES1	16	43
Cc1nnc(CN(C)CN2C[C@]3(CN4CCC3CC4)OC2=O)s1	ZINC000853619041	ED	On-Demand	Anodyne	CHRNA7	16	56
Cc1nnc(CN(C)CN2C[C@@]3(CN4CCC3CC4)OC2=O)s1	ZINC000853619042	ED	On-Demand	Anodyne	CHRNA7	16	56
N#Cc1ccc(OC2CCN(c3cnc(F)cn3)CC2)c(F)c1	ZINC000853619053	DF	On-Demand	Mild	DCK	60	46
N#Cc1ccc(OC2CCN(c3cnc(F)cn3)CC2)c(F)c1	ZINC000853619053	DF	On-Demand	Mild	SCD1	45	35
Cc1ccc(N2CCC([C@@H](O)c3ccccc3C)CC2)nn1	ZINC000853619222	CG	On-Demand	Anodyne	SCD1	46	43
Cc1ccc(N2CCC([C@@H](O)c3ccccc3C)CC2)nn1	ZINC000853619222	CG	On-Demand	Anodyne	SCD	21	41
Cc1ccc(N2CCC([C@H](O)c3ccccc3C)CC2)nn1	ZINC000853619223	CG	On-Demand	Anodyne	SCD1	46	43
Cc1ccc(N2CCC([C@H](O)c3ccccc3C)CC2)nn1	ZINC000853619223	CG	On-Demand	Anodyne	SCD	21	41
CN(CC1=CCSC1)CN1C(=O)C(=O)c2ccccc21	ZINC000853619298	CD	On-Demand	Anodyne	ALDH1A1	59	41
CN(CC1=CCSC1)CN1C(=O)C(=O)c2ccccc21	ZINC000853619298	CD	On-Demand	Anodyne	ALDH3A1	39	41
CN(CC1=CCSC1)CN1C(=O)C(=O)c2ccccc21	ZINC000853619298	CD	On-Demand	Anodyne	CES1	17	41
CN(CC1=CCSC1)CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21	ZINC000853619299	FF	On-Demand	Anodyne	CHRM5	15	42
N#Cc1ccc(OC2CCN(c3ncnc(F)c3Br)CC2)c(F)c1	ZINC000853619300	GG	On-Demand	Mild	PDE3A	36	41
N#Cc1ccc(OC2CCN(c3ncnc(F)c3Br)CC2)c(F)c1	ZINC000853619300	GG	On-Demand	Mild	DCK	59	51
N#Cc1ccc(OC2CCN(c3ncnc(F)c3Br)CC2)c(F)c1	ZINC000853619300	GG	On-Demand	Mild	PDE3B	42	41
N#Cc1ccc(OC2CCN(c3ncnc(F)c3Br)CC2)c(F)c1	ZINC000853619300	GG	On-Demand	Mild	SCD1	17	44
COC(=O)c1nccc(N2CCC([C@H](O)c3ccccc3C)CC2)n1	ZINC000853619350	EF	On-Demand	Anodyne	SORD	73	35
COC(=O)c1nccc(N2CCC([C@@H](O)c3ccccc3C)CC2)n1	ZINC000853619351	EF	On-Demand	Anodyne	SORD	73	35
C[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)C1(S(C)(=O)=O)CC1	ZINC000853619404	FD	On-Demand	Anodyne	ABCC8	44	34
Cc1cc(CO)cc(N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853619473	GE	On-Demand	Anodyne	GPR119	39	48
Cc1cc(CO)cc(N2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853619474	GE	On-Demand	Anodyne	GPR119	39	48
CCCc1ccc(N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)nn1	ZINC000853619498	GF	On-Demand	Anodyne	GPR119	44	42
CCCc1ccc(N2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)nn1	ZINC000853619499	GF	On-Demand	Anodyne	GPR119	44	42
CCOc1cc(N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)nc(C)n1	ZINC000853619500	GE	On-Demand	Anodyne	GPR119	45	50
CCOc1cc(N2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)nc(C)n1	ZINC000853619501	GE	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3cc(C(C)(C)C)ncn3)C2)CC1	ZINC000853619530	GF	On-Demand	Anodyne	GPR119	52	52
CCNc1nccnc1NCC1CCN(C(=O)OC)CC1	ZINC000853619534	CD	On-Demand	Anodyne	GRIN2B	26	48
CCNc1nccnc1NCC1CCN(C(=O)OC)CC1	ZINC000853619534	CD	On-Demand	Anodyne	CACNA1I	41	32
COC(=O)N1CCC(CNc2cc(=O)n(C)c(=O)n2C)CC1	ZINC000853619548	DB	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)N1CCC(CNc2nc(OC)c3cnn(C(C)(C)C)c3n2)CC1	ZINC000853619549	GE	On-Demand	Anodyne	GRIN2B	22	46
COC(=O)N1CCC(CNc2cc(OC)c([N+](=O)[O-])cc2Cl)CC1	ZINC000853619568	FG	On-Demand	Bother	HTR4	48	45
COC(=O)N1CCC(CNc2cc(OC)c([N+](=O)[O-])cc2Cl)CC1	ZINC000853619568	FG	On-Demand	Bother	CACNA1I	46	34
COC(=O)N1CCC(CNc2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853619570	EE	On-Demand	Anodyne	GRIN2B	22	42
COC(=O)N(C)CCNC(=O)NC(C)(C)c1ccc(Cl)c(Cl)c1	ZINC000853619573	FG	On-Demand	Anodyne	IMDH_CRYPV	40	39
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3cc(C(C)(C)C)ncn3)C2)CC1	ZINC000853619580	GF	On-Demand	Anodyne	GPR119	52	52
COC(=O)N1CCC(CNc2cnc(N3CCCC3=O)cn2)CC1	ZINC000853619583	ED	On-Demand	Anodyne	GRIN2B	20	42
COC(=O)N1CCC(CNc2ccc3c(c2)S(=O)(=O)N=C3Cl)CC1	ZINC000853619585	FE	On-Demand	Anodyne	CACNA1I	42	34
C#CCCN(CCOC)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853619604	FD	On-Demand	Mild	SLC27A4	49	32
COC(=O)Cc1ccnc(NCC2CCN(C(=O)OC)CC2)c1	ZINC000853619605	DD	On-Demand	Anodyne	GRIN2B	30	52
C#CCCN(CCOC)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853619606	FD	On-Demand	Mild	SLC27A4	49	32
CCNc1nccnc1N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853619616	GE	On-Demand	Anodyne	GPR119	45	45
CCNc1nccnc1N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853619619	GE	On-Demand	Anodyne	GPR119	45	45
COC(=O)N1CCC(CNc2nc(C(F)F)nc3ccc(F)cc23)CC1	ZINC000853619639	FH	On-Demand	Anodyne	GRIN2B	37	41
COC(=O)N1CCC(CNc2nc(C(F)F)nc3ccc(F)cc23)CC1	ZINC000853619639	FH	On-Demand	Anodyne	NPY5R	19	41
COC(=O)N1CCC(CNc2cc(C(C)=O)ccn2)CC1	ZINC000853619646	CE	On-Demand	Anodyne	GRIN2B	25	50
COC(=O)N1CCC(CNc2cc(C(C)=O)ccn2)CC1	ZINC000853619646	CE	On-Demand	Anodyne	CACNA1I	53	35
Cn1nnc2c(N3CC[C@@H](N4CCN(C(=O)OC(C)(C)C)CC4)C3)ncnc21	ZINC000853619671	GC	On-Demand	Anodyne	GPR119	40	41
Cn1nnc2c(N3CC[C@H](N4CCN(C(=O)OC(C)(C)C)CC4)C3)ncnc21	ZINC000853619673	GC	On-Demand	Anodyne	GPR119	40	41
COC(=O)N1CCC(CNc2cc(Cl)nc3cc(C)nn23)CC1	ZINC000853619675	EF	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3cc(CO)c(F)cn3)C2)CC1	ZINC000853619701	GD	On-Demand	Anodyne	GPR119	52	44
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3cc(CO)c(F)cn3)C2)CC1	ZINC000853619702	GD	On-Demand	Anodyne	GPR119	52	44
Cn1ncc(C#N)c1N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853619705	FD	On-Demand	Mild	GPR119	38	44
Cn1ncc(C#N)c1N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853619706	FD	On-Demand	Mild	GPR119	38	44
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3ccnc(O)c3[N+](=O)[O-])C2)CC1	ZINC000853619708	GD	On-Demand	Bother	GPR119	50	46
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3ccnc(O)c3[N+](=O)[O-])C2)CC1	ZINC000853619709	GD	On-Demand	Bother	GPR119	50	46
COC(=O)N1CCC(CNc2nc3ncccc3cc2C#N)CC1	ZINC000853619735	EE	On-Demand	Mild	GRIN2B	28	48
COC(=O)N1CCC(CNc2nc3ncccc3cc2C#N)CC1	ZINC000853619735	EE	On-Demand	Mild	BDKRB1	15	41
CCOc1cc(NCC2CCN(C(=O)OC)CC2)c(F)cn1	ZINC000853619742	DF	On-Demand	Anodyne	GRIN2B	21	42
CCOc1cc(NCC2CCN(C(=O)OC)CC2)c(F)cn1	ZINC000853619742	DF	On-Demand	Anodyne	CACNA1I	47	33
COC(=O)N1CCC(CNc2cc(OC)c(C)cc2[N+](=O)[O-])CC1	ZINC000853619746	EF	On-Demand	Bother	HTR4	21	44
COC(=O)c1c([N+](=O)[O-])ccc(NCC2CCN(C(=O)OC)CC2)c1Cl	ZINC000853619755	GF	On-Demand	Bother	CACNA1I	46	33
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3cc(F)ncn3)C2)CC1	ZINC000853619763	FD	On-Demand	Anodyne	GPR119	54	52
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3cc(F)ncn3)C2)CC1	ZINC000853619764	FD	On-Demand	Anodyne	GPR119	54	52
CN(CC1=CCSC1)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853619794	DD	On-Demand	Anodyne	CHRNA7	17	53
CN(CC1=CCSC1)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853619796	DD	On-Demand	Anodyne	CHRNA7	17	53
COC(=O)N1CCC(CNc2cc(Cl)c3ncccc3n2)CC1	ZINC000853619806	EG	On-Demand	Anodyne	GRIN2B	37	47
COC(=O)N1CCC(CNc2cc(Cl)c3ncccc3n2)CC1	ZINC000853619806	EG	On-Demand	Anodyne	CACNA1I	46	38
COC(=O)N1CCC(CNc2cnc(F)cn2)CC1	ZINC000853619808	CD	On-Demand	Anodyne	GRIN2B	23	47
CCOc1cc(NCC2CCN(C(=O)OC)CC2)nc(C)n1	ZINC000853619825	DE	On-Demand	Anodyne	GRIN2B	24	43
CCOc1cc(NCC2CCN(C(=O)OC)CC2)nc(C)n1	ZINC000853619825	DE	On-Demand	Anodyne	CACNA1I	50	33
COC(=O)N1CCC(CNc2ccc(S(N)(=O)=O)c([N+](=O)[O-])c2)CC1	ZINC000853619829	FD	On-Demand	Bother	GRIN2B	24	40
COC(=O)N1CCC(CNc2ccc(S(N)(=O)=O)c([N+](=O)[O-])c2)CC1	ZINC000853619829	FD	On-Demand	Bother	F13A1	43	37
C#CCCN(CCOC)CN1C(=O)C(=O)c2ccccc21	ZINC000853619859	CD	On-Demand	Mild	ALDH1A1	58	41
C#CCCN(CCOC)CN1C(=O)C(=O)c2ccccc21	ZINC000853619859	CD	On-Demand	Mild	ALDH3A1	38	41
C#CCCN(CCOC)CN1C(=O)C(=O)c2ccccc21	ZINC000853619859	CD	On-Demand	Mild	CES1	16	43
CN(CC1=CCSC1)Cn1nnc2c(cnn2C)c1=O	ZINC000853619869	CC	On-Demand	Anodyne	Q9M629_MAIZE	59	37
CCOC(=O)C1(S(C)(=O)=O)CCN(c2nc3ccc(N)cc3s2)CC1	ZINC000853619927	GD	On-Demand	Anodyne	CA2	24	43
CCOC(=O)C1(S(C)(=O)=O)CCN(c2nc3ccc(N)cc3s2)CC1	ZINC000853619927	GD	On-Demand	Anodyne	CA1	15	41
CCOC(=O)C1(S(C)(=O)=O)CCN(c2nc3ccc(N)cc3s2)CC1	ZINC000853619927	GD	On-Demand	Anodyne	CA4	19	41
C#CCCN(CCOC)Cn1c(=O)oc2ccc(C)cc21	ZINC000853619959	CD	On-Demand	Mild	MIF	17	45
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3nc(C#N)c(Cl)s3)C2)CC1	ZINC000853619968	GF	On-Demand	Mild	GPR119	18	41
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3nc(C#N)c(Cl)s3)C2)CC1	ZINC000853619969	GF	On-Demand	Mild	GPR119	18	41
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3ccc(N)c([N+](=O)[O-])n3)C2)CC1	ZINC000853619970	GD	On-Demand	Bother	GPR119	41	44
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3ccc(N)c([N+](=O)[O-])n3)C2)CC1	ZINC000853619971	GD	On-Demand	Bother	GPR119	41	44
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3nccc4c(N)cccc34)C2)CC1	ZINC000853619997	GF	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3nccc4c(N)cccc34)C2)CC1	ZINC000853619998	GF	On-Demand	Anodyne	GPR119	47	45
C#CCCN(CCOC)CN1C(=O)C(=O)c2ccc(OC(F)(F)F)cc21	ZINC000853620016	FE	On-Demand	Mild	CHRM5	15	43
COC(=O)N1CCC(CNc2noc3ccc(S(N)(=O)=O)cc23)CC1	ZINC000853620050	FD	On-Demand	Anodyne	GPR119	36	43
COC(=O)c1ccc(C(F)(F)F)nc1NCC1CCN(C(=O)OC)CC1	ZINC000853620052	GF	On-Demand	Anodyne	GRIN2B	22	42
COC(=O)N1CCC(CNc2cc(C#N)cnn2)CC1	ZINC000853620062	CD	On-Demand	Mild	GRIN2B	21	40
COC(=O)N1CCC(CNc2nccnc2OC2CCC2)CC1	ZINC000853620067	DE	On-Demand	Anodyne	GRIN2B	24	44
COC(=O)N1CCC(CNc2nccnc2OC2CCC2)CC1	ZINC000853620067	DE	On-Demand	Anodyne	GPR119	45	38
COC(=O)N1CCC(CNc2nccnc2OC2CCC2)CC1	ZINC000853620067	DE	On-Demand	Anodyne	SCD	20	41
COC(=O)N1CCC(CNc2cc(C(F)(F)F)cc(C)n2)CC1	ZINC000853620078	EG	On-Demand	Anodyne	GRIN2B	21	40
COC(=O)N1CCC(CNc2cc(C(F)(F)F)cc(C)n2)CC1	ZINC000853620078	EG	On-Demand	Anodyne	CACNA1I	49	44
COC(=O)N1CCC(CNc2ncnc3c2ncn3-c2ccccc2)CC1	ZINC000853620091	FF	On-Demand	Anodyne	ADORA1	42	41
COC(=O)N1CCC(CNc2ncnc3c2ncn3-c2ccccc2)CC1	ZINC000853620091	FF	On-Demand	Anodyne	GRIN2B	28	43
COC(=O)N1CCC(CNc2ncnc3c2ncn3-c2ccccc2)CC1	ZINC000853620091	FF	On-Demand	Anodyne	ADORA3	60	37
COC(=O)N1CCC(CNc2ncnc3c2ncn3-c2ccccc2)CC1	ZINC000853620091	FF	On-Demand	Anodyne	GPR119	20	45
CN(CC1=CCSC1)CN1C[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C1=O	ZINC000853620092	FF	On-Demand	Anodyne	SIGMAR1	29	41
C#Cc1cccnc1N1CCC[C@H](Oc2ccccc2OC)C1	ZINC000853620123	DG	On-Demand	Mild	PDE3A	47	48
C#Cc1cccnc1N1CCC[C@H](Oc2ccccc2OC)C1	ZINC000853620123	DG	On-Demand	Mild	PDE3B	50	46
C#Cc1cccnc1N1CCC[C@@H](Oc2ccccc2OC)C1	ZINC000853620125	DG	On-Demand	Mild	PDE3A	47	48
C#Cc1cccnc1N1CCC[C@@H](Oc2ccccc2OC)C1	ZINC000853620125	DG	On-Demand	Mild	PDE3B	50	46
COC(=O)N1CCC(CNc2nc(C(F)(F)F)ccc2C(C)=O)CC1	ZINC000853620126	FG	On-Demand	Anodyne	GRIN2B	21	40
COC(=O)N1CCC(CNc2ccnc(O)c2[N+](=O)[O-])CC1	ZINC000853620128	DD	On-Demand	Bother	GRIN2B	24	43
COC(=O)N1CCC(CNc2ncnc3c2nnn3C)CC1	ZINC000853620180	DC	On-Demand	Anodyne	GPR119	17	44
Cc1ccc(N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)nn1	ZINC000853620181	ED	On-Demand	Anodyne	GPR119	49	46
CC(=O)c1ccnc(N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	ZINC000853620194	FE	On-Demand	Anodyne	GPR119	51	50
CC(=O)c1ccnc(N2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	ZINC000853620195	FE	On-Demand	Anodyne	GPR119	51	50
C#CCCN(CCOC)CN1C(=O)C(=O)c2cc(-c3ccccc3)ccc21	ZINC000853620227	FF	On-Demand	Mild	ALDH1A1	51	35
C#Cc1cccnc1N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853620243	FE	On-Demand	Mild	GPR119	43	48
C#Cc1cccnc1N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853620244	FE	On-Demand	Mild	GPR119	43	48
CCOC(=O)C1(S(C)(=O)=O)CCN(c2nc3ncccc3cc2C#N)CC1	ZINC000853620273	GD	On-Demand	Mild	P2RY12	35	43
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3cc(C#N)cnn3)C2)CC1	ZINC000853620295	FD	On-Demand	Mild	GPR119	40	48
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3cc(C#N)cnn3)C2)CC1	ZINC000853620298	FD	On-Demand	Mild	GPR119	40	48
COC(=O)N1CCC(CNc2ccccc2S(=O)(=O)N(C)C)CC1	ZINC000853620316	FD	On-Demand	Anodyne	GRIN2B	33	43
COC(=O)N1CCC(CNc2ccccc2S(=O)(=O)N(C)C)CC1	ZINC000853620316	FD	On-Demand	Anodyne	CCR8	61	39
COC(=O)N1CCC(CNc2cc(C(C)(C)C)ncn2)CC1	ZINC000853620325	DF	On-Demand	Anodyne	GRIN2B	23	46
COC(=O)N1CCC(CNc2cc(C(C)(C)C)ncn2)CC1	ZINC000853620325	DF	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)N1CCC(CNc2cc(C(C)(C)C)ncn2)CC1	ZINC000853620325	DF	On-Demand	Anodyne	GPR119	59	42
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3cc(O)nc4cccnc34)C2)CC1	ZINC000853620336	GE	On-Demand	Anodyne	GPR119	41	45
COC(=O)N1CCC(CNc2nc3ccc(S(N)(=O)=O)cc3[nH]2)CC1	ZINC000853620337	FD	On-Demand	Anodyne	GRIN2B	42	40
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3cc(O)nc4cccnc34)C2)CC1	ZINC000853620339	GE	On-Demand	Anodyne	GPR119	41	45
CC(C)(C)OC(=O)N1CCN([C@@H]2CCN(c3cnc(F)cn3)C2)CC1	ZINC000853620343	FD	On-Demand	Anodyne	GPR119	50	49
CC(C)(C)OC(=O)N1CCN([C@H]2CCN(c3cnc(F)cn3)C2)CC1	ZINC000853620346	FD	On-Demand	Anodyne	GPR119	50	49
COC(=O)N1CCC(CNc2ncnc(F)c2Br)CC1	ZINC000853620369	EE	On-Demand	Anodyne	GRIN2B	22	43
COC(=O)N1CCC(CNc2ncnc(F)c2Br)CC1	ZINC000853620369	EE	On-Demand	Anodyne	GPR119	46	42
C#Cc1cccnc1NCC1CCN(C(=O)OC)CC1	ZINC000853620390	CD	On-Demand	Mild	GRIN2B	28	48
COC(=O)N1CCC(CNc2cc(CO)c(F)cn2)CC1	ZINC000853620399	CD	On-Demand	Anodyne	GRIN2B	24	45
COC(=O)c1nccc(N2CC[C@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853620433	GD	On-Demand	Anodyne	GPR119	50	51
COC(=O)c1nccc(N2CC[C@@H](N3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853620434	GD	On-Demand	Anodyne	GPR119	50	51
COC(=O)N1CCC(CNc2cc(O)nc3cccnc23)CC1	ZINC000853620443	DE	On-Demand	Anodyne	GRIN2B	42	48
COC(=O)N1CCC(CNc2nc(-c3cc(OC)cc(OC)c3)no2)CC1	ZINC000853620458	GF	On-Demand	Anodyne	GRIN2B	20	44
COC(=O)N1CCC(CNc2cc(N3CCC(C)(O)CC3)ncn2)CC1	ZINC000853620459	FD	On-Demand	Anodyne	GRIN2B	21	43
COC(=O)N1CCC(CNc2nccc3c(N)cccc23)CC1	ZINC000853620468	DF	On-Demand	Anodyne	HTR4	28	40
COC(=O)N1CCC(CNc2nccc3c(N)cccc23)CC1	ZINC000853620468	DF	On-Demand	Anodyne	GRIN2B	33	47
COC(=O)N1CCC(CNc2nc(C3CC3)ncc2Br)CC1	ZINC000853620487	FG	On-Demand	Anodyne	GRIN2B	20	42
COC(=O)N1CCC(CNc2ccc(C(F)F)cc2[N+](=O)[O-])CC1	ZINC000853620513	EG	On-Demand	Bother	GRIN2B	20	41
COC(=O)N1CCC(CNc2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853620515	FG	On-Demand	Anodyne	PDGFRB	43	35
COC(=O)N1CCC(CNc2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853620515	FG	On-Demand	Anodyne	GRIN2B	27	47
COC(=O)N1CCC(CNc2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853620515	FG	On-Demand	Anodyne	KDR	49	35
COC(=O)N1CCC(CNc2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853620515	FG	On-Demand	Anodyne	PDGFRA	40	34
COC(=O)N1CCC(CNc2nccnc2-c2ccccc2)CC1	ZINC000853620520	EG	On-Demand	Anodyne	P2RY12	77	34
COC(=O)N1CCC(CNc2nccnc2-c2ccccc2)CC1	ZINC000853620520	EG	On-Demand	Anodyne	GRIN2B	44	51
COC(=O)N1CCC(CNc2nccnc2-c2ccccc2)CC1	ZINC000853620520	EG	On-Demand	Anodyne	SCD	19	41
COC(=O)N1CCC(CNc2nccnc2-c2ccccc2)CC1	ZINC000853620520	EG	On-Demand	Anodyne	VCP	46	37
C#CCCCOc1cccnc1NCC1CCN(C(=O)OC)CC1	ZINC000853620523	EF	On-Demand	Mild	GRIN2B	25	45
COC(=O)N1CCC(CNc2cc(OC)ncc2Br)CC1	ZINC000853620524	FF	On-Demand	Anodyne	GRIN2B	22	43
COC(=O)N1CCC(CNc2cc(OC)ncc2Br)CC1	ZINC000853620524	FF	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)N1CCC(CNc2ccc(C)nn2)CC1	ZINC000853620526	CD	On-Demand	Anodyne	GRIN2B	24	46
COC(=O)N1CCC(CNc2ccc(C)nn2)CC1	ZINC000853620526	CD	On-Demand	Anodyne	CACNA1I	41	33
COC(=O)N1CCC(CNc2nc(C)nc(C)c2Br)CC1	ZINC000853620536	FF	On-Demand	Anodyne	GRIN2B	19	40
CCCc1ccc(NCC2CCN(C(=O)OC)CC2)nn1	ZINC000853620566	CE	On-Demand	Anodyne	GRIN2B	23	43
COC(=O)N1CCC(CNc2nc(N)c3cnn(C(C)(C)C)c3n2)CC1	ZINC000853620602	FE	On-Demand	Anodyne	GRIN2B	22	44
COC(=O)N1CCC(CNc2ccc(N)c([N+](=O)[O-])n2)CC1	ZINC000853620603	DD	On-Demand	Bother	GRIN2B	23	42
COC(=O)N1CCC(CNc2ccc(C(=O)C3CC3)cc2S(N)(=O)=O)CC1	ZINC000853620606	GD	On-Demand	Anodyne	CACNA1I	48	33
COC(=O)N1CCC(CNc2cc(F)ncn2)CC1	ZINC000853620612	CD	On-Demand	Anodyne	GRIN2B	25	47
COC(=O)N1CCC(CNc2cc(F)ncn2)CC1	ZINC000853620612	CD	On-Demand	Anodyne	CACNA1I	42	33
COC(=O)N1CCC(CNc2cc(F)ncn2)CC1	ZINC000853620612	CD	On-Demand	Anodyne	GPR119	48	37
COC(=O)N1CCC(CNc2nc3ccc(N)cc3s2)CC1	ZINC000853620615	DF	On-Demand	Anodyne	GRIN2B	28	42
COC(=O)N1CCC(CNc2nc3ccc(N)cc3s2)CC1	ZINC000853620615	DF	On-Demand	Anodyne	LCK	22	40
COC(=O)N1CCC(CNc2nc3ccc(N)cc3s2)CC1	ZINC000853620615	DF	On-Demand	Anodyne	CSNK1D	43	40
COC(=O)N1CCC(CNc2nc3ccc(N)cc3s2)CC1	ZINC000853620615	DF	On-Demand	Anodyne	NMT1	27	41
COC(=O)N1CCC(CNc2nc3ccc(N)cc3s2)CC1	ZINC000853620615	DF	On-Demand	Anodyne	NPY5R	21	45
COC(=O)N1CCC(CNc2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1	ZINC000853620620	ED	On-Demand	Bother	GRIN2B	20	40
COC(=O)N1CCC(CNc2cc(CO)cc(C)n2)CC1	ZINC000853620657	CD	On-Demand	Anodyne	GRIN2B	27	44
COC(=O)N1CCC(CNc2cc(CO)cc(C)n2)CC1	ZINC000853620657	CD	On-Demand	Anodyne	CACNA1I	41	32
COC(=O)N1CCC(CNc2nc(C#N)ccc2C)CC1	ZINC000853620664	CE	On-Demand	Mild	GRIN2B	23	44
C#CCCN(CCOC)Cn1nnc2c(cnn2C)c1=O	ZINC000853620794	CB	On-Demand	Mild	Q9M629_MAIZE	64	39
COC(=O)c1nccc(N2CC(O)(c3ccccc3)C2)n1	ZINC000853620930	CC	On-Demand	Anodyne	SORD	60	40
C#CCCN(CCOC)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853620948	ED	On-Demand	Mild	SLC27A4	51	34
C#CCCN(CCOC)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853620949	ED	On-Demand	Mild	SLC27A4	51	34
Cc1nc([C@@H](C)Nc2cnc(F)cn2)n[nH]1	ZINC000853620961	BD	On-Demand	Anodyne	JAK2	19	41
C#CCCN(CCOC)CN1Cc2ccc(OC)cc2C1=O	ZINC000853621031	DD	On-Demand	Mild	ADAM17	40	44
CCOC(=O)c1nccc(N2CC(O)(c3ccccc3)C2)n1	ZINC000853621097	CD	On-Demand	Anodyne	SORD	62	38
Cc1nc([C@@H](C)Nc2ccc3c(c2)S(=O)(=O)N=C3Cl)n[nH]1	ZINC000853621140	ED	On-Demand	Anodyne	ABCC8	44	35
Cc1cc(C(F)(F)F)cc(N2CC(O)(c3ccccc3)C2)n1	ZINC000853621196	DG	On-Demand	Anodyne	TACR1	28	41
CON(C)CCNC(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000853621216	GD	On-Demand	Anodyne	HRH2	24	41
CON(C)CCNC(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000853621216	GD	On-Demand	Anodyne	NAMPT	52	52
Cn1c(=O)n(CN2CCc3c(cccc3C(N)=O)C2)c2ccccc21	ZINC000853621383	ED	On-Demand	Anodyne	PARP1	17	42
Cn1nnc2c(N3CCC[C@@H]3COC(=O)NC3CCCCC3)ncnc21	ZINC000853621401	FD	On-Demand	Anodyne	SIRT3	55	34
Cn1nnc2c(N3CCC[C@@H]3COC(=O)NC3CCCCC3)ncnc21	ZINC000853621401	FD	On-Demand	Anodyne	SIRT2	43	34
Cn1nnc2c(N3CCC[C@H]3COC(=O)NC3CCCCC3)ncnc21	ZINC000853621402	FD	On-Demand	Anodyne	SIRT3	55	34
Cn1nnc2c(N3CCC[C@H]3COC(=O)NC3CCCCC3)ncnc21	ZINC000853621402	FD	On-Demand	Anodyne	SIRT2	43	34
NC(=O)c1cccc2c1CCN(CN1C(=O)N[C@H](Cc3ccccc3)C1=O)C2	ZINC000853621447	GD	On-Demand	Anodyne	GHRL	40	33
NC(=O)c1cccc2c1CCN(CN1C(=O)N[C@@H](Cc3ccccc3)C1=O)C2	ZINC000853621448	GD	On-Demand	Anodyne	GHRL	40	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc2c(c1)CCO2	ZINC000853621475	GF	On-Demand	Anodyne	GPR119	22	42
Cc1ccc(-c2nc(=S)n(CN3CCc4c(cccc4C(N)=O)C3)[nH]2)cc1	ZINC000853621483	GG	On-Demand	Anodyne	PARP2	58	38
Cc1ccc(-c2nc(=S)n(CN3CCc4c(cccc4C(N)=O)C3)[nH]2)cc1	ZINC000853621483	GG	On-Demand	Anodyne	PARP1	58	44
CCOC(=O)c1nccc(N2CCC[C@H]2COC(=O)NC2CCCCC2)n1	ZINC000853621498	GF	On-Demand	Anodyne	FAAH	18	42
CCOC(=O)c1nccc(N2CCC[C@@H]2COC(=O)NC2CCCCC2)n1	ZINC000853621499	GF	On-Demand	Anodyne	FAAH	18	42
NC(=O)c1cc(N2CCC[C@H]2COC(=O)NC2CCCCC2)ccc1[N+](=O)[O-]	ZINC000853621505	GF	On-Demand	Bother	FAAH	18	43
NC(=O)c1cc(N2CCC[C@@H]2COC(=O)NC2CCCCC2)ccc1[N+](=O)[O-]	ZINC000853621506	GF	On-Demand	Bother	FAAH	18	43
CN1C(=O)C(=O)N(CN2CCc3c(cccc3C(N)=O)C2)C1=O	ZINC000853621555	DB	On-Demand	Anodyne	PARP1	15	44
CCn1c(C2CC2)nn(CN2CCc3c(cccc3C(N)=O)C2)c1=S	ZINC000853621575	FE	On-Demand	Anodyne	PARP1	15	40
COc1ccc(-c2nc(=S)n(CN3CCc4c(cccc4C(N)=O)C3)[nH]2)cc1	ZINC000853621580	GF	On-Demand	Anodyne	PARP2	54	37
COc1ccc(-c2nc(=S)n(CN3CCc4c(cccc4C(N)=O)C3)[nH]2)cc1	ZINC000853621580	GF	On-Demand	Anodyne	PARP1	51	46
COc1ccc(-c2nnn(CN3CCc4c(cccc4C(N)=O)C3)n2)cc1OC	ZINC000853621582	GD	On-Demand	Anodyne	ABCB1B	55	35
COc1ccc(-c2nnn(CN3CCc4c(cccc4C(N)=O)C3)n2)cc1OC	ZINC000853621582	GD	On-Demand	Anodyne	PARP1	24	45
NC(=O)c1cccc2c1CCN(Cn1nc(N3CCOCC3)sc1=S)C2	ZINC000853621687	GD	On-Demand	Anodyne	PIK3CB	18	41
C[C@@H]1CCN(CN2C(=O)C(=O)c3ccccc32)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853621727	FD	On-Demand	Anodyne	ALDH3A1	38	44
C#CCCCOc1cccnc1N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000853621739	GH	On-Demand	Mild	ETHR	53	36
NC(=O)c1cccc2c1CCN(CN1C[C@]3(CN4CCC3CC4)OC1=O)C2	ZINC000853621750	FD	On-Demand	Anodyne	CHRNA7	16	46
NC(=O)c1cccc2c1CCN(CN1C[C@@]3(CN4CCC3CC4)OC1=O)C2	ZINC000853621751	FD	On-Demand	Anodyne	CHRNA7	16	46
COC(=O)c1nn(CN2CCc3c(cccc3C(N)=O)C2)c2ccccc12	ZINC000853621763	FD	On-Demand	Anodyne	ELANE	16	44
Cn1cnn(CN2CCc3c(cccc3C(N)=O)C2)c1=O	ZINC000853621909	CB	On-Demand	Anodyne	PARP1	19	40
CC(=O)c1ccnc(N[C@@H]2CCC2(C)C)c1	ZINC000853621966	BF	On-Demand	Anodyne	TYK2	51	42
CC(=O)c1ccnc(N[C@H]2CCC2(C)C)c1	ZINC000853621968	BF	On-Demand	Anodyne	TYK2	51	42
COc1cc2c(cc1OC)N(CN1CCc3c(cccc3C(N)=O)C1)C(=O)C2=O	ZINC000853621970	GD	On-Demand	Anodyne	ABCB1B	52	35
C#CCCN(CCOC)C(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000853621995	GD	On-Demand	Mild	DRD3	40	35
C#CCCN(CCOC)C(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000853621995	GD	On-Demand	Mild	HTR7	15	40
CCOC(=O)c1cnn(CN2CCc3c(cccc3C(N)=O)C2)c1	ZINC000853621999	ED	On-Demand	Anodyne	PARP1	20	41
CCOC(=O)c1cnn(CN2CCc3c(cccc3C(N)=O)C2)c1	ZINC000853621999	ED	On-Demand	Anodyne	NOD2	32	41
CCOc1ccc(-c2nnn(CN3CCc4c(cccc4C(N)=O)C3)n2)cc1	ZINC000853622019	GD	On-Demand	Anodyne	NOD2	25	40
O=C(CCC(F)(F)F)N1CCC[C@@H](Nc2ncnc(F)c2Br)C1	ZINC000853622049	GG	On-Demand	Anodyne	ETHR	56	37
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	HTR1A	41	40
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	DRD2	41	40
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	ADRA1D	42	38
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	ADRA1A	40	38
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	DRD3	52	39
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	HTR7	39	43
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	KCNQ2	46	36
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853622083	GF	On-Demand	Reactive	P2RX7	44	37
COC(=O)c1cn(CN2CCc3c(cccc3C(N)=O)C2)nn1	ZINC000853622100	DC	On-Demand	Anodyne	NOD2	40	36
CC(C)[C@H]1CCN(CN2CCc3c(cccc3C(N)=O)C2)C1=O	ZINC000853622158	DD	On-Demand	Anodyne	PARP1	19	42
CC(C)c1ccc2ncnc(NCc3cnn(C)n3)c2c1	ZINC000853622196	CE	On-Demand	Anodyne	CLK4	62	38
COCCN(CCF)C(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000853622259	GD	On-Demand	Anodyne	MC4R	18	42
Cn1ncc2c(=O)n(CN3CCc4c(cccc4C(N)=O)C3)nnc21	ZINC000853622262	EB	On-Demand	Anodyne	Q9M629_MAIZE	50	33
COc1cccc([C@H]2CC(=O)N(CN3CCc4c(cccc4C(N)=O)C3)C2)c1	ZINC000853622510	GE	On-Demand	Anodyne	DRD4	41	33
Cn1ncc2c(=O)n(CN3C[C@]45CCCC[C@@]4(COC5)C3)nnc21	ZINC000853622624	EC	On-Demand	Anodyne	Q9M629_MAIZE	53	35
Cn1ncc2c(=O)n(CN3C[C@@]45CCCC[C@]4(COC5)C3)nnc21	ZINC000853622625	EC	On-Demand	Anodyne	Q9M629_MAIZE	53	35
Cn1ncc2c(=O)n(CN3C[C@]45CCCC[C@]4(COC5)C3)nnc21	ZINC000853622626	EC	On-Demand	Anodyne	Q9M629_MAIZE	53	35
CON(C)CCNC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000853622852	FC	On-Demand	Anodyne	DRD3	42	36
CON(C)CCNC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000853622852	FC	On-Demand	Anodyne	HTR7	26	41
CON(C)CCNC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000853622852	FC	On-Demand	Anodyne	KCNQ2	44	33
O=C1O[C@]2(CN3CCC2CC3)CN1CN1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853622892	FD	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@]2(CN3CCC2CC3)CN1CN1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853622893	FD	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@]2(CN3CCC2CC3)CN1CN1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853622894	FD	On-Demand	Anodyne	CHRNA7	17	56
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853622895	FD	On-Demand	Anodyne	CHRNA7	17	56
C#Cc1cccnc1N[C@@H]1CCCN(C(=O)CCC(F)(F)F)C1	ZINC000853622896	EF	On-Demand	Mild	ETHR	57	39
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853622979	GF	On-Demand	Reactive	AVPR2	28	41
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853622979	GF	On-Demand	Reactive	MC4R	36	41
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853622979	GF	On-Demand	Reactive	KCNQ2	42	35
CC(=O)N1CCN(c2ccccc2CNC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853622979	GF	On-Demand	Reactive	NPY2R	85	40
COC(=O)N(C)CCNC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1	ZINC000853622985	GC	On-Demand	Anodyne	HTR7	21	40
CC(C)c1ccc2ncnc(N[C@H](C)[C@@H](C)O)c2c1	ZINC000853623409	CF	On-Demand	Anodyne	CD38	36	42
CC(C)c1ccc2ncnc(N[C@H](C)[C@H](C)O)c2c1	ZINC000853623410	CF	On-Demand	Anodyne	CD38	36	42
CC(C)c1ccc2ncnc(N[C@@H](C)[C@H](C)O)c2c1	ZINC000853623411	CF	On-Demand	Anodyne	CD38	36	42
CC(C)c1ccc2ncnc(N[C@@H](C)[C@@H](C)O)c2c1	ZINC000853623412	CF	On-Demand	Anodyne	CD38	36	42
CC(=O)N1CCN(c2ccccc2CNC(=O)NCc2ncccn2)CC1	ZINC000853623566	FD	On-Demand	Anodyne	MC4R	41	38
CC(=O)N1CCN(c2ccccc2CNC(=O)NCc2ncccn2)CC1	ZINC000853623566	FD	On-Demand	Anodyne	KCNQ2	44	35
C[C@@H]1CCN(CN2CCN(Cc3cccnc3)C2=O)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853623576	GD	On-Demand	Anodyne	CHRNA7	43	35
CC(=O)c1ccc(N[C@H](C)[C@@H](C)O)c(I)c1	ZINC000853623643	EF	On-Demand	Anodyne	AKR1C3	15	41
CC(=O)c1ccc(N[C@@H](C)[C@@H](C)O)c(I)c1	ZINC000853623644	EF	On-Demand	Anodyne	AKR1C3	15	41
CC(=O)c1ccc(N[C@H](C)[C@H](C)O)c(I)c1	ZINC000853623645	EF	On-Demand	Anodyne	AKR1C3	15	41
CC(=O)c1ccc(N[C@@H](C)[C@H](C)O)c(I)c1	ZINC000853623646	EF	On-Demand	Anodyne	AKR1C3	15	41
CC(C)(C)OC(=O)NCCc1ccc(CNC(=O)N2CCC3(COC3)C2)cc1	ZINC000853623699	GF	On-Demand	Anodyne	EPHX2	15	40
O=C(CCC(F)(F)F)N1CCC[C@@H](Nc2cc(F)ncn2)C1	ZINC000853623836	DE	On-Demand	Anodyne	ETHR	57	38
C#C[C@H](NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1)C1CCOCC1	ZINC000853623855	GD	On-Demand	Mild	MC4R	40	36
C#C[C@@H](NC(=O)NCc1ccccc1N1CCN(C(C)=O)CC1)C1CCOCC1	ZINC000853623856	GD	On-Demand	Mild	MC4R	40	36
O=C(CCC(F)(F)F)N1CCC[C@@H](Nc2cnc(F)cn2)C1	ZINC000853623876	DE	On-Demand	Anodyne	ETHR	57	38
CN(C)CCC[C@@H]1CN(CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCO1	ZINC000853623948	GD	On-Demand	Bother	SLC27A4	42	32
CN(C)CCC[C@@H]1CN(CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CCO1	ZINC000853623951	GD	On-Demand	Bother	SLC27A4	42	32
Fc1cnc(N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)cn1	ZINC000853624002	EE	On-Demand	Anodyne	DCK	44	34
Fc1cnc(N2CC[C@@H](Oc3cccnc3N3CCCC3)C2)cn1	ZINC000853624002	EE	On-Demand	Anodyne	PDE3B	41	37
Fc1cnc(N2CC[C@H](Oc3cccnc3N3CCCC3)C2)cn1	ZINC000853624003	EE	On-Demand	Anodyne	DCK	44	34
Fc1cnc(N2CC[C@H](Oc3cccnc3N3CCCC3)C2)cn1	ZINC000853624003	EE	On-Demand	Anodyne	PDE3B	41	37
CN(C)CCC[C@@H]1CN(CN2C(=O)C(=O)c3ccccc32)CCO1	ZINC000853624032	ED	On-Demand	Anodyne	ALDH1A1	40	39
CN(C)CCC[C@@H]1CN(CN2C(=O)C(=O)c3ccccc32)CCO1	ZINC000853624032	ED	On-Demand	Anodyne	ALDH3A1	39	45
C[C@@H]1CCN(Cn2nnc3c(cnn3C)c2=O)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853624496	FB	On-Demand	Anodyne	Q9M629_MAIZE	50	34
C=CCSc1nc2ccccc2n1CN1CCC(NC(=O)OC)CC1	ZINC000853624766	FG	On-Demand	Mild	TNKS	40	31
COc1cccc(Nc2nc(N[C@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624787	EE	On-Demand	Anodyne	PDPK1	17	45
COc1cccc(Nc2nc(N[C@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624787	EE	On-Demand	Anodyne	SYK	15	42
COc1cccc(Nc2nc(N[C@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624787	EE	On-Demand	Anodyne	CDK1	19	44
COc1cccc(Nc2nc(N[C@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624787	EE	On-Demand	Anodyne	DYRK1A	15	40
COc1cccc(Nc2nc(N[C@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624787	EE	On-Demand	Anodyne	CCNB_PATPE	73	40
COc1cccc(Nc2nc(N[C@@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624788	EE	On-Demand	Anodyne	PDPK1	17	45
COc1cccc(Nc2nc(N[C@@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624788	EE	On-Demand	Anodyne	SYK	15	42
COc1cccc(Nc2nc(N[C@@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624788	EE	On-Demand	Anodyne	CDK1	19	44
COc1cccc(Nc2nc(N[C@@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624788	EE	On-Demand	Anodyne	DYRK1A	15	40
COc1cccc(Nc2nc(N[C@@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624788	EE	On-Demand	Anodyne	CCNB_PATPE	73	40
COc1cccc(Nc2nc(N[C@@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624789	EE	On-Demand	Anodyne	PDPK1	17	45
COc1cccc(Nc2nc(N[C@@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624789	EE	On-Demand	Anodyne	SYK	15	42
COc1cccc(Nc2nc(N[C@@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624789	EE	On-Demand	Anodyne	CDK1	19	44
COc1cccc(Nc2nc(N[C@@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624789	EE	On-Demand	Anodyne	DYRK1A	15	40
COc1cccc(Nc2nc(N[C@@H](C)[C@@H](C)O)nc3[nH]cnc23)c1	ZINC000853624789	EE	On-Demand	Anodyne	CCNB_PATPE	73	40
COc1cccc(Nc2nc(N[C@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624790	EE	On-Demand	Anodyne	PDPK1	17	45
COc1cccc(Nc2nc(N[C@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624790	EE	On-Demand	Anodyne	SYK	15	42
COc1cccc(Nc2nc(N[C@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624790	EE	On-Demand	Anodyne	CDK1	19	44
COc1cccc(Nc2nc(N[C@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624790	EE	On-Demand	Anodyne	DYRK1A	15	40
COc1cccc(Nc2nc(N[C@H](C)[C@H](C)O)nc3[nH]cnc23)c1	ZINC000853624790	EE	On-Demand	Anodyne	CCNB_PATPE	73	40
COC(=O)c1nn(CN2CCO[C@@H](CCCN(C)C)C2)c2ccccc12	ZINC000853625022	FD	On-Demand	Anodyne	HTR4	31	41
COC(=O)c1nn(CN2CCO[C@H](CCCN(C)C)C2)c2ccccc12	ZINC000853625023	FD	On-Demand	Anodyne	HTR4	31	41
CCOC(=O)c1cnn(CN2CCC(NC(=O)OC)CC2)c1	ZINC000853625401	DC	On-Demand	Anodyne	SSTR5	51	40
CCn1c(-c2cccc(C)c2)nn(CN2CCC(NC(=O)OC)CC2)c1=S	ZINC000853625527	GG	On-Demand	Anodyne	FAAH	17	41
O=C1C(=O)N(CN2C[C@]34CCCC[C@]3(COC4)C2)c2ccccc21	ZINC000853625720	EE	On-Demand	Anodyne	ALDH1A1	59	43
O=C1C(=O)N(CN2C[C@]34CCCC[C@]3(COC4)C2)c2ccccc21	ZINC000853625720	EE	On-Demand	Anodyne	ALDH3A1	43	50
O=C1C(=O)N(CN2C[C@]34CCCC[C@]3(COC4)C2)c2ccccc21	ZINC000853625720	EE	On-Demand	Anodyne	CES1	17	43
O=C1C(=O)N(CN2C[C@]34CCCC[C@@]3(COC4)C2)c2ccccc21	ZINC000853625723	EE	On-Demand	Anodyne	ALDH1A1	59	43
O=C1C(=O)N(CN2C[C@]34CCCC[C@@]3(COC4)C2)c2ccccc21	ZINC000853625723	EE	On-Demand	Anodyne	ALDH3A1	43	50
O=C1C(=O)N(CN2C[C@]34CCCC[C@@]3(COC4)C2)c2ccccc21	ZINC000853625723	EE	On-Demand	Anodyne	CES1	17	43
O=C1C(=O)N(CN2C[C@@]34CCCC[C@]3(COC4)C2)c2ccccc21	ZINC000853625727	EE	On-Demand	Anodyne	ALDH1A1	59	43
O=C1C(=O)N(CN2C[C@@]34CCCC[C@]3(COC4)C2)c2ccccc21	ZINC000853625727	EE	On-Demand	Anodyne	ALDH3A1	43	50
O=C1C(=O)N(CN2C[C@@]34CCCC[C@]3(COC4)C2)c2ccccc21	ZINC000853625727	EE	On-Demand	Anodyne	CES1	17	43
CN(C)CCC[C@@H]1CN(Cn2nnc3c(cnn3C)c2=O)CCO1	ZINC000853625928	EB	On-Demand	Anodyne	Q9M629_MAIZE	58	34
CCOc1ccccc1-c1nn(CN2CCC(NC(=O)OC)CC2)c(=S)o1	ZINC000853626345	GG	On-Demand	Anodyne	SSTR5	68	35
CCOc1ccccc1-c1nn(CN2CCC(NC(=O)OC)CC2)c(=S)o1	ZINC000853626345	GG	On-Demand	Anodyne	HCN1	46	31
CCOc1ccccc1-c1nn(CN2CCC(NC(=O)OC)CC2)c(=S)o1	ZINC000853626345	GG	On-Demand	Anodyne	HCN4	40	31
CCOc1ccc(-c2nnn(CN3CCC(NC(=O)OC)CC3)n2)cc1	ZINC000853626413	FD	On-Demand	Anodyne	SSTR5	49	37
CCOc1ccc(-c2nnn(CN3CCC(NC(=O)OC)CC3)n2)cc1	ZINC000853626413	FD	On-Demand	Anodyne	FAAH	24	43
CCOc1ccc(-c2nnn(CN3CCC(NC(=O)OC)CC3)n2)cc1	ZINC000853626413	FD	On-Demand	Anodyne	SCARB1	40	43
C=CCc1cc(CN2CCC(NC(=O)OC)CC2)c(O)c(OC)c1	ZINC000853626510	EE	On-Demand	Mild	SIGMAR1	15	48
C=CCc1cc(CN2CCC(NC(=O)OC)CC2)c(O)c(OC)c1	ZINC000853626510	EE	On-Demand	Mild	SSTR5	63	43
C=CCc1cc(CN2CCC(NC(=O)OC)CC2)c(O)c(OC)c1	ZINC000853626510	EE	On-Demand	Mild	MCHR1	25	42
C=CCc1cc(OCC)cc(CN2CCC(NC(=O)OC)CC2)c1O	ZINC000853626530	EF	On-Demand	Mild	SSTR5	53	38
C=CCc1cc(OCC)cc(CN2CCC(NC(=O)OC)CC2)c1O	ZINC000853626530	EF	On-Demand	Mild	MCHR1	21	45
COC(=O)c1nccc(N2CC(OC(=O)NC(C)C)C2)n1	ZINC000853626572	CC	On-Demand	Anodyne	SORD	68	46
CN(C[C@@H]1CC1(C)C)CN1C(=O)C(=O)c2ccccc21	ZINC000853626588	CE	On-Demand	Anodyne	ALDH1A1	62	45
CN(C[C@@H]1CC1(C)C)CN1C(=O)C(=O)c2ccccc21	ZINC000853626588	CE	On-Demand	Anodyne	ALDH3A1	41	45
CN(C[C@@H]1CC1(C)C)CN1C(=O)C(=O)c2ccccc21	ZINC000853626588	CE	On-Demand	Anodyne	CES1	19	44
COc1ccc(-c2nccc(N3CC(OC(=O)NC(C)C)C3)n2)cc1	ZINC000853626672	EE	On-Demand	Anodyne	SORD	58	36
CN(C[C@@H]1CC1(C)C)Cn1nc(-c2ccc(F)c(F)c2)c2ccccc2c1=O	ZINC000853626864	GI	On-Demand	Anodyne	HRH1	22	41
CN(C[C@H]1CC1(C)C)Cn1nc(-c2ccc(F)c(F)c2)c2ccccc2c1=O	ZINC000853626865	GI	On-Demand	Anodyne	HRH1	22	41
CN(C[C@@H]1CC1(C)C)CN1C(=O)C(=O)N(Cc2ccccc2)C1=O	ZINC000853626890	ED	On-Demand	Anodyne	CTSG	15	45
NC(=O)N1CCC[C@H](CNc2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853626910	FH	On-Demand	Anodyne	CACNA1I	44	30
NC(=O)N1CCC[C@@H](CNc2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853626911	FH	On-Demand	Anodyne	CACNA1I	44	30
CN(C[C@@H]1CC1(C)C)CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853626922	DE	On-Demand	Anodyne	GALR1	45	35
CN(C[C@@H]1CC1(C)C)CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853626922	DE	On-Demand	Anodyne	GHRL	53	34
CN(C[C@@H]1CC1(C)C)CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853626924	DE	On-Demand	Anodyne	GALR1	45	35
CN(C[C@@H]1CC1(C)C)CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853626924	DE	On-Demand	Anodyne	GHRL	53	34
CCOC(=O)c1nccc(N2CC(OC(=O)NC(C)C)C2)n1	ZINC000853626988	DC	On-Demand	Anodyne	SORD	65	43
CON(C)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000853627056	GE	On-Demand	Anodyne	DRD4	22	52
CON(C)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000853627056	GE	On-Demand	Anodyne	SIGMAR1	16	40
CON(C)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000853627056	GE	On-Demand	Anodyne	SSTR5	48	39
CON(C)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000853627056	GE	On-Demand	Anodyne	PDK1	45	36
CON(C)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000853627056	GE	On-Demand	Anodyne	MCHR1	30	42
CON(C)CCNC(=O)NC1CCN(Cc2coc(-c3ccccc3)n2)CC1	ZINC000853627056	GE	On-Demand	Anodyne	PDE8B	55	33
CN(C[C@H]1CC1(C)C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853627071	CF	On-Demand	Bother	F2RL3	43	31
CN(C[C@@H]1CC1(C)C)Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853627072	CF	On-Demand	Bother	F2RL3	43	31
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1Cc2cccc(Cl)c2C1	ZINC000853627253	GG	On-Demand	Anodyne	CA13	23	40
CN(C[C@@H]1CC1(C)C)CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853627306	FE	On-Demand	Bother	SLC27A4	51	35
CN(C[C@@H]1CC1(C)C)CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853627307	FE	On-Demand	Bother	SLC27A4	51	35
Cc1onc2c(=O)n(CN(C)C[C@@H]3CC3(C)C)nc(-c3ccccc3)c12	ZINC000853627345	FG	On-Demand	Anodyne	GRM7	52	33
Cc1onc2c(=O)n(CN(C)C[C@H]3CC3(C)C)nc(-c3ccccc3)c12	ZINC000853627346	FG	On-Demand	Anodyne	GRM7	52	33
COc1ccc(-c2nnn(CN(C)C[C@H]3CC3(C)C)n2)cc1OC	ZINC000853627517	EE	On-Demand	Anodyne	SCARB1	22	43
COc1ccc(-c2nnn(CN(C)C[C@@H]3CC3(C)C)n2)cc1OC	ZINC000853627518	EE	On-Demand	Anodyne	SCARB1	22	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nnc2ccccc2c1=O	ZINC000853627593	FD	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1ncc2ccccc2c1=O	ZINC000853627764	FE	On-Demand	Anodyne	GPR119	34	40
CN(C[C@@H]1CC1(C)C)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853627861	EF	On-Demand	Bother	SLC27A4	52	35
CN(C[C@@H]1CC1(C)C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853627862	EF	On-Demand	Bother	SLC27A4	52	35
CN(C[C@@H]1CC1(C)C)CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853627949	DD	On-Demand	Anodyne	CHRNA7	18	61
CN(C[C@@H]1CC1(C)C)CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853627950	DD	On-Demand	Anodyne	CHRNA7	18	61
COC(=O)c1cnc([C@@H]2CCCN(CN3C(=O)C(=O)c4ccccc43)C2)s1	ZINC000853628045	GE	On-Demand	Anodyne	ALDH3A1	34	40
COC(=O)c1cnc([C@H]2CCCN(CN3C(=O)C(=O)c4ccccc43)C2)s1	ZINC000853628046	GE	On-Demand	Anodyne	ALDH3A1	34	40
CN(C[C@H]1CC1(C)C)Cn1nnc2c(cnn2C)c1=O	ZINC000853628066	CC	On-Demand	Anodyne	Q9M629_MAIZE	59	37
CN(C[C@@H]1CC1(C)C)Cn1nnc2c(cnn2C)c1=O	ZINC000853628067	CC	On-Demand	Anodyne	Q9M629_MAIZE	59	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nc2ccccn2c1=O	ZINC000853628170	FD	On-Demand	Anodyne	GPR119	24	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cc1c(O)ccc2ccncc12	ZINC000853628361	FH	On-Demand	Clean	GPR119	29	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1C(=O)c2ccccc2C1=O	ZINC000853628429	FE	On-Demand	Anodyne	GPR119	31	41
COC(=O)c1cnc([C@H]2CCCN(Cn3nnc4c(cnn4C)c3=O)C2)s1	ZINC000853628433	GC	On-Demand	Anodyne	Q9M629_MAIZE	47	31
COC(=O)c1cnc([C@@H]2CCCN(Cn3nnc4c(cnn4C)c3=O)C2)s1	ZINC000853628434	GC	On-Demand	Anodyne	Q9M629_MAIZE	47	31
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cnc(-c2ccccc2)n1	ZINC000853628452	FF	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853628511	FD	On-Demand	Mild	GPR119	42	49
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853628513	FD	On-Demand	Mild	GPR119	42	49
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nc(C(F)(F)F)ccc1=O	ZINC000853628519	GE	On-Demand	Anodyne	GPR119	46	43
Cc1ccc2c(c1)[C@@H](Nc1cc(F)ncn1)CCC2	ZINC000853628538	CG	On-Demand	Anodyne	KCNN3	19	49
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3cc(O)nc4cccnc34)CC2)C1	ZINC000853628587	GE	On-Demand	Anodyne	GPR119	44	44
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3cc(O)nc4cccnc34)CC2)C1	ZINC000853628589	GE	On-Demand	Anodyne	GPR119	44	44
COc1ccc(-c2nnn(CN3CC4(CCC4)[C@@H]3c3ccncc3)n2)cc1OC	ZINC000853628640	GF	On-Demand	Anodyne	SCARB1	19	40
COc1ccc(-c2nnn(CN3CC4(CCC4)[C@H]3c3ccncc3)n2)cc1OC	ZINC000853628642	GF	On-Demand	Anodyne	SCARB1	19	40
C#Cc1cccnc1N1CCC[C@@H](CCNC(C)=O)C1	ZINC000853628654	CD	On-Demand	Mild	SIRT3	43	39
C#Cc1cccnc1N1CCC[C@@H](CCNC(C)=O)C1	ZINC000853628654	CD	On-Demand	Mild	SIRT2	45	32
C#Cc1cccnc1N1CCC[C@@H](CCNC(C)=O)C1	ZINC000853628654	CD	On-Demand	Mild	SIRT1	41	32
C#Cc1cccnc1N1CCC[C@H](CCNC(C)=O)C1	ZINC000853628656	CD	On-Demand	Mild	SIRT3	43	39
C#Cc1cccnc1N1CCC[C@H](CCNC(C)=O)C1	ZINC000853628656	CD	On-Demand	Mild	SIRT2	45	32
C#Cc1cccnc1N1CCC[C@H](CCNC(C)=O)C1	ZINC000853628656	CD	On-Demand	Mild	SIRT1	41	32
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3ccnc(O)c3[N+](=O)[O-])CC2)C1	ZINC000853628668	GD	On-Demand	Bother	GPR119	48	44
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3ccnc(O)c3[N+](=O)[O-])CC2)C1	ZINC000853628670	GD	On-Demand	Bother	GPR119	48	44
COc1ccc(-c2nn(CN(C)C[C@@H]3CC3(C)C)c(=O)c3ccccc23)cc1	ZINC000853628741	GI	On-Demand	Anodyne	HRH1	15	41
COc1ccc(-c2nn(CN(C)C[C@H]3CC3(C)C)c(=O)c3ccccc23)cc1	ZINC000853628742	GI	On-Demand	Anodyne	HRH1	15	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cc(Cl)cn1	ZINC000853628757	EF	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cccnc1=S	ZINC000853628777	EF	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nc2c(cc1=O)CCCC2	ZINC000853628782	FE	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1ccc(C(F)(F)F)n1	ZINC000853628786	FF	On-Demand	Anodyne	GPR119	48	41
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3cnc(F)cn3)CC2)C1	ZINC000853628868	FD	On-Demand	Anodyne	GPR119	52	49
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3cnc(F)cn3)CC2)C1	ZINC000853628869	FD	On-Demand	Anodyne	GPR119	52	49
COC(=O)c1nccc(N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853628870	GD	On-Demand	Anodyne	GPR119	46	50
COC(=O)c1nccc(N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853628871	GD	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nc2ccccn2c1=S	ZINC000853628892	GF	On-Demand	Anodyne	GPR119	25	40
CC(C)c1ccc2ncnc(NCc3cnnn3C)c2c1	ZINC000853628896	CE	On-Demand	Anodyne	CLK4	59	37
CCCc1ccc(N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853628908	GF	On-Demand	Anodyne	GPR119	46	42
CCCc1ccc(N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853628910	GF	On-Demand	Anodyne	GPR119	46	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853629015	FE	On-Demand	Anodyne	ALDH1A1	41	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853629015	FE	On-Demand	Anodyne	ALDH3A1	37	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1C(=O)C(=O)c2ccccc21	ZINC000853629015	FE	On-Demand	Anodyne	CES1	15	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nc(C(C)(C)C)ccc1=O	ZINC000853629068	GF	On-Demand	Anodyne	GPR119	46	44
CCOc1cc(Nc2ccc(C3(O)COC3)cc2)nc(C)n1	ZINC000853629080	DE	On-Demand	Anodyne	AGPAT2	40	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1C(=O)c2nccnc2C1=O	ZINC000853629123	FD	On-Demand	Anodyne	GPR119	35	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cc(Br)cn1	ZINC000853629144	FF	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3cc(C(C)(C)C)ncn3)CC2)C1	ZINC000853629183	GF	On-Demand	Anodyne	GPR119	51	52
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3cc(C(C)(C)C)ncn3)CC2)C1	ZINC000853629184	GF	On-Demand	Anodyne	GPR119	51	52
Cn1c(=O)n(CN2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c2cnccc21	ZINC000853629298	FD	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cc(-c2ccncn2)cn1	ZINC000853629313	FE	On-Demand	Anodyne	GPR119	31	43
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3nccc4c(N)cccc34)CC2)C1	ZINC000853629416	GF	On-Demand	Anodyne	GPR119	46	44
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3nccc4c(N)cccc34)CC2)C1	ZINC000853629417	GF	On-Demand	Anodyne	GPR119	46	44
CC(=O)c1ccnc(N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853629451	FE	On-Demand	Anodyne	GPR119	49	49
CC(=O)c1ccnc(N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853629451	FE	On-Demand	Anodyne	L3MBTL3	51	37
CC(=O)c1ccnc(N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853629452	FE	On-Demand	Anodyne	GPR119	49	49
CC(=O)c1ccnc(N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853629452	FE	On-Demand	Anodyne	L3MBTL3	51	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1Cc2ncccc2C1=O	ZINC000853629589	FE	On-Demand	Anodyne	GPR119	33	42
Cn1nnc2c(N3CCN([C@@H]4CCN(C(=O)OC(C)(C)C)C4)CC3)ncnc21	ZINC000853629714	GC	On-Demand	Anodyne	GPR119	42	41
Cn1nnc2c(N3CCN([C@H]4CCN(C(=O)OC(C)(C)C)C4)CC3)ncnc21	ZINC000853629715	GC	On-Demand	Anodyne	GPR119	42	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1ccc(Br)n1	ZINC000853629769	FF	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nc(-c2ccccc2)ccc1=O	ZINC000853629847	GF	On-Demand	Anodyne	P2RY12	53	34
Fc1ccc2[nH]cc(C3CCN(c4cnc(F)cn4)CC3)c2c1	ZINC000853629872	DH	On-Demand	Anodyne	HTR1D	23	44
Fc1ccc2[nH]cc(C3CCN(c4cnc(F)cn4)CC3)c2c1	ZINC000853629872	DH	On-Demand	Anodyne	HTR1B	20	46
Fc1ccc2[nH]cc(C3CCN(c4cnc(F)cn4)CC3)c2c1	ZINC000853629872	DH	On-Demand	Anodyne	SLC6A4	23	51
Fc1ccc2[nH]cc(C3CCN(c4cnc(F)cn4)CC3)c2c1	ZINC000853629872	DH	On-Demand	Anodyne	HTR1F	53	44
Fc1ccc2[nH]cc(C3CCN(c4cnc(F)cn4)CC3)c2c1	ZINC000853629872	DH	On-Demand	Anodyne	MPO	67	36
Cn1ncc(C#N)c1N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853629940	FD	On-Demand	Mild	GPR119	46	43
Cn1ncc(C#N)c1N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853629942	FD	On-Demand	Mild	GPR119	46	43
CCNc1nccnc1N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853629961	GE	On-Demand	Anodyne	GPR119	46	45
CCNc1nccnc1N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853629963	GE	On-Demand	Anodyne	GPR119	46	45
C[C@H]1c2ccccc2OCCN1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000853630016	EG	On-Demand	Bother	F2RL3	45	32
Cc1cc(CO)cc(N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853630022	GE	On-Demand	Anodyne	GPR119	39	49
Cc1cc(CO)cc(N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853630023	GE	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cc([N+](=O)[O-])cn1	ZINC000853630076	ED	On-Demand	Bother	GPR119	27	40
Fc1ccc2[nH]cc(C3CCN(c4cc(F)ncn4)CC3)c2c1	ZINC000853630085	DH	On-Demand	Anodyne	HTR1D	22	44
Fc1ccc2[nH]cc(C3CCN(c4cc(F)ncn4)CC3)c2c1	ZINC000853630085	DH	On-Demand	Anodyne	HTR1B	21	46
Fc1ccc2[nH]cc(C3CCN(c4cc(F)ncn4)CC3)c2c1	ZINC000853630085	DH	On-Demand	Anodyne	SLC6A4	24	51
Fc1ccc2[nH]cc(C3CCN(c4cc(F)ncn4)CC3)c2c1	ZINC000853630085	DH	On-Demand	Anodyne	HTR1F	59	44
Fc1ccc2[nH]cc(C3CCN(c4cc(F)ncn4)CC3)c2c1	ZINC000853630085	DH	On-Demand	Anodyne	MPO	67	36
CCCC[C@H](CC)CCCN(C)Cn1nnc2c(cnn2C)c1=O	ZINC000853630581	EE	On-Demand	Anodyne	Q9M629_MAIZE	57	38
CCCC[C@@H](CC)CCCN(C)Cn1nnc2c(cnn2C)c1=O	ZINC000853630583	EE	On-Demand	Anodyne	Q9M629_MAIZE	57	38
C[C@H]1c2ccccc2OCCN1CN1C(=O)N[C@H](Cc2ccccc2)C1=O	ZINC000853630628	FF	On-Demand	Anodyne	GHRL	100	39
C[C@H]1c2ccccc2OCCN1CN1C(=O)N[C@@H](Cc2ccccc2)C1=O	ZINC000853630632	FF	On-Demand	Anodyne	GHRL	100	39
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3cc(F)ncn3)CC2)C1	ZINC000853630662	FD	On-Demand	Anodyne	GPR119	54	52
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3cc(F)ncn3)CC2)C1	ZINC000853630663	FD	On-Demand	Anodyne	GPR119	54	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1nccc1[N+](=O)[O-]	ZINC000853630743	ED	On-Demand	Bother	GPR119	45	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1Cc2cccnc2C1=O	ZINC000853630796	FE	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1C[C@@H](c2ccccn2)CC1=O	ZINC000853630797	GE	On-Demand	Anodyne	GPR119	32	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2CN1C[C@H](c2ccccn2)CC1=O	ZINC000853630798	GE	On-Demand	Anodyne	GPR119	32	44
C[C@H]1c2ccccc2OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853630835	DF	On-Demand	Anodyne	ALDH1A1	50	40
C[C@H]1c2ccccc2OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853630835	DF	On-Demand	Anodyne	ALDH3A1	41	45
C[C@H]1c2ccccc2OCCN1CN1C(=O)C(=O)c2ccccc21	ZINC000853630835	DF	On-Demand	Anodyne	CES1	16	40
C#CCCN(CCOC)C(=O)NCC1CCN(CC)CC1	ZINC000853630844	CD	On-Demand	Mild	CACNA1I	45	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cnc(-c2ccccn2)n1	ZINC000853630866	FE	On-Demand	Anodyne	GPR119	31	44
CCOc1cc(N2CCN([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)nc(C)n1	ZINC000853630914	GE	On-Demand	Anodyne	GPR119	45	50
CCOc1cc(N2CCN([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)nc(C)n1	ZINC000853630916	GE	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3ccc(N)c([N+](=O)[O-])n3)CC2)C1	ZINC000853630941	GD	On-Demand	Bother	GPR119	40	43
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3ccc(N)c([N+](=O)[O-])n3)CC2)C1	ZINC000853630942	GD	On-Demand	Bother	GPR119	40	43
Cc1ccc2c(c1)[C@@H](Nc1cnc(F)cn1)CCC2	ZINC000853630945	CG	On-Demand	Anodyne	KCNN3	19	49
C#Cc1cccnc1N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853630964	FE	On-Demand	Mild	GPR119	44	47
C#Cc1cccnc1N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853630965	FE	On-Demand	Mild	GPR119	44	47
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCC1CCN(CC)CC1	ZINC000853631134	ED	On-Demand	Mild	CACNA1I	47	33
O=C1C(=O)N(CN2CC3(CCC3)[C@H]2c2ccncc2)c2ccccc21	ZINC000853631151	EF	On-Demand	Anodyne	ALDH1A1	41	38
O=C1C(=O)N(CN2CC3(CCC3)[C@H]2c2ccncc2)c2ccccc21	ZINC000853631151	EF	On-Demand	Anodyne	ALDH3A1	36	40
O=C1C(=O)N(CN2CC3(CCC3)[C@@H]2c2ccncc2)c2ccccc21	ZINC000853631154	EF	On-Demand	Anodyne	ALDH1A1	41	38
O=C1C(=O)N(CN2CC3(CCC3)[C@@H]2c2ccncc2)c2ccccc21	ZINC000853631154	EF	On-Demand	Anodyne	ALDH3A1	36	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1cnnc1	ZINC000853631184	CD	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CC[C@H](N2CCN(c3cc(CO)c(F)cn3)CC2)C1	ZINC000853631211	GD	On-Demand	Anodyne	GPR119	53	43
CC(C)(C)OC(=O)N1CC[C@@H](N2CCN(c3cc(CO)c(F)cn3)CC2)C1	ZINC000853631212	GD	On-Demand	Anodyne	GPR119	53	43
C[C@H]1c2ccccc2OCCN1CN1C[C@@]2(CN3CCC2CC3)OC1=O	ZINC000853631444	FE	On-Demand	Anodyne	CHRNA7	18	52
C[C@H]1c2ccccc2OCCN1CN1C[C@]2(CN3CCC2CC3)OC1=O	ZINC000853631465	FE	On-Demand	Anodyne	CHRNA7	18	52
Cn1ncc2c(=O)n(CN3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)nnc21	ZINC000853631620	GC	On-Demand	Anodyne	Q9M629_MAIZE	52	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1ccnc1S	ZINC000853631633	DE	On-Demand	Anodyne	GPR119	37	41
CN(C)S(=O)(=O)c1cnn(CN2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853631646	GD	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2Cn1ccc(=S)c2ccccc21	ZINC000853631686	GI	On-Demand	Anodyne	GPR119	24	42
C[C@@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@](C)(C(F)F)O1	ZINC000853631801	EC	On-Demand	Anodyne	Q9M629_MAIZE	61	36
C[C@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@](C)(C(F)F)O1	ZINC000853631802	EC	On-Demand	Anodyne	Q9M629_MAIZE	61	36
C[C@@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@@](C)(C(F)F)O1	ZINC000853631803	EC	On-Demand	Anodyne	Q9M629_MAIZE	61	36
C[C@H]1CN(Cn2nnc3c(cnn3C)c2=O)C[C@@](C)(C(F)F)O1	ZINC000853631804	EC	On-Demand	Anodyne	Q9M629_MAIZE	61	36
O=C1c2cc(F)ccc2CN1CN1CC2(CCC2)[C@H]1c1ccncc1	ZINC000853631970	EG	On-Demand	Anodyne	ADAM17	17	41
O=C1c2cc(F)ccc2CN1CN1CC2(CCC2)[C@@H]1c1ccncc1	ZINC000853631971	EG	On-Demand	Anodyne	ADAM17	17	41
O=S(=O)(c1ccccc1)N1CC[C@H](Nc2cc(F)ncn2)C1	ZINC000853632099	DD	On-Demand	Anodyne	SFRP1	22	40
C[C@H]1c2ccccc2OCCN1Cn1nnc2c(cnn2C)c1=O	ZINC000853632145	EC	On-Demand	Anodyne	Q9M629_MAIZE	63	37
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC2(CCC2)[C@@H]1c1ccncc1	ZINC000853632192	FE	On-Demand	Anodyne	CHRNA7	18	49
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC2(CCC2)[C@H]1c1ccncc1	ZINC000853632193	FE	On-Demand	Anodyne	CHRNA7	18	49
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CC2(CCC2)[C@@H]1c1ccncc1	ZINC000853632194	FE	On-Demand	Anodyne	CHRNA7	18	49
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CC2(CCC2)[C@H]1c1ccncc1	ZINC000853632195	FE	On-Demand	Anodyne	CHRNA7	18	49
C[C@H]1c2ccccc2OCCN1CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853632297	GG	On-Demand	Bother	SLC27A4	44	34
C[C@H]1c2ccccc2OCCN1CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000853632298	GG	On-Demand	Bother	SLC27A4	44	34
N#Cc1ncc(C(F)(F)F)cc1N1CC[C@H](CC(N)=O)C1	ZINC000853632387	CD	On-Demand	Mild	LIPG	48	39
N#Cc1ncc(C(F)(F)F)cc1N1CC[C@@H](CC(N)=O)C1	ZINC000853632388	CD	On-Demand	Mild	LIPG	48	39
C#Cc1cnc(N2CC[C@@H](CC(N)=O)C2)nc1	ZINC000853632832	BC	On-Demand	Mild	SIRT3	46	35
C#Cc1cnc(N2CC[C@H](CC(N)=O)C2)nc1	ZINC000853632833	BC	On-Demand	Mild	SIRT3	46	35
Cn1ncc2c(=O)n(CN3CC4(CCC4)[C@@H]3c3ccncc3)nnc21	ZINC000853632863	ED	On-Demand	Anodyne	Q9M629_MAIZE	49	32
CCCC[C@H]1NC(=O)N(CN2CCOc3ccccc3[C@@H]2C)C1=O	ZINC000853632898	EF	On-Demand	Anodyne	GHRL	44	38
CCCC[C@@H]1NC(=O)N(CN2CCOc3ccccc3[C@H]2C)C1=O	ZINC000853632899	EF	On-Demand	Anodyne	GHRL	44	38
CCCC[C@H]1NC(=O)N(CN2CCOc3ccccc3[C@H]2C)C1=O	ZINC000853632900	EF	On-Demand	Anodyne	GHRL	44	38
CCCC[C@@H]1NC(=O)N(CN2CCOc3ccccc3[C@@H]2C)C1=O	ZINC000853632901	EF	On-Demand	Anodyne	GHRL	44	38
C[C@@H]1CN(CN2C[C@H](c3cccc(Cl)c3)CC2=O)C[C@@](C)(C(F)F)O1	ZINC000853632918	FG	On-Demand	Anodyne	MDM2	98	33
C[C@@H]1CN(CN2C[C@@H](c3cccc(Cl)c3)CC2=O)C[C@@](C)(C(F)F)O1	ZINC000853632919	FG	On-Demand	Anodyne	MDM2	98	33
C[C@@H]1CN(CN2C[C@H](c3cccc(Cl)c3)CC2=O)C[C@](C)(C(F)F)O1	ZINC000853632920	FG	On-Demand	Anodyne	MDM2	98	33
C[C@@H]1CN(CN2C[C@@H](c3cccc(Cl)c3)CC2=O)C[C@](C)(C(F)F)O1	ZINC000853632921	FG	On-Demand	Anodyne	MDM2	98	33
Cn1ncc2c(=O)n(CN3CC4(CCC4)[C@H]3c3ccncc3)nnc21	ZINC000853632969	ED	On-Demand	Anodyne	Q9M629_MAIZE	49	32
C#Cc1cccnc1N1CC[C@@H](CC(N)=O)C1	ZINC000853633262	BC	On-Demand	Mild	SIRT3	44	33
C#Cc1cccnc1N1CC[C@H](CC(N)=O)C1	ZINC000853633263	BC	On-Demand	Mild	SIRT3	44	33
O=C1O[C@@]2(CN3CCC2CC3)CN1CN1CCC[C@@H]2CCCC[C@@H]21	ZINC000853633727	EF	On-Demand	Anodyne	CHRNA7	18	59
O=C1O[C@]2(CN3CCC2CC3)CN1CN1CCC[C@@H]2CCCC[C@@H]21	ZINC000853633729	EF	On-Demand	Anodyne	CHRNA7	18	59
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2ccc(F)c(Cl)c2)C1	ZINC000853633762	GF	On-Demand	Anodyne	MAPK1	32	49
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2ccc(F)c(Cl)c2)C1	ZINC000853633764	GF	On-Demand	Anodyne	MAPK1	32	49
Cn1ncc2c(=O)n(CN3CCC[C@@H]4CCCC[C@@H]43)nnc21	ZINC000853633766	DD	On-Demand	Anodyne	Q9M629_MAIZE	59	37
NC(=O)C[C@@H]1CCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853633982	EG	On-Demand	Anodyne	SIRT3	44	33
NC(=O)C[C@H]1CCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853633983	EG	On-Demand	Anodyne	SIRT3	44	33
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNc2cc(F)ncn2)CC1	ZINC000853634003	EG	On-Demand	Anodyne	ACACB	15	44
Cn1ncc2c(=O)n(CN3CCO[C@@](C)(C(F)F)C3)nnc21	ZINC000853634176	DB	On-Demand	Anodyne	Q9M629_MAIZE	71	39
Cn1ncc2c(=O)n(CN3CCO[C@](C)(C(F)F)C3)nnc21	ZINC000853634177	DB	On-Demand	Anodyne	Q9M629_MAIZE	71	39
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1CCC[C@@H]2CCCC[C@@H]21	ZINC000853634242	EF	On-Demand	Anodyne	OXTR	15	42
O=C1N[C@H](Cc2ccccc2)C(=O)N1CN1CCC[C@@H]2CCCC[C@@H]21	ZINC000853634242	EF	On-Demand	Anodyne	GHRL	63	35
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNc2cc(CO)c(F)cn2)CC1	ZINC000853634248	FG	On-Demand	Anodyne	ACACB	15	44
COC(=O)Cc1ccnc(NC[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)CC2)c1	ZINC000853634292	GH	On-Demand	Anodyne	ACACB	15	43
C#CCCCOc1cccnc1NCc1ccc(OC)c(S(N)(=O)=O)c1	ZINC000853634293	GE	On-Demand	Mild	DRTS_TRYCR	46	33
Cn1ncc(C#N)c1NC[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CC1	ZINC000853634524	EG	On-Demand	Mild	ACACB	15	41
Cn1ncc(C#N)c1NC[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CC1	ZINC000853634524	EG	On-Demand	Mild	CACNA1I	42	33
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853634609	FH	On-Demand	Anodyne	LUXR	58	35
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853634609	FH	On-Demand	Anodyne	LASR	47	37
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853634610	FH	On-Demand	Anodyne	LUXR	58	35
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853634610	FH	On-Demand	Anodyne	LASR	47	37
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853634611	FH	On-Demand	Anodyne	LUXR	58	35
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853634611	FH	On-Demand	Anodyne	LASR	47	37
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853634612	FH	On-Demand	Anodyne	LUXR	58	35
CCc1cccc2c1OCC[C@@H]2NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853634612	FH	On-Demand	Anodyne	LASR	47	37
Cc1ccc(NC[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853634614	EH	On-Demand	Anodyne	ACACB	17	48
Cc1ccc(NC[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853634614	EH	On-Demand	Anodyne	VCP	40	33
Cn1nnc2c(NC[C@@H]3CC[C@@H](CNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853634640	GF	On-Demand	Anodyne	SIRT3	28	40
Cn1nnc2c(NC[C@@H]3CC[C@@H](CNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853634640	GF	On-Demand	Anodyne	SIRT2	24	40
Cn1nnc2c(NC[C@@H]3CC[C@@H](CNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853634640	GF	On-Demand	Anodyne	SIRT1	28	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNc2cc(O)nc3cccnc23)CC1	ZINC000853634655	GI	On-Demand	Anodyne	ACACB	19	51
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](CNc2cc(O)nc3cccnc23)CC1	ZINC000853634655	GI	On-Demand	Anodyne	VCP	49	32
Cc1onc2c(=O)n(CN3CCC[C@@H]4CCCC[C@@H]43)nc(-c3ccccc3)c12	ZINC000853634692	GH	On-Demand	Anodyne	GRM7	40	32
COc1cc2c(cc1OC)N(CN1CCC[C@@H]3CCCC[C@@H]31)C(=O)C2=O	ZINC000853634752	FF	On-Demand	Anodyne	CASP3	45	35
COc1cc2c(cc1OC)N(CN1CCC[C@@H]3CCCC[C@@H]31)C(=O)C2=O	ZINC000853634752	FF	On-Demand	Anodyne	CASP7	65	36
O=C(NCCCN1CCCS1(=O)=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853635275	GC	On-Demand	Reactive	TBXA2R	16	40
COc1cccc(Nc2nc(NCCS(=O)(=O)C(C)C)nc3[nH]cnc23)c1	ZINC000853635387	GE	On-Demand	Anodyne	PDPK1	15	42
COc1cccc(Nc2nc(NCCS(=O)(=O)C(C)C)nc3[nH]cnc23)c1	ZINC000853635387	GE	On-Demand	Anodyne	SYK	19	46
COc1cccc(Nc2nc(NCCS(=O)(=O)C(C)C)nc3[nH]cnc23)c1	ZINC000853635387	GE	On-Demand	Anodyne	CDK1	18	49
COC(=O)c1ccc(C(F)(F)F)nc1NCCS(=O)(=O)C(C)C	ZINC000853635393	FE	On-Demand	Anodyne	TRPV1	87	37
CC(=O)c1ccc(C(F)(F)F)nc1NCCS(=O)(=O)C(C)C	ZINC000853635468	EF	On-Demand	Anodyne	TRPV1	87	36
Fc1cccc(OCCOC(F)F)c1	ZINC000853635475	BE	On-Demand	Anodyne	CHRNA10	30	44
COc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853635510	DF	On-Demand	Anodyne	GPR119	38	40
COc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853635511	DF	On-Demand	Anodyne	GPR119	38	40
Cc1nonc1COc1ccc2c(c1)OCO2	ZINC000853635535	BD	On-Demand	Anodyne	EDNRA	19	44
CC(C)c1ccc2ncnc(NCCS(=O)(=O)C(C)C)c2c1	ZINC000853635640	DF	On-Demand	Anodyne	CLK4	57	34
FC(F)CN1CCC(CNc2nn3cc(-c4ccccc4)nc3s2)CC1	ZINC000853635770	GH	On-Demand	Anodyne	VCP	51	40
Fc1cccc(OCCC2SCCS2)c1	ZINC000853635776	BG	On-Demand	Anodyne	CHRNA10	37	48
FC(F)CN1CCC(CNc2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853635782	GI	On-Demand	Anodyne	HTR4	15	43
Cc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853635801	DG	On-Demand	Anodyne	GPR119	41	45
Cc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853635802	DG	On-Demand	Anodyne	GPR119	41	45
FC(F)OCCOc1ccccc1	ZINC000853635815	AE	On-Demand	Anodyne	LTA4H	17	44
C#CCOCCOc1cccc(F)c1	ZINC000853635821	AD	On-Demand	Mild	CHRNA10	28	41
CC(=O)c1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853635822	CG	On-Demand	Anodyne	PLA2G4B	80	39
COC(=O)C1(COc2ccc(C=O)cc2OC)CC1	ZINC000853635823	CD	On-Demand	Anodyne	TUBB1	53	33
O=[N+]([O-])c1c(NCC2CCN(CC(F)F)CC2)nc2ccccn12	ZINC000853635838	EF	On-Demand	Bother	PRKCQ	23	40
Cn1nnc2c(N[C@@H]3COc4ccccc4[C@H]3O)ncnc21	ZINC000853635857	CC	On-Demand	Anodyne	ADORA1	20	41
Cn1nnc2c(N[C@H]3COc4ccccc4[C@@H]3O)ncnc21	ZINC000853635858	CC	On-Demand	Anodyne	ADORA1	20	41
Cn1nnc2c(N[C@H]3COc4ccccc4[C@H]3O)ncnc21	ZINC000853635859	CC	On-Demand	Anodyne	ADORA1	20	41
Cn1nnc2c(N[C@@H]3COc4ccccc4[C@@H]3O)ncnc21	ZINC000853635860	CC	On-Demand	Anodyne	ADORA1	20	41
COc1cccc(C2(CNc3cnc(F)cn3)CC2)c1	ZINC000853635865	CF	On-Demand	Anodyne	ICMT	42	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2NC(C)=O)CC1	ZINC000853635881	FD	On-Demand	Anodyne	P2RY12	143	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2NC(C)=O)CC1	ZINC000853635882	FD	On-Demand	Anodyne	P2RY12	143	43
Brc1cccc(OCCC2SCCS2)c1	ZINC000853635891	DI	On-Demand	Anodyne	HMOX2	20	41
O=C(COC(=O)CCS(=O)(=O)c1ccc(F)cc1)NCC1(c2ccccc2)CCCC1	ZINC000853635905	IG	On-Demand	Anodyne	KCNA3	46	37
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C(=O)c3cccc4cccc2c34)CC1	ZINC000853635918	GE	On-Demand	Anodyne	P2RY12	52	38
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C(=O)c3cccc4cccc2c34)CC1	ZINC000853635918	GE	On-Demand	Anodyne	TRY2_BOVIN	41	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2C(=O)c3cccc4cccc2c34)CC1	ZINC000853635919	GE	On-Demand	Anodyne	P2RY12	52	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2C(=O)c3cccc4cccc2c34)CC1	ZINC000853635919	GE	On-Demand	Anodyne	TRY2_BOVIN	41	40
FC(F)OCCOc1cccc(Br)c1	ZINC000853635930	CG	On-Demand	Anodyne	HMOX2	21	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(C)cccc2C)CC1	ZINC000853635931	EE	On-Demand	Anodyne	P2RY12	92	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(C)cccc2C)CC1	ZINC000853635932	EE	On-Demand	Anodyne	P2RY12	92	44
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(F)c2)C1	ZINC000853635943	DF	On-Demand	Anodyne	CHRNA10	48	44
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(F)c2)C1	ZINC000853635943	DF	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(F)c2)C1	ZINC000853635944	DF	On-Demand	Anodyne	CHRNA10	48	44
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(F)c2)C1	ZINC000853635944	DF	On-Demand	Anodyne	GPR119	40	46
COC(=O)C1(COc2ccc3ccccc3c2C=O)CC1	ZINC000853635959	CF	On-Demand	Anodyne	MTNR1A	29	43
COC(=O)C1(COc2ccc3ccccc3c2C=O)CC1	ZINC000853635959	CF	On-Demand	Anodyne	MTNR1B	20	43
Cn1cncc1CCOc1cccc([N+](=O)[O-])c1	ZINC000853635960	BD	On-Demand	Bother	CACNA1D	50	38
Cn1cncc1CCOc1cccc([N+](=O)[O-])c1	ZINC000853635960	BD	On-Demand	Bother	ACR	16	40
COC(=O)c1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853635978	CF	On-Demand	Anodyne	PLA2G4B	63	37
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC1CCN(CC(F)F)CC1	ZINC000853636062	EF	On-Demand	Bother	PRKCQ	23	40
CC(C)c1ccc2ncnc(NCc3cncn3C)c2c1	ZINC000853636066	CG	On-Demand	Anodyne	CLK4	60	38
C#CCOCCOc1cccc(Br)c1	ZINC000853636067	CE	On-Demand	Mild	HMOX2	20	41
COc1cccc(C2(CNc3cc(F)ncn3)CC2)c1	ZINC000853636093	CF	On-Demand	Anodyne	ICMT	38	41
c1ccc(OCCC2SCCS2)cc1	ZINC000853636099	BG	On-Demand	Anodyne	LTA4H	24	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3c(c2)OCO3)C1	ZINC000853636111	EE	On-Demand	Anodyne	EDNRB	57	36
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3c(c2)OCO3)C1	ZINC000853636111	EE	On-Demand	Anodyne	EDNRA	57	36
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3c(c2)OCO3)C1	ZINC000853636112	EE	On-Demand	Anodyne	EDNRB	57	36
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3c(c2)OCO3)C1	ZINC000853636112	EE	On-Demand	Anodyne	EDNRA	57	36
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	CHRM2	20	44
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	HTR1A	20	49
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	CHRM1	20	44
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	DRD2	41	52
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	DRD4	64	54
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	ACHE	48	46
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	DRD3	22	50
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	KCNH2	17	44
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	HTR4	24	41
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	CHRM3	31	44
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	LTA4H	23	44
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	SIGMAR1	58	58
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	SSTR5	66	41
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	CCR3	46	44
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	MCHR1	53	49
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	CACNA1G	30	43
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	CCR8	21	47
C[C@@H](Oc1ccccc1C=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853636117	FG	On-Demand	Anodyne	BIRC2	33	41
O=C(COC(=O)CCS(=O)(=O)c1ccc(F)cc1)NCC1(c2ccccc2)CC1	ZINC000853636136	HE	On-Demand	Anodyne	KCNA3	47	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccccc2=O)CC1	ZINC000853636142	DC	On-Demand	Anodyne	P2RY12	174	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccccc2=O)CC1	ZINC000853636143	DC	On-Demand	Anodyne	P2RY12	174	41
Cc1c(NC(=O)[C@@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)cccc1[N+](=O)[O-]	ZINC000853636149	IF	On-Demand	Bother	COLA	113	43
Cc1c(NC(=O)[C@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)cccc1[N+](=O)[O-]	ZINC000853636150	IF	On-Demand	Bother	COLA	113	43
COC(=O)c1cnc(NCC2CCN(CC(F)F)CC2)cc1C(F)(F)F	ZINC000853636159	GG	On-Demand	Anodyne	CACNA1I	58	39
COc1ccc(OCCOC(F)F)cc1	ZINC000853636232	BE	On-Demand	Anodyne	AHR	24	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2)CC1	ZINC000853636291	GF	On-Demand	Anodyne	DRD4	29	55
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2)CC1	ZINC000853636291	GF	On-Demand	Anodyne	SIGMAR1	25	50
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2)CC1	ZINC000853636291	GF	On-Demand	Anodyne	SSTR5	49	38
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2)CC1	ZINC000853636291	GF	On-Demand	Anodyne	CCR3	19	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2)CC1	ZINC000853636291	GF	On-Demand	Anodyne	CCR2	18	49
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2)CC1	ZINC000853636291	GF	On-Demand	Anodyne	MCHR1	31	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2)CC1	ZINC000853636291	GF	On-Demand	Anodyne	CCR8	50	42
CCN1CC[C@H](Oc2ccc3c(C)cc(=O)oc3c2)C1=O	ZINC000853636307	CE	On-Demand	Anodyne	MAOA	63	47
CCN1CC[C@H](Oc2ccc3c(C)cc(=O)oc3c2)C1=O	ZINC000853636307	CE	On-Demand	Anodyne	MAOB	45	49
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000853636309	JD	On-Demand	Anodyne	P2RX3	16	41
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000853636309	JD	On-Demand	Anodyne	AKT1	19	40
Fc1ccc2c(C3CCN(c4cnc(F)cn4)CC3)noc2c1	ZINC000853636357	DG	On-Demand	Anodyne	DRD2	16	57
Fc1ccc2c(C3CCN(c4cnc(F)cn4)CC3)noc2c1	ZINC000853636357	DG	On-Demand	Anodyne	HTR2A	28	47
Fc1ccc2c(C3CCN(c4cnc(F)cn4)CC3)noc2c1	ZINC000853636357	DG	On-Demand	Anodyne	HTR7	26	44
COc1cccc(OCc2oc(C)nc2C)c1	ZINC000853636371	BF	On-Demand	Anodyne	MAOB	23	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3ccccc3c2=O)CC1	ZINC000853636376	FD	On-Demand	Anodyne	P2RY12	98	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3ccccc3c2=O)CC1	ZINC000853636377	FD	On-Demand	Anodyne	P2RY12	98	39
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	CA1	17	45
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	SCN2A	18	49
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	MTNR1A	17	40
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	PLA2G4B	61	33
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	FAAH	25	46
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	ACR	36	43
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	CA12	15	48
CC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853636393	BE	On-Demand	Anodyne	P96878_MYCTU	17	48
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853636399	GH	On-Demand	Anodyne	CCR5	26	40
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853636399	GH	On-Demand	Anodyne	CTSS	17	46
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853636399	GH	On-Demand	Anodyne	BIRC8	46	34
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853636400	GH	On-Demand	Anodyne	CCR5	26	40
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853636400	GH	On-Demand	Anodyne	CTSS	17	46
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853636400	GH	On-Demand	Anodyne	BIRC8	46	34
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853636401	GH	On-Demand	Anodyne	CCR5	26	40
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853636401	GH	On-Demand	Anodyne	CTSS	17	46
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853636401	GH	On-Demand	Anodyne	BIRC8	46	34
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853636402	GH	On-Demand	Anodyne	CCR5	26	40
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853636402	GH	On-Demand	Anodyne	CTSS	17	46
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853636402	GH	On-Demand	Anodyne	BIRC8	46	34
O=C1CCC2=C(CCN(C(=O)N[C@@H](CC3CCCCC3)c3ccccc3)C2)N1	ZINC000853636405	GI	On-Demand	Anodyne	CTSS	17	42
O=C1CCC2=C(CCN(C(=O)N[C@H](CC3CCCCC3)c3ccccc3)C2)N1	ZINC000853636406	GI	On-Demand	Anodyne	CTSS	17	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2C(C)=O)CC1	ZINC000853636427	GF	On-Demand	Anodyne	P2RY12	40	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2C(C)=O)CC1	ZINC000853636429	GF	On-Demand	Anodyne	P2RY12	40	37
Cc1cc(NC(=O)[C@@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)ccc1Br	ZINC000853636494	JH	On-Demand	Anodyne	LEF	40	36
Cc1cc(NC(=O)[C@@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)ccc1Br	ZINC000853636494	JH	On-Demand	Anodyne	IDO1	15	43
CC(=O)Nc1ccc(OCCO[Si](C)(C)C(C)(C)C)cc1	ZINC000853636516	DI	On-Demand	Reactive	FAAH	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)c(Cl)c2)CC1	ZINC000853636529	FF	On-Demand	Anodyne	P2RY12	63	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)c(Cl)c2)CC1	ZINC000853636529	FF	On-Demand	Anodyne	MC4R	64	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)c(Cl)c2)CC1	ZINC000853636530	FF	On-Demand	Anodyne	P2RY12	63	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)c(Cl)c2)CC1	ZINC000853636530	FF	On-Demand	Anodyne	MC4R	64	38
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853636537	JE	On-Demand	Anodyne	SLC6A9	26	45
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000853636548	IF	On-Demand	Anodyne	BDKRB1	29	41
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000853636550	IF	On-Demand	Anodyne	BDKRB1	29	41
COC(=O)c1nccc(N2CC[C@]3(CCc4ccccc4O3)C2)n1	ZINC000853636551	EE	On-Demand	Anodyne	SCD1	15	42
COC(=O)c1nccc(N2CC[C@]3(CCc4ccccc4O3)C2)n1	ZINC000853636551	EE	On-Demand	Anodyne	SCD	30	42
COC(=O)c1nccc(N2CC[C@@]3(CCc4ccccc4O3)C2)n1	ZINC000853636552	EE	On-Demand	Anodyne	SCD1	15	42
COC(=O)c1nccc(N2CC[C@@]3(CCc4ccccc4O3)C2)n1	ZINC000853636552	EE	On-Demand	Anodyne	SCD	30	42
COc1cccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853636585	DF	On-Demand	Anodyne	CHRNA10	29	41
COc1cccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853636585	DF	On-Demand	Anodyne	GPR119	34	40
COc1cccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853636586	DF	On-Demand	Anodyne	CHRNA10	29	41
COc1cccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853636586	DF	On-Demand	Anodyne	GPR119	34	40
CCCCCOc1ccc(OCCc2cncn2C)cc1	ZINC000853636597	CH	On-Demand	Anodyne	HRH3	18	46
CCCCCOc1ccc(OCCc2cncn2C)cc1	ZINC000853636597	CH	On-Demand	Anodyne	PLA2G4B	86	37
CCCCCOc1ccc(OCCc2cncn2C)cc1	ZINC000853636597	CH	On-Demand	Anodyne	CYP1A2	21	50
CCCCCOc1ccc(OCCc2cncn2C)cc1	ZINC000853636597	CH	On-Demand	Anodyne	CYP2C19	30	50
Cc1ccc(N2CC[C@]3(CCc4ccccc4O3)C2)nn1	ZINC000853636607	CF	On-Demand	Anodyne	SCD	57	47
CC(C)(C)OC(=O)N1CCC[C@@]2(CCN2c2cnccn2)C1	ZINC000853636614	DE	On-Demand	Anodyne	GPR119	18	53
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(F)(F)F)ccc2=O)CC1	ZINC000853636640	GD	On-Demand	Anodyne	P2RY12	49	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(F)(F)F)ccc2=O)CC1	ZINC000853636641	GD	On-Demand	Anodyne	P2RY12	49	38
N#Cc1cnnc(N2CCC[C@H](CNC(=O)C(F)(F)F)C2)c1	ZINC000853636676	DD	On-Demand	Mild	GPBAR1	26	40
N#Cc1cnnc(N2CCC[C@@H](CNC(=O)C(F)(F)F)C2)c1	ZINC000853636677	DD	On-Demand	Mild	GPBAR1	26	40
Cc1nonc1Cn1c(CO)nc2ccccc21	ZINC000853636678	BD	On-Demand	Anodyne	RPS6KB1	29	43
CC(=O)c1ccnc(N2CC[C@@]3(CCc4ccccc4O3)C2)c1	ZINC000853636721	DG	On-Demand	Anodyne	SCD1	29	42
CC(=O)c1ccnc(N2CC[C@@]3(CCc4ccccc4O3)C2)c1	ZINC000853636721	DG	On-Demand	Anodyne	SCD	49	42
CC(=O)c1ccnc(N2CC[C@]3(CCc4ccccc4O3)C2)c1	ZINC000853636722	DG	On-Demand	Anodyne	SCD1	29	42
CC(=O)c1ccnc(N2CC[C@]3(CCc4ccccc4O3)C2)c1	ZINC000853636722	DG	On-Demand	Anodyne	SCD	49	42
NS(=O)(=O)c1ccc2nc(N3CC[C@@]4(CCc5ccccc5O4)C3)[nH]c2c1	ZINC000853636724	GE	On-Demand	Anodyne	NPY5R	17	41
NS(=O)(=O)c1ccc2nc(N3CC[C@]4(CCc5ccccc5O4)C3)[nH]c2c1	ZINC000853636725	GE	On-Demand	Anodyne	NPY5R	17	41
CCOC(=O)c1nccc(N2CC[C@@]3(CCc4ccccc4O3)C2)n1	ZINC000853636730	EF	On-Demand	Anodyne	SCD1	20	41
CCOC(=O)c1nccc(N2CC[C@@]3(CCc4ccccc4O3)C2)n1	ZINC000853636730	EF	On-Demand	Anodyne	SCD	33	41
CCOC(=O)c1nccc(N2CC[C@]3(CCc4ccccc4O3)C2)n1	ZINC000853636731	EF	On-Demand	Anodyne	SCD1	20	41
CCOC(=O)c1nccc(N2CC[C@]3(CCc4ccccc4O3)C2)n1	ZINC000853636731	EF	On-Demand	Anodyne	SCD	33	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2C)CC1	ZINC000853636745	FD	On-Demand	Anodyne	P2RY12	198	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2C)CC1	ZINC000853636745	FD	On-Demand	Anodyne	CCR8	47	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2C)CC1	ZINC000853636746	FD	On-Demand	Anodyne	P2RY12	198	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2C)CC1	ZINC000853636746	FD	On-Demand	Anodyne	CCR8	47	42
COc1ccc(NC(=O)[C@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)c(OC)c1	ZINC000853636757	IF	On-Demand	Anodyne	MMP2	15	40
N=C(NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1	ZINC000853636766	GE	On-Demand	Anodyne	PREP	42	39
N=C(NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1	ZINC000853636766	GE	On-Demand	Anodyne	EPHX2	29	46
N=C(NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1	ZINC000853636766	GE	On-Demand	Anodyne	SFRP1	97	38
N=C(NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1ccccc1	ZINC000853636766	GE	On-Demand	Anodyne	WNT3	79	38
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1	ZINC000853636767	DF	On-Demand	Anodyne	GRIN2B	46	38
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1	ZINC000853636767	DF	On-Demand	Anodyne	L3MBTL3	59	37
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1	ZINC000853636768	DF	On-Demand	Anodyne	GRIN2B	46	38
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1	ZINC000853636768	DF	On-Demand	Anodyne	L3MBTL3	59	37
C#CCOCCOc1cccc(OC)c1	ZINC000853636775	BD	On-Demand	Mild	MTNR1A	16	47
C#CCOCCOc1cccc(OC)c1	ZINC000853636775	BD	On-Demand	Mild	MTNR1B	20	47
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCc1ccccc1F	ZINC000853636781	HE	On-Demand	Anodyne	TRPV1	64	35
COC[C@@H](COc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853636791	CE	On-Demand	Anodyne	ALDH2	45	33
COC[C@@H](COc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853636791	CE	On-Demand	Anodyne	MAOA	81	54
COC[C@@H](COc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853636791	CE	On-Demand	Anodyne	MAOB	64	58
COC(=O)Cc1ccnc(N2CC[C@@]3(CCc4ccccc4O3)C2)c1	ZINC000853636804	EF	On-Demand	Anodyne	SCD1	22	43
COC(=O)Cc1ccnc(N2CC[C@@]3(CCc4ccccc4O3)C2)c1	ZINC000853636804	EF	On-Demand	Anodyne	SCD	33	41
COC(=O)Cc1ccnc(N2CC[C@]3(CCc4ccccc4O3)C2)c1	ZINC000853636805	EF	On-Demand	Anodyne	SCD1	22	43
COC(=O)Cc1ccnc(N2CC[C@]3(CCc4ccccc4O3)C2)c1	ZINC000853636805	EF	On-Demand	Anodyne	SCD	33	41
Nc1ncccc1Cn1cnc2sc3c(c2c1=O)CCCC3	ZINC000853636843	DE	On-Demand	Anodyne	HTR1B	19	41
C#CCOCCOc1ccc(NC(C)=O)cc1	ZINC000853636864	BD	On-Demand	Mild	FAAH	20	41
CN(c1cnccn1)C1CN(C(=O)OC(C)(C)C)C1	ZINC000853636866	CD	On-Demand	Anodyne	GPR119	29	50
COC(=O)C1(COc2ccc3c(C)cc(=O)oc3c2)CC1	ZINC000853636911	CE	On-Demand	Anodyne	MAOA	83	62
COC(=O)C1(COc2ccc3c(C)cc(=O)oc3c2)CC1	ZINC000853636911	CE	On-Demand	Anodyne	MAOB	65	62
N#Cc1cnnc(N2CC[C@@]3(CCc4ccccc4O3)C2)c1	ZINC000853636929	CE	On-Demand	Mild	SCD	42	39
N#Cc1cnnc(N2CC[C@]3(CCc4ccccc4O3)C2)c1	ZINC000853636930	CE	On-Demand	Mild	SCD	42	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncc3ccccc3c2=O)CC1	ZINC000853636941	FD	On-Demand	Anodyne	P2RY12	139	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncc3ccccc3c2=O)CC1	ZINC000853636942	FD	On-Demand	Anodyne	P2RY12	139	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	CHRM1	19	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	DRD4	28	57
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	SLC6A1	43	34
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	HTR4	15	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	SIGMAR1	25	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	SSTR5	40	37
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	CCR3	18	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	MCHR1	31	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2C)CC1	ZINC000853636943	GF	On-Demand	Anodyne	CCR8	72	37
COc1cccc(OCCOC(F)F)c1	ZINC000853636944	BE	On-Demand	Anodyne	MTNR1A	19	49
COc1cccc(OCCOC(F)F)c1	ZINC000853636944	BE	On-Demand	Anodyne	MTNR1B	23	49
COC(=O)C1(COc2cc(C=O)ccc2OC)CC1	ZINC000853636962	CD	On-Demand	Anodyne	TUBB1	53	33
O=c1c2ccccc2cnn1CCOC(F)F	ZINC000853636967	BD	On-Demand	Anodyne	NPBWR1	47	37
C#Cc1cccnc1N1CCC(c2noc3cc(F)ccc23)CC1	ZINC000853636969	DH	On-Demand	Mild	DRD2	15	53
C#Cc1cccnc1N1CCC(c2noc3cc(F)ccc23)CC1	ZINC000853636969	DH	On-Demand	Mild	HTR2A	27	46
C#Cc1cccnc1N1CCC(c2noc3cc(F)ccc23)CC1	ZINC000853636969	DH	On-Demand	Mild	HTR7	26	44
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2ccccc2)C1	ZINC000853636995	EE	On-Demand	Anodyne	CCR8	30	44
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2ccccc2)C1	ZINC000853636996	EE	On-Demand	Anodyne	CCR8	30	44
O=C(NC[C@H]1CCCN(c2nc3ccccc3n3cccc23)C1)C(F)(F)F	ZINC000853637017	GG	On-Demand	Anodyne	HTR3A	30	42
CC(C)c1ccc2ncnc(N3CCC[C@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637021	GH	On-Demand	Anodyne	PDE3A	41	38
CC(C)c1ccc2ncnc(N3CCC[C@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637021	GH	On-Demand	Anodyne	PDGFRB	56	41
CC(C)c1ccc2ncnc(N3CCC[C@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637021	GH	On-Demand	Anodyne	PDE3B	43	38
CC(C)c1ccc2ncnc(N3CCC[C@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637021	GH	On-Demand	Anodyne	SIRT3	72	39
CC(C)c1ccc2ncnc(N3CCC[C@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637021	GH	On-Demand	Anodyne	SIRT2	60	34
CC(C)c1ccc2ncnc(N3CCC[C@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637021	GH	On-Demand	Anodyne	SIRT1	55	34
CC(C)c1ccc2ncnc(N3CCC[C@@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637022	GH	On-Demand	Anodyne	PDE3A	41	38
CC(C)c1ccc2ncnc(N3CCC[C@@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637022	GH	On-Demand	Anodyne	PDGFRB	56	41
CC(C)c1ccc2ncnc(N3CCC[C@@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637022	GH	On-Demand	Anodyne	PDE3B	43	38
CC(C)c1ccc2ncnc(N3CCC[C@@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637022	GH	On-Demand	Anodyne	SIRT3	72	39
CC(C)c1ccc2ncnc(N3CCC[C@@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637022	GH	On-Demand	Anodyne	SIRT2	60	34
CC(C)c1ccc2ncnc(N3CCC[C@@H](CNC(=O)C(F)(F)F)C3)c2c1	ZINC000853637022	GH	On-Demand	Anodyne	SIRT1	55	34
O=C1N[C@H](CCc2ccccc2)C(=O)N1CCC1SCCS1	ZINC000853637029	EF	On-Demand	Anodyne	SLC18A2	47	39
CC(=O)Nc1ccc(OCCC2SCCS2)cc1	ZINC000853637049	CG	On-Demand	Anodyne	ADRB1	19	44
CC(=O)Nc1ccc(OCCC2SCCS2)cc1	ZINC000853637049	CG	On-Demand	Anodyne	TSHR	41	32
CC(=O)Nc1ccc(OCCC2SCCS2)cc1	ZINC000853637049	CG	On-Demand	Anodyne	FAAH	21	41
CC(=O)Nc1ccc(OCCC2SCCS2)cc1	ZINC000853637049	CG	On-Demand	Anodyne	EPHX2	23	45
O=C(NC[C@H]1CCCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1)C(F)(F)F	ZINC000853637066	GH	On-Demand	Bother	SERPINE1	23	41
Cc1nonc1Cn1c(NC[C@@H](C)O)nc2ccccc21	ZINC000853637068	CD	On-Demand	Anodyne	RPS6KB1	15	40
Cc1nonc1Cn1c(NC[C@H](C)O)nc2ccccc21	ZINC000853637069	CD	On-Demand	Anodyne	RPS6KB1	15	40
CCOC(=O)c1nccc(N2CC[C@]23CCCN(C(=O)OC(C)(C)C)C3)n1	ZINC000853637095	GF	On-Demand	Anodyne	GPR119	15	40
CCOC(=O)c1nccc(N2CC[C@@]23CCCN(C(=O)OC(C)(C)C)C3)n1	ZINC000853637096	GF	On-Demand	Anodyne	GPR119	15	40
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	DRD2	19	53
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	DRD4	36	53
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	SIGMAR1	40	48
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	CCR3	60	48
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	MLNR	52	37
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	CCR2	18	42
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	BACE1	19	43
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	MCHR1	30	43
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	CACNA1G	41	46
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853637139	JE	On-Demand	Anodyne	BIRC2	38	42
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	DRD2	19	53
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	DRD4	36	53
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	SIGMAR1	40	48
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	CCR3	60	48
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	MLNR	52	37
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	CCR2	18	42
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	BACE1	19	43
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	MCHR1	30	43
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	CACNA1G	41	46
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853637140	JE	On-Demand	Anodyne	BIRC2	38	42
COc1cccc(OC)c1OCCC1SCCS1	ZINC000853637141	CG	On-Demand	Anodyne	ADRA1D	17	45
COc1cccc(OC)c1OCCC1SCCS1	ZINC000853637141	CG	On-Demand	Anodyne	ADRA1A	17	45
COc1cccc(OC)c1OCCC1SCCS1	ZINC000853637141	CG	On-Demand	Anodyne	ADRA1B	17	45
Nc1ccc(N2CC[C@@]3(CCc4ccccc4O3)C2)nc1[N+](=O)[O-]	ZINC000853637155	EF	On-Demand	Bother	SCD	28	40
Nc1ccc(N2CC[C@]3(CCc4ccccc4O3)C2)nc1[N+](=O)[O-]	ZINC000853637156	EF	On-Demand	Bother	SCD	28	40
CCCc1ccc(N2CC[C@@]3(CCc4ccccc4O3)C2)nn1	ZINC000853637190	DG	On-Demand	Anodyne	SCD1	30	48
CCCc1ccc(N2CC[C@@]3(CCc4ccccc4O3)C2)nn1	ZINC000853637190	DG	On-Demand	Anodyne	SCD	57	46
CCCc1ccc(N2CC[C@]3(CCc4ccccc4O3)C2)nn1	ZINC000853637191	DG	On-Demand	Anodyne	SCD1	30	48
CCCc1ccc(N2CC[C@]3(CCc4ccccc4O3)C2)nn1	ZINC000853637191	DG	On-Demand	Anodyne	SCD	57	46
COc1cccc(OCCC2SCCS2)c1	ZINC000853637203	CG	On-Demand	Anodyne	MTNR1B	18	47
COc1cccc(OCCC2SCCS2)c1	ZINC000853637203	CG	On-Demand	Anodyne	CHRNA10	26	44
Cn1c(S)nnc1CCNC(=O)N[C@@H](CC1CCCCC1)c1ccccc1	ZINC000853637298	GH	On-Demand	Anodyne	REN	61	35
Cn1c(S)nnc1CCNC(=O)N[C@H](CC1CCCCC1)c1ccccc1	ZINC000853637299	GH	On-Demand	Anodyne	REN	61	35
CO[C@@H](C)[C@@H](C)Nc1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853637305	DE	On-Demand	Anodyne	ABCC8	45	34
COC(=O)C1(COc2ccc3ccc(=O)oc3c2)CC1	ZINC000853637315	CE	On-Demand	Anodyne	MAOA	52	46
COC(=O)C1(COc2ccc3ccc(=O)oc3c2)CC1	ZINC000853637315	CE	On-Demand	Anodyne	MAOB	39	49
Cn1nnc2c(N3CCC[C@H](CNC(=O)C(F)(F)F)C3)ncnc21	ZINC000853637316	EC	On-Demand	Anodyne	SIRT3	50	38
O=c1ccc2ccc(OCCO[C@@H]3CC3(F)F)cc2o1	ZINC000853637317	CF	On-Demand	Anodyne	MAOA	38	41
O=c1ccc2ccc(OCCO[C@@H]3CC3(F)F)cc2o1	ZINC000853637317	CF	On-Demand	Anodyne	MAOB	21	53
O=c1ccc2ccc(OCCO[C@H]3CC3(F)F)cc2o1	ZINC000853637318	CF	On-Demand	Anodyne	MAOA	38	41
O=c1ccc2ccc(OCCO[C@H]3CC3(F)F)cc2o1	ZINC000853637318	CF	On-Demand	Anodyne	MAOB	21	53
Cn1nnc2c(N3CCC[C@@H](CNC(=O)C(F)(F)F)C3)ncnc21	ZINC000853637320	EC	On-Demand	Anodyne	SIRT3	50	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(NCCO)nc3ccccc32)CC1	ZINC000853637322	GD	On-Demand	Anodyne	P2RY12	158	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(NCCO)nc3ccccc32)CC1	ZINC000853637323	GD	On-Demand	Anodyne	P2RY12	158	40
C[C@H](O)c1nc2ccccc2n1CCOCc1ccccc1	ZINC000853637330	CG	On-Demand	Anodyne	HRH1	26	45
C[C@H](O)c1nc2ccccc2n1CCOCc1ccccc1	ZINC000853637330	CG	On-Demand	Anodyne	PDE6D	60	42
O=C1N[C@H](CCc2ccccc2)C(=O)N1CCOC(F)F	ZINC000853637331	CD	On-Demand	Anodyne	SLC18A2	47	38
CC1(COc2ccc3ccc(=O)oc3c2)CCC1	ZINC000853637334	BG	On-Demand	Anodyne	MAOA	52	46
CC1(COc2ccc3ccc(=O)oc3c2)CCC1	ZINC000853637334	BG	On-Demand	Anodyne	MAOB	40	52
C[C@H](O)c1nc2ccccc2n1CCC1(O)CCC1	ZINC000853637339	CE	On-Demand	Anodyne	HRH1	27	41
CON(C)CCNC(=O)NCC(=O)N1CCc2ccccc21	ZINC000853637340	DC	On-Demand	Anodyne	AVPR2	34	41
C#CCOCCn1c([C@@H](C)O)nc2ccccc21	ZINC000853637359	BD	On-Demand	Mild	HRH1	19	62
C#CCOCCn1c([C@H](C)O)nc2ccccc21	ZINC000853637360	BD	On-Demand	Mild	HRH1	19	62
Fc1cnc(NC[C@@H]2CCCCN(Cc3ccccc3)C2)cn1	ZINC000853637382	DG	On-Demand	Anodyne	DRD4	21	40
Fc1cnc(NC[C@@H]2CCCCN(Cc3ccccc3)C2)cn1	ZINC000853637382	DG	On-Demand	Anodyne	ACHE	16	40
Fc1cnc(NC[C@H]2CCCCN(Cc3ccccc3)C2)cn1	ZINC000853637383	DG	On-Demand	Anodyne	DRD4	21	40
Fc1cnc(NC[C@H]2CCCCN(Cc3ccccc3)C2)cn1	ZINC000853637383	DG	On-Demand	Anodyne	ACHE	16	40
COc1cccc(C2(NC(=O)NCCn3cncn3)CCC2)c1	ZINC000853637411	DD	On-Demand	Anodyne	DRD4	44	33
CC(C)(CO)[C@H](NC(=O)NCCn1cncn1)c1cccs1	ZINC000853637417	DD	On-Demand	Anodyne	HIS3	50	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)cc2C(C)=O)CC1	ZINC000853637425	GD	On-Demand	Anodyne	P2RY12	48	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)cc2C(C)=O)CC1	ZINC000853637425	GD	On-Demand	Anodyne	MTNR1A	46	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)cc2C(C)=O)CC1	ZINC000853637425	GD	On-Demand	Anodyne	MTNR1B	45	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)cc2C(C)=O)CC1	ZINC000853637426	GD	On-Demand	Anodyne	P2RY12	48	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)cc2C(C)=O)CC1	ZINC000853637426	GD	On-Demand	Anodyne	MTNR1A	46	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)cc2C(C)=O)CC1	ZINC000853637426	GD	On-Demand	Anodyne	MTNR1B	45	41
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637433	GD	On-Demand	Anodyne	MMP13	15	46
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637433	GD	On-Demand	Anodyne	MMP8	18	46
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637433	GD	On-Demand	Anodyne	TGM2	16	42
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637433	GD	On-Demand	Anodyne	F13A1	18	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637434	GD	On-Demand	Anodyne	MMP13	15	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637434	GD	On-Demand	Anodyne	MMP8	18	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637434	GD	On-Demand	Anodyne	TGM2	16	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853637434	GD	On-Demand	Anodyne	F13A1	18	42
Fc1ccc2c(C3CCN(c4cc(F)ncn4)CC3)noc2c1	ZINC000853637446	DG	On-Demand	Anodyne	DRD2	16	57
Fc1ccc2c(C3CCN(c4cc(F)ncn4)CC3)noc2c1	ZINC000853637446	DG	On-Demand	Anodyne	HTR2A	28	47
Fc1ccc2c(C3CCN(c4cc(F)ncn4)CC3)noc2c1	ZINC000853637446	DG	On-Demand	Anodyne	HTR7	27	44
FC(F)(F)COc1ccc(N2CC[C@@]3(CCc4ccccc4O3)C2)nn1	ZINC000853637448	FG	On-Demand	Anodyne	SCD	56	43
FC(F)(F)COc1ccc(N2CC[C@]3(CCc4ccccc4O3)C2)nn1	ZINC000853637449	FG	On-Demand	Anodyne	SCD	56	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(OC)cccc2OC)CC1	ZINC000853637495	FD	On-Demand	Anodyne	P2RY12	65	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(OC)cccc2OC)CC1	ZINC000853637496	FD	On-Demand	Anodyne	P2RY12	65	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2OCC)CC1	ZINC000853637500	FE	On-Demand	Anodyne	P2RY12	180	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2OCC)CC1	ZINC000853637500	FE	On-Demand	Anodyne	HCN1	51	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2OCC)CC1	ZINC000853637500	FE	On-Demand	Anodyne	HCN4	42	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2OCC)CC1	ZINC000853637501	FE	On-Demand	Anodyne	P2RY12	180	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2OCC)CC1	ZINC000853637501	FE	On-Demand	Anodyne	HCN1	51	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2OCC)CC1	ZINC000853637501	FE	On-Demand	Anodyne	HCN4	42	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637511	ED	On-Demand	Anodyne	P2RY12	192	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637511	ED	On-Demand	Anodyne	TRY2_BOVIN	80	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637511	ED	On-Demand	Anodyne	ST14	23	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637511	ED	On-Demand	Anodyne	CCR8	20	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637512	ED	On-Demand	Anodyne	P2RY12	192	44
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637512	ED	On-Demand	Anodyne	TRY2_BOVIN	80	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637512	ED	On-Demand	Anodyne	ST14	23	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2)CC1	ZINC000853637512	ED	On-Demand	Anodyne	CCR8	20	42
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CCS(=O)(=O)c3ccc(F)cc3)ccc2c1	ZINC000853637522	JH	On-Demand	Anodyne	BMP1	74	42
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CCS(=O)(=O)c3ccc(F)cc3)ccc2c1	ZINC000853637523	JH	On-Demand	Anodyne	BMP1	74	42
C[C@H](NC(=O)[C@@H](C)OC(=O)CCS(=O)(=O)c1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853637529	JD	On-Demand	Anodyne	CA2	47	40
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853637530	JD	On-Demand	Anodyne	CA2	47	40
CN(c1ncnc(F)c1Br)C1CN(C(=O)OC(C)(C)C)C1	ZINC000853637538	FE	On-Demand	Anodyne	GPR119	31	42
CCN(CCNC(=O)NNc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000853637541	ED	On-Demand	Reactive	SLC27A4	42	31
CC(=O)Nc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853637553	CF	On-Demand	Anodyne	PLA2G4B	57	32
CC(=O)Nc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853637553	CF	On-Demand	Anodyne	FAAH	22	44
CC(=O)Nc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853637553	CF	On-Demand	Anodyne	EPHX2	18	43
CC(=O)Nc1ccc(OCc2oc(C)nc2C)cc1	ZINC000853637555	CF	On-Demand	Anodyne	TSHR	59	37
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCC(=O)N1CCc2ccccc21	ZINC000853637558	FD	On-Demand	Mild	AVPR2	22	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(N)=O)CC1	ZINC000853637585	EC	On-Demand	Anodyne	P2RY12	97	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(N)=O)CC1	ZINC000853637585	EC	On-Demand	Anodyne	HCN1	52	32
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(N)=O)CC1	ZINC000853637586	EC	On-Demand	Anodyne	P2RY12	97	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(N)=O)CC1	ZINC000853637586	EC	On-Demand	Anodyne	HCN1	52	32
OCCNc1nc2ccccc2n1CCOC(F)F	ZINC000853637591	CD	On-Demand	Anodyne	HRH1	17	40
C#CCOCCn1c(CO)nc2ccccc21	ZINC000853637596	BD	On-Demand	Mild	HRH1	16	59
CC(=O)CCc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853637645	CH	On-Demand	Anodyne	PPARA	50	32
CC(=O)CCc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853637645	CH	On-Demand	Anodyne	FFAR1	40	41
CC(=O)CCc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853637645	CH	On-Demand	Anodyne	FFAR4	49	38
CC[C@@H](O)CNC(=O)NCCn1cncn1	ZINC000853637688	BB	On-Demand	Anodyne	HIS3	46	38
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCn1cncn1	ZINC000853637690	FG	On-Demand	Anodyne	HIS3	48	40
O=C(NCCn1cncn1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853637705	DD	On-Demand	Anodyne	EPHX2	21	45
C[C@H](O)c1nc2ccccc2n1CCC1SCCS1	ZINC000853637770	CG	On-Demand	Anodyne	HRH1	29	41
C[C@H](O)c1nc2ccccc2n1CCC1SCCS1	ZINC000853637770	CG	On-Demand	Anodyne	PDE6D	40	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(C)=O)cc2)CC1	ZINC000853637832	FD	On-Demand	Anodyne	P2RY12	83	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(C)=O)cc2)CC1	ZINC000853637832	FD	On-Demand	Anodyne	TGM2	26	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(C)=O)cc2)CC1	ZINC000853637832	FD	On-Demand	Anodyne	F13A1	46	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(C)=O)cc2)CC1	ZINC000853637833	FD	On-Demand	Anodyne	P2RY12	83	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(C)=O)cc2)CC1	ZINC000853637833	FD	On-Demand	Anodyne	TGM2	26	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(C)=O)cc2)CC1	ZINC000853637833	FD	On-Demand	Anodyne	F13A1	46	46
CN(C)S(=O)(=O)c1ccccc1N1CCC[C@H](CNC(=O)C(F)(F)F)C1	ZINC000853637839	GD	On-Demand	Anodyne	SFRP1	48	33
CN(C)S(=O)(=O)c1ccccc1N1CCC[C@@H](CNC(=O)C(F)(F)F)C1	ZINC000853637840	GD	On-Demand	Anodyne	SFRP1	48	33
O=C(NC[C@H]1CCCN(c2ncnc(F)c2Br)C1)C(F)(F)F	ZINC000853637843	GE	On-Demand	Anodyne	SIRT3	45	36
CC(=O)Nc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853637861	FF	On-Demand	Anodyne	EPHX2	24	42
CC(=O)Nc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853637862	FF	On-Demand	Anodyne	EPHX2	24	42
OCc1nc2ccccc2n1CCOC(F)F	ZINC000853637887	BD	On-Demand	Anodyne	HRH1	24	42
OCc1nc2ccccc2n1CCOC(F)F	ZINC000853637887	BD	On-Demand	Anodyne	GRM2	15	40
Cc1cc(CNc2cc(F)ncn2)cc(N2CCCC2)n1	ZINC000853637901	CF	On-Demand	Anodyne	HRH4	17	46
COc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853637982	CG	On-Demand	Anodyne	MTNR1A	16	46
COc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853637982	CG	On-Demand	Anodyne	MTNR1B	19	46
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)c1	ZINC000853637988	IF	On-Demand	Anodyne	IDO1	23	41
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)c1	ZINC000853637988	IF	On-Demand	Anodyne	KCNK3	40	32
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)c1	ZINC000853637989	IF	On-Demand	Anodyne	IDO1	23	41
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)CCS(=O)(=O)c2ccc(F)cc2)c1	ZINC000853637989	IF	On-Demand	Anodyne	KCNK3	40	32
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853638009	IH	On-Demand	Anodyne	IDO1	19	41
O=C(NCCn1cncn1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853638030	FC	On-Demand	Anodyne	HTR1A	24	41
O=C(NCCn1cncn1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853638030	FC	On-Demand	Anodyne	HTR2A	17	40
O=C(NCCn1cncn1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853638030	FC	On-Demand	Anodyne	DRD3	16	40
CN(C(=O)NCCn1cncn1)[C@H](CO)Cc1ccccc1	ZINC000853638038	DC	On-Demand	Anodyne	HIS3	43	39
CN(C(=O)NCCn1cncn1)[C@@H](CO)Cc1ccccc1	ZINC000853638039	DC	On-Demand	Anodyne	HIS3	43	39
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853638052	GI	On-Demand	Anodyne	CCR5	20	41
O=C(N[C@@H](CC1CCCCC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853638052	GI	On-Demand	Anodyne	CTSS	19	49
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853638054	GI	On-Demand	Anodyne	CCR5	20	41
O=C(N[C@H](CC1CCCCC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853638054	GI	On-Demand	Anodyne	CTSS	19	49
O=C(NCCn1cncn1)NCC(O)(C1CC1)C1CC1	ZINC000853638087	CC	On-Demand	Anodyne	HIS3	40	37
N#CCC1(COc2ccc3ccc(=O)oc3c2)CC1	ZINC000853638101	CF	On-Demand	Mild	MAOA	38	41
N#CCC1(COc2ccc3ccc(=O)oc3c2)CC1	ZINC000853638101	CF	On-Demand	Mild	MAOB	19	50
COC[C@H](NC(=O)NCCn1cncn1)c1cccc(OC)c1	ZINC000853638149	DC	On-Demand	Anodyne	DRD4	43	32
COC[C@H](NC(=O)NCCn1cncn1)c1cccc(OC)c1	ZINC000853638149	DC	On-Demand	Anodyne	HIS3	46	36
COC[C@@H](NC(=O)NCCn1cncn1)c1cccc(OC)c1	ZINC000853638150	DC	On-Demand	Anodyne	DRD4	43	32
COC[C@@H](NC(=O)NCCn1cncn1)c1cccc(OC)c1	ZINC000853638150	DC	On-Demand	Anodyne	HIS3	46	36
CC(=O)CCc1ccc(OCCOC(F)F)cc1	ZINC000853638157	CF	On-Demand	Anodyne	PLA2G4B	70	39
CC(=O)CCc1ccc(OCCOC(F)F)cc1	ZINC000853638157	CF	On-Demand	Anodyne	FFAR1	48	40
CC(=O)CCc1ccc(OCCOC(F)F)cc1	ZINC000853638157	CF	On-Demand	Anodyne	PPO2	34	40
CC(=O)CCc1ccc(OCCOC(F)F)cc1	ZINC000853638157	CF	On-Demand	Anodyne	FFAR4	46	35
Cn1ncc(C#N)c1N1CCC([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853638162	FF	On-Demand	Mild	GPR119	55	53
Cn1ncc(C#N)c1N1CCC([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853638163	FF	On-Demand	Mild	GPR119	55	53
CCCCCOc1ccc(OC[C@@H](OC)[C@@H]2CCOC2)cc1	ZINC000853638188	DH	On-Demand	Anodyne	PLA2G4B	65	33
CCCCCOc1ccc(OC[C@@H](OC)[C@H]2CCOC2)cc1	ZINC000853638189	DH	On-Demand	Anodyne	PLA2G4B	65	33
CCCCCOc1ccc(OC[C@H](OC)[C@@H]2CCOC2)cc1	ZINC000853638190	DH	On-Demand	Anodyne	PLA2G4B	65	33
CCCCCOc1ccc(OC[C@H](OC)[C@H]2CCOC2)cc1	ZINC000853638191	DH	On-Demand	Anodyne	PLA2G4B	65	33
Fc1ccc2c(C3CCN(c4ncnc(F)c4Br)CC3)noc2c1	ZINC000853638199	GI	On-Demand	Anodyne	DRD2	15	54
Fc1ccc2c(C3CCN(c4ncnc(F)c4Br)CC3)noc2c1	ZINC000853638199	GI	On-Demand	Anodyne	HTR2A	27	47
Fc1ccc2c(C3CCN(c4ncnc(F)c4Br)CC3)noc2c1	ZINC000853638199	GI	On-Demand	Anodyne	HTR7	25	42
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	TACR1	22	49
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	CCKAR	48	46
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	MPO	72	37
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	BRS3	26	42
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	NMBR	22	49
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	MTNR1A	21	40
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	MMP2	24	40
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	GRPR	46	31
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	MMP11	49	33
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	ALOX15	17	46
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	MMP9	21	46
C[C@@H](OC(=O)CCS(=O)(=O)c1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853638205	IF	On-Demand	Anodyne	KISS1R	41	33
COc1ccc(OCCOC(F)F)c(C(C)=O)c1	ZINC000853638229	CF	On-Demand	Anodyne	MTNR1A	51	40
COc1ccc(OCCOC(F)F)c(C(C)=O)c1	ZINC000853638229	CF	On-Demand	Anodyne	MTNR1B	44	40
C[C@@H](CCNC(=O)NCCn1cncn1)N(C)C	ZINC000853638264	CB	On-Demand	Anodyne	HIS3	45	35
C#Cc1cccnc1N1CCC([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853638276	FH	On-Demand	Mild	GPR119	51	59
C#Cc1cccnc1N1CCC([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853638277	FH	On-Demand	Mild	GPR119	51	59
CO[C@@H](Cn1c([C@@H](C)O)nc2ccccc21)C1CCC1	ZINC000853638278	CF	On-Demand	Anodyne	PDE6D	79	35
CO[C@@H](Cn1c([C@H](C)O)nc2ccccc21)C1CCC1	ZINC000853638280	CF	On-Demand	Anodyne	PDE6D	79	35
C#CCOCCOc1cccc(CC)c1	ZINC000853638302	BE	On-Demand	Mild	SQLE	44	33
C[C@H](O)c1nc2ccccc2n1CCCCC1(C)OCCO1	ZINC000853638339	DG	On-Demand	Anodyne	HRH1	15	40
O=C(NCCn1cncn1)N(CCN1CCOCC1)CC1CC1	ZINC000853638356	DC	On-Demand	Anodyne	CASR	40	36
COC(=O)C1(Cn2c([C@H](C)O)nc3ccccc32)CC1	ZINC000853638363	CE	On-Demand	Anodyne	PDE6D	45	35
COC(=O)C1(Cn2c([C@@H](C)O)nc3ccccc32)CC1	ZINC000853638364	CE	On-Demand	Anodyne	PDE6D	45	35
O=C(NCCn1cncn1)N[C@H](c1cccs1)C1(CO)CCC1	ZINC000853638382	ED	On-Demand	Anodyne	HIS3	40	38
O=C(NCCn1cncn1)N[C@@H](c1cccs1)C1(CO)CCC1	ZINC000853638383	ED	On-Demand	Anodyne	HIS3	40	38
Cn1ncc(C#N)c1N[C@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000853638388	GI	On-Demand	Mild	CSNK2A1	47	33
Cn1ncc(C#N)c1N[C@@H]1CC(C)(C)Oc2ccc(NC(=O)OC(C)(C)C)cc21	ZINC000853638389	GI	On-Demand	Mild	CSNK2A1	47	33
Cc1nonc1Cn1c([C@@H](C)O)nc2ccccc21	ZINC000853638425	CD	On-Demand	Anodyne	RPS6KB1	27	44
Cc1nonc1Cn1c([C@H](C)O)nc2ccccc21	ZINC000853638426	CD	On-Demand	Anodyne	RPS6KB1	27	44
CO[C@@H](Cn1c([C@@H](C)O)nc2ccccc21)C1CCCCC1	ZINC000853638432	DH	On-Demand	Anodyne	PDE6D	69	38
CO[C@@H](Cn1c([C@H](C)O)nc2ccccc21)C1CCCCC1	ZINC000853638433	DH	On-Demand	Anodyne	PDE6D	69	38
O=C(NCCn1cncn1)N1CCc2sccc2[C@@H]1c1ccc(Cl)cc1	ZINC000853638436	GG	On-Demand	Anodyne	TRPM8	24	57
O=C(NCCn1cncn1)N1CCc2sccc2[C@H]1c1ccc(Cl)cc1	ZINC000853638437	GG	On-Demand	Anodyne	TRPM8	24	57
Cn1nnc2c(N3CCC([C@H]4CCN(C(=O)OC(C)(C)C)C4)CC3)ncnc21	ZINC000853638442	GE	On-Demand	Anodyne	SIRT3	40	39
Cn1nnc2c(N3CCC([C@H]4CCN(C(=O)OC(C)(C)C)C4)CC3)ncnc21	ZINC000853638442	GE	On-Demand	Anodyne	GPR119	49	53
Cn1nnc2c(N3CCC([C@@H]4CCN(C(=O)OC(C)(C)C)C4)CC3)ncnc21	ZINC000853638443	GE	On-Demand	Anodyne	SIRT3	40	39
Cn1nnc2c(N3CCC([C@@H]4CCN(C(=O)OC(C)(C)C)C4)CC3)ncnc21	ZINC000853638443	GE	On-Demand	Anodyne	GPR119	49	53
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3ccnc(O)c3[N+](=O)[O-])CC2)C1	ZINC000853638490	GG	On-Demand	Bother	GPR119	55	53
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3ccnc(O)c3[N+](=O)[O-])CC2)C1	ZINC000853638491	GG	On-Demand	Bother	GPR119	55	53
Cc1ccc(N2CCC([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853638494	EG	On-Demand	Anodyne	GPR119	59	58
Cc1ccc(N2CCC([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853638495	EG	On-Demand	Anodyne	GPR119	59	58
Cc1cc(CO)cc(N2CCC([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853638507	GG	On-Demand	Anodyne	GPR119	42	60
Cc1cc(CO)cc(N2CCC([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853638508	GG	On-Demand	Anodyne	GPR119	42	60
O=C(NCCn1cncn1)N[C@@H](c1ccncc1)C1(CO)CCC1	ZINC000853638513	EC	On-Demand	Anodyne	HIS3	44	32
O=C(NCCn1cncn1)N[C@H](c1ccncc1)C1(CO)CCC1	ZINC000853638514	EC	On-Demand	Anodyne	HIS3	44	32
COc1ccc(OCCc2cncn2C)c(C(C)=O)c1	ZINC000853638520	CE	On-Demand	Anodyne	MTNR1A	42	38
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3nc(C#N)c(Cl)s3)CC2)C1	ZINC000853638538	GI	On-Demand	Mild	GPR119	19	49
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3nc(C#N)c(Cl)s3)CC2)C1	ZINC000853638539	GI	On-Demand	Mild	GPR119	19	49
CC(=O)CCc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853638549	FG	On-Demand	Anodyne	GPR119	28	41
CC(=O)CCc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853638550	FG	On-Demand	Anodyne	GPR119	28	41
CC(=O)CCc1ccc(OCCC2SCCS2)cc1	ZINC000853638557	CH	On-Demand	Anodyne	FFAR4	44	33
COC(=O)c1nccc(N2CCC([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853638558	GF	On-Demand	Anodyne	GPR119	54	62
COC(=O)c1nccc(N2CCC([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853638559	GF	On-Demand	Anodyne	GPR119	54	62
CO[C@@H](Cn1c([C@H](C)O)nc2ccccc21)C1CCCC1	ZINC000853638565	CG	On-Demand	Anodyne	PDE6D	78	37
CO[C@@H](Cn1c([C@@H](C)O)nc2ccccc21)C1CCCC1	ZINC000853638567	CG	On-Demand	Anodyne	PDE6D	78	37
COc1ccc(OCc2oc(C)nc2C)c(C(C)=O)c1	ZINC000853638571	CG	On-Demand	Anodyne	MTNR1A	45	37
C[C@H](O)c1nc2ccccc2n1CCC1CCC1	ZINC000853638579	BG	On-Demand	Anodyne	HRH1	33	42
C[C@H](O)c1nc2ccccc2n1CCC1CCC1	ZINC000853638579	BG	On-Demand	Anodyne	PDE6D	52	36
C[C@H](O)c1nc2ccccc2n1CCC1CCC1	ZINC000853638579	BG	On-Demand	Anodyne	RPS6KB1	20	40
C#CCOCCOc1ccc(CCC(C)=O)cc1	ZINC000853638580	BE	On-Demand	Mild	PLA2G4B	52	35
C#CCOCCOc1ccc(CCC(C)=O)cc1	ZINC000853638580	BE	On-Demand	Mild	FFAR1	45	40
C#CCOCCOc1ccc(CCC(C)=O)cc1	ZINC000853638580	BE	On-Demand	Mild	FFAR4	44	33
C[C@H](O)c1nc2ccccc2n1CCO[Si](C)(C)C(C)(C)C	ZINC000853638585	DI	On-Demand	Reactive	HRH1	17	40
CCN1CC[C@H](Oc2ccc3ccc(=O)oc3c2)C1=O	ZINC000853638591	CD	On-Demand	Anodyne	MAOA	21	42
COC(=O)c1nccc(N2CCC([C@@H](O)c3ccc(OC)cc3)CC2)n1	ZINC000853638616	FE	On-Demand	Anodyne	SORD	60	37
COC(=O)c1nccc(N2CCC([C@H](O)c3ccc(OC)cc3)CC2)n1	ZINC000853638617	FE	On-Demand	Anodyne	SORD	60	37
CCOc1ccc([C@@H](O)C2CCN(c3nccc4c(N)cccc34)CC2)cc1	ZINC000853638623	GI	On-Demand	Anodyne	CACNA2D2	51	33
CCOc1ccc([C@@H](O)C2CCN(c3cc(OCC)nc(C)n3)CC2)cc1	ZINC000853638638	FH	On-Demand	Anodyne	CACNA2D2	52	32
C=CCN(Cc1oc(C)nc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638656	EF	On-Demand	Mild	BMP1	58	36
C=CCN(Cc1oc(C)nc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638656	EF	On-Demand	Mild	MMP13	19	40
C=CCN(Cc1oc(C)nc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638656	EF	On-Demand	Mild	MMP3	17	40
C=CCN(Cc1oc(C)nc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638656	EF	On-Demand	Mild	MMP8	18	40
C=CCN(Cc1oc(C)nc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638656	EF	On-Demand	Mild	MMP9	22	40
C=CCN(Cc1oc(C)nc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638656	EF	On-Demand	Mild	MMP12	22	40
C=CCN(Cc1oc(C)nc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638656	EF	On-Demand	Mild	MMP1	18	40
CON(C)C(=O)C1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1	ZINC000853638661	FF	On-Demand	Bother	SERPINE1	26	47
CON(C)C(=O)C1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1	ZINC000853638661	FF	On-Demand	Bother	SFRP1	61	38
CON(C)C(=O)C1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1	ZINC000853638661	FF	On-Demand	Bother	WNT3	43	33
C=CCN(CCOC(F)F)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638667	DE	On-Demand	Mild	MMP13	19	41
C=CCN(CCOC(F)F)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638667	DE	On-Demand	Mild	MMP2	16	41
C=CCN(CCOC(F)F)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638667	DE	On-Demand	Mild	MMP3	20	41
C=CCN(CCOC(F)F)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638667	DE	On-Demand	Mild	MMP8	21	41
C=CCN(CCOC(F)F)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638667	DE	On-Demand	Mild	MMP9	18	41
C=CCN(CCOC(F)F)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638667	DE	On-Demand	Mild	MMP12	22	41
C=CCN(Cc1nonc1C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853638695	DD	On-Demand	Mild	BMP1	41	37
O=C(NCCn1cncn1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853638699	EC	On-Demand	Anodyne	CCR3	19	40
O=C(NCCn1cncn1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853638701	EC	On-Demand	Anodyne	CCR3	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3sccc3c2=O)CC1	ZINC000853638733	FD	On-Demand	Anodyne	P2RY12	45	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3sccc3c2=O)CC1	ZINC000853638735	FD	On-Demand	Anodyne	P2RY12	45	35
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3cc(F)ncn3)CC2)C1	ZINC000853638740	FG	On-Demand	Anodyne	GPR119	61	64
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3cc(F)ncn3)CC2)C1	ZINC000853638741	FG	On-Demand	Anodyne	GPR119	61	64
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853638747	FF	On-Demand	Mild	GPR119	48	61
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853638748	FF	On-Demand	Mild	GPR119	48	61
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3cc(O)nc4cccnc34)CC2)C1	ZINC000853638749	GH	On-Demand	Anodyne	GPR119	48	55
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3cc(O)nc4cccnc34)CC2)C1	ZINC000853638750	GH	On-Demand	Anodyne	GPR119	48	55
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3cc(CO)c(F)cn3)CC2)C1	ZINC000853638757	GG	On-Demand	Anodyne	GPR119	63	54
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3cc(CO)c(F)cn3)CC2)C1	ZINC000853638758	GG	On-Demand	Anodyne	GPR119	63	54
CC(=O)c1ccnc(N2CCC([C@@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853638765	FH	On-Demand	Anodyne	GPR119	54	62
CC(=O)c1ccnc(N2CCC([C@H]3CCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853638766	FH	On-Demand	Anodyne	GPR119	54	62
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3ccc(N)c([N+](=O)[O-])n3)CC2)C1	ZINC000853638780	GG	On-Demand	Bother	GPR119	45	52
Cn1cncc1CCOc1ccc2c3c(c(=O)oc2c1)CCCCC3	ZINC000853638781	EG	On-Demand	Anodyne	MAOB	46	52
Cn1cncc1CCOc1ccc2c3c(c(=O)oc2c1)CCCCC3	ZINC000853638781	EG	On-Demand	Anodyne	BCHE	20	46
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3ccc(N)c([N+](=O)[O-])n3)CC2)C1	ZINC000853638782	GG	On-Demand	Bother	GPR119	45	52
CCOc1ccc(C=NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853638783	GH	On-Demand	Mild	ACKR3	58	35
O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)N1CCC(N2CCOC2=O)CC1	ZINC000853638784	FF	On-Demand	Anodyne	L3MBTL3	42	33
CCOc1ccc(C=NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853638785	GH	On-Demand	Mild	ACKR3	58	35
O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)N1CCC(N2CCOC2=O)CC1	ZINC000853638787	FF	On-Demand	Anodyne	L3MBTL3	42	33
O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)N1CCC(N2CCOC2=O)CC1	ZINC000853638789	FF	On-Demand	Anodyne	L3MBTL3	42	33
O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)N1CCC(N2CCOC2=O)CC1	ZINC000853638791	FF	On-Demand	Anodyne	L3MBTL3	42	33
Cn1cncc1CCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853638792	EG	On-Demand	Anodyne	CYP19A1	15	42
Cn1cncc1CCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853638792	EG	On-Demand	Anodyne	CYP11B1	17	41
Cn1cncc1CCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853638792	EG	On-Demand	Anodyne	MAOA	50	36
Cn1cncc1CCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853638792	EG	On-Demand	Anodyne	MAOB	47	51
O=c1cc(C(F)(F)F)c2ccc(OC[C@@H]3COCCO3)cc2o1	ZINC000853638812	EF	On-Demand	Anodyne	MAOA	50	36
O=c1cc(C(F)(F)F)c2ccc(OC[C@@H]3COCCO3)cc2o1	ZINC000853638812	EF	On-Demand	Anodyne	MAOB	40	51
COc1ccc(OCCC2SCCS2)c(C(C)=O)c1	ZINC000853638814	CG	On-Demand	Anodyne	MTNR1A	45	38
O=c1cc(C(F)(F)F)c2ccc(OC[C@H]3COCCO3)cc2o1	ZINC000853638819	EF	On-Demand	Anodyne	MAOA	50	36
O=c1cc(C(F)(F)F)c2ccc(OC[C@H]3COCCO3)cc2o1	ZINC000853638819	EF	On-Demand	Anodyne	MAOB	40	51
O=c1cc(C(F)(F)F)c2ccc(OCCO[C@H]3CC3(F)F)cc2o1	ZINC000853638852	FH	On-Demand	Anodyne	MAOA	49	34
O=c1cc(C(F)(F)F)c2ccc(OCCO[C@H]3CC3(F)F)cc2o1	ZINC000853638852	FH	On-Demand	Anodyne	MAOB	42	52
CC(C)n1ncnc1COc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853638865	FH	On-Demand	Anodyne	MAOA	54	41
CC(C)n1ncnc1COc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853638865	FH	On-Demand	Anodyne	MAOB	52	54
CS(=O)(=O)N1CC[C@H](COc2ccc3c(C(F)(F)F)cc(=O)oc3c2)C1	ZINC000853638890	GE	On-Demand	Anodyne	MAOB	35	46
CS(=O)(=O)N1CC[C@@H](COc2ccc3c(C(F)(F)F)cc(=O)oc3c2)C1	ZINC000853638891	GE	On-Demand	Anodyne	MAOB	35	46
O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OC[C@@H]3COCCO3)cc2o1	ZINC000853638937	GG	On-Demand	Clean	MAOA	48	34
O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OC[C@@H]3COCCO3)cc2o1	ZINC000853638937	GG	On-Demand	Clean	MAOB	23	44
O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OC[C@H]3COCCO3)cc2o1	ZINC000853638938	GG	On-Demand	Clean	MAOA	48	34
O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OC[C@H]3COCCO3)cc2o1	ZINC000853638938	GG	On-Demand	Clean	MAOB	23	44
CO[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)C1CCCCC1	ZINC000853638941	EG	On-Demand	Mild	CACNA1C	41	34
CO[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)C1CCCCC1	ZINC000853638941	EG	On-Demand	Mild	CACNA1D	63	34
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000853638950	GG	On-Demand	Mild	CACNA1I	50	34
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000853638951	GG	On-Demand	Mild	CACNA1I	50	34
CCN(CCNC(=O)N[C@@H](COC)c1cccc(OC)c1)C(C)C	ZINC000853638980	EE	On-Demand	Anodyne	MTNR1A	42	39
CCN(CCNC(=O)N[C@H](COC)c1cccc(OC)c1)C(C)C	ZINC000853638981	EE	On-Demand	Anodyne	MTNR1A	42	39
CON(C)C(=O)C1CCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853638999	EF	On-Demand	Anodyne	HTR3A	33	46
Nc1ncccc1COc1ccc2c3c(c(=O)oc2c1)CCCCC3	ZINC000853639008	EH	On-Demand	Anodyne	MAOB	59	63
CO[C@@H](COc1ccc2ccc(=O)oc2c1)C1CCCC1	ZINC000853639014	CG	On-Demand	Anodyne	MAOA	39	42
CO[C@@H](COc1ccc2ccc(=O)oc2c1)C1CCCC1	ZINC000853639014	CG	On-Demand	Anodyne	MAOB	24	47
CCCc1cc(=O)oc2cc(OCCO[C@H]3CC3(F)F)ccc12	ZINC000853639029	DH	On-Demand	Anodyne	CYP11B1	16	44
CCCc1cc(=O)oc2cc(OCCO[C@H]3CC3(F)F)ccc12	ZINC000853639029	DH	On-Demand	Anodyne	MAOA	50	35
CCCc1cc(=O)oc2cc(OCCO[C@H]3CC3(F)F)ccc12	ZINC000853639029	DH	On-Demand	Anodyne	MAOB	48	46
CCCc1cc(=O)oc2cc(OCCO[C@H]3CC3(F)F)ccc12	ZINC000853639029	DH	On-Demand	Anodyne	HSD17B3	17	48
C=C(Cl)COc1ccc(OC)cc1C(C)=O	ZINC000853639031	BG	On-Demand	Mild	MTNR1A	54	38
C=C(Cl)COc1ccc(OC)cc1C(C)=O	ZINC000853639031	BG	On-Demand	Mild	MTNR1B	45	38
C=C(Cl)COc1ccc(OC)cc1C(C)=O	ZINC000853639031	BG	On-Demand	Mild	AKR1C2	41	39
CCCc1cc(=O)oc2cc(OCCO[C@@H]3CC3(F)F)ccc12	ZINC000853639032	DH	On-Demand	Anodyne	CYP11B1	16	44
CCCc1cc(=O)oc2cc(OCCO[C@@H]3CC3(F)F)ccc12	ZINC000853639032	DH	On-Demand	Anodyne	MAOA	50	35
CCCc1cc(=O)oc2cc(OCCO[C@@H]3CC3(F)F)ccc12	ZINC000853639032	DH	On-Demand	Anodyne	MAOB	48	46
CCCc1cc(=O)oc2cc(OCCO[C@@H]3CC3(F)F)ccc12	ZINC000853639032	DH	On-Demand	Anodyne	HSD17B3	17	48
O=C(C=NOCC1C[C@H]2C[C@@H]2C1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639041	DF	On-Demand	Mild	CACNA1C	47	37
O=C(C=NOCC1C[C@H]2C[C@@H]2C1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639041	DF	On-Demand	Mild	CACNA1D	77	37
O=C(C=NOCC1C[C@@H]2C[C@H]2C1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639043	DF	On-Demand	Mild	CACNA1C	47	37
O=C(C=NOCC1C[C@@H]2C[C@H]2C1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639043	DF	On-Demand	Mild	CACNA1D	77	37
O=C(C=NOC[C@H]1C[C@@H]2C[C@@H]2C1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639044	DF	On-Demand	Mild	CACNA1C	47	37
O=C(C=NOC[C@H]1C[C@@H]2C[C@@H]2C1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639044	DF	On-Demand	Mild	CACNA1D	77	37
CC(C)c1cccc(Cn2c([C@H](C)O)nc3ccccc32)c1	ZINC000853639045	CI	On-Demand	Anodyne	HRH1	26	42
CC(C)c1cccc(Cn2c([C@H](C)O)nc3ccccc32)c1	ZINC000853639045	CI	On-Demand	Anodyne	ALOX5AP	15	50
CC(C)c1cccc(Cn2c([C@H](C)O)nc3ccccc32)c1	ZINC000853639045	CI	On-Demand	Anodyne	PDE6D	59	36
CC(C)c1cccc(Cn2c([C@@H](C)O)nc3ccccc32)c1	ZINC000853639051	CI	On-Demand	Anodyne	HRH1	26	42
CC(C)c1cccc(Cn2c([C@@H](C)O)nc3ccccc32)c1	ZINC000853639051	CI	On-Demand	Anodyne	ALOX5AP	15	50
CC(C)c1cccc(Cn2c([C@@H](C)O)nc3ccccc32)c1	ZINC000853639051	CI	On-Demand	Anodyne	PDE6D	59	36
C[C@H](O)c1nc2ccccc2n1CCCC1CCC1	ZINC000853639057	CH	On-Demand	Anodyne	HRH1	32	43
C[C@H](O)c1nc2ccccc2n1CCCC1CCC1	ZINC000853639057	CH	On-Demand	Anodyne	NPY1R	40	35
C[C@H](O)c1nc2ccccc2n1CCOC(F)F	ZINC000853639073	CE	On-Demand	Anodyne	HRH1	32	42
COC(=O)C1(CON=CC(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000853639089	DD	On-Demand	Mild	CACNA1C	52	34
COC(=O)C1(CON=CC(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000853639089	DD	On-Demand	Mild	CACNA1D	82	34
CC[C@H](C)N(CC)C(=O)NCCn1cncn1	ZINC000853639096	BD	On-Demand	Anodyne	HIS3	79	38
CC(=O)CCc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853639103	DH	On-Demand	Anodyne	PLA2G4B	69	38
CC(=O)CCc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853639103	DH	On-Demand	Anodyne	FFAR4	42	32
O=c1cc(C(F)(F)F)c2ccc(OCCC3(O)CCC3)cc2o1	ZINC000853639107	EG	On-Demand	Anodyne	MAOA	50	37
O=c1cc(C(F)(F)F)c2ccc(OCCC3(O)CCC3)cc2o1	ZINC000853639107	EG	On-Demand	Anodyne	MAOB	49	53
CC(C)c1ccc2ncnc(N[C@@H]3COC(=O)C3)c2c1	ZINC000853639111	CE	On-Demand	Anodyne	CD38	75	41
CCCOc1cccc(Cn2c([C@H](C)O)nc3ccccc32)c1	ZINC000853639116	DH	On-Demand	Anodyne	PDE6D	52	41
CCCOc1cccc(Cn2c([C@@H](C)O)nc3ccccc32)c1	ZINC000853639118	DH	On-Demand	Anodyne	PDE6D	52	41
CC(C)(C)OC(=O)N1CC[C@H](C2CCN(c3cnc(F)cn3)CC2)C1	ZINC000853639120	FG	On-Demand	Anodyne	GPR119	63	62
CC(C)(C)OC(=O)N1CC[C@@H](C2CCN(c3cnc(F)cn3)CC2)C1	ZINC000853639121	FG	On-Demand	Anodyne	GPR119	63	62
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccccc2OCC)CC1	ZINC000853639136	GE	On-Demand	Mild	P2RY12	72	39
C#CCOCCOc1ccc(OC)cc1C(C)=O	ZINC000853639137	BD	On-Demand	Mild	MAOB	15	50
C#CCOCCOc1ccc(OC)cc1C(C)=O	ZINC000853639137	BD	On-Demand	Mild	MTNR1A	40	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccccc2OCC)CC1	ZINC000853639138	GE	On-Demand	Mild	P2RY12	72	39
CN(C(=O)NCCn1cncn1)[C@H](CO)c1cccc(Cl)c1Cl	ZINC000853639139	FD	On-Demand	Anodyne	HIS3	44	32
CN(C(=O)NCCn1cncn1)[C@@H](CO)c1cccc(Cl)c1Cl	ZINC000853639140	FD	On-Demand	Anodyne	HIS3	44	32
COc1ccc(OC[C@H](OC)C2CCC2)c(C(C)=O)c1	ZINC000853639149	CG	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(OC[C@H](OC)C2CCC2)c(C(C)=O)c1	ZINC000853639149	CG	On-Demand	Anodyne	MTNR1B	51	37
COc1ccc(OC[C@H](OC)C2CCC2)c(C(C)=O)c1	ZINC000853639149	CG	On-Demand	Anodyne	ABCB1	17	46
COc1ccc(OC[C@@H](OC)C2CCC2)c(C(C)=O)c1	ZINC000853639151	CG	On-Demand	Anodyne	MTNR1A	53	37
COc1ccc(OC[C@@H](OC)C2CCC2)c(C(C)=O)c1	ZINC000853639151	CG	On-Demand	Anodyne	MTNR1B	51	37
COc1ccc(OC[C@@H](OC)C2CCC2)c(C(C)=O)c1	ZINC000853639151	CG	On-Demand	Anodyne	ABCB1	17	46
C[C@H](O)c1nc2ccccc2n1C[C@H]1COCCO1	ZINC000853639182	CD	On-Demand	Anodyne	HRH1	22	40
C[C@H](O)c1nc2ccccc2n1C[C@@H]1COCCO1	ZINC000853639183	CD	On-Demand	Anodyne	HRH1	22	40
C#CCOCCN(C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000853639219	DC	On-Demand	Mild	PKM	34	41
CCN(CCNC(=O)NCC[C@@H](C)N(C)C)C(C)C	ZINC000853639235	CD	On-Demand	Anodyne	CHRNA4	18	40
CCN(CCNC(=O)NCC[C@H](C)N(C)C)C(C)C	ZINC000853639236	CD	On-Demand	Anodyne	CHRNA4	18	40
O=C(C=NOCCCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639241	DG	On-Demand	Mild	CACNA1C	43	35
O=C(C=NOCCCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639241	DG	On-Demand	Mild	CACNA1D	66	35
COc1ccc([C@@H](O)C2CCN(c3cc(CO)c(F)cn3)CC2)cc1	ZINC000853639247	EF	On-Demand	Anodyne	DCK	40	42
COc1ccc([C@@H](O)C2CCN(c3cc(F)ncn3)CC2)cc1	ZINC000853639257	DF	On-Demand	Anodyne	DCK	40	43
CON(C)CCNC(=O)NCCCNC(=O)c1ccc(Br)cc1	ZINC000853639281	GD	On-Demand	Anodyne	HDAC9	16	45
CON(C)C(=O)C1CCN(c2nc3ncccc3cc2C#N)CC1	ZINC000853639294	ED	On-Demand	Mild	P2RY12	25	41
O=C(C=NOCCO[C@@H]1CC1(F)F)Nc1cccc([N+](=O)[O-])c1	ZINC000853639296	ED	On-Demand	Mild	CACNA1C	40	32
O=C(C=NOCCO[C@@H]1CC1(F)F)Nc1cccc([N+](=O)[O-])c1	ZINC000853639296	ED	On-Demand	Mild	CACNA1D	66	32
O=C(C=NOCCO[C@H]1CC1(F)F)Nc1cccc([N+](=O)[O-])c1	ZINC000853639297	ED	On-Demand	Mild	CACNA1C	40	32
O=C(C=NOCCO[C@H]1CC1(F)F)Nc1cccc([N+](=O)[O-])c1	ZINC000853639297	ED	On-Demand	Mild	CACNA1D	66	32
COC[C@@H](COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)OC	ZINC000853639309	GG	On-Demand	Clean	ALDH2	71	34
COC[C@@H](COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)OC	ZINC000853639309	GG	On-Demand	Clean	MAOA	50	36
COC[C@@H](COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)OC	ZINC000853639309	GG	On-Demand	Clean	MAOB	44	48
CCCc1ccc(N2CCC([C@@H](O)c3ccc(OCC)cc3)CC2)nn1	ZINC000853639316	FH	On-Demand	Anodyne	CACNA2D2	50	32
CCCc1ccc(N2CCC([C@H](O)c3ccc(OCC)cc3)CC2)nn1	ZINC000853639318	FH	On-Demand	Anodyne	CACNA2D2	50	32
CCOc1ccc(C=NOCc2cccnc2N)cc1OC	ZINC000853639319	DF	On-Demand	Mild	DRTS_PLAFK	33	42
CCCc1cc(=O)oc2cc(OC[C@H](COC)OC)ccc12	ZINC000853639325	DF	On-Demand	Anodyne	CYP11B1	18	44
CCCc1cc(=O)oc2cc(OC[C@H](COC)OC)ccc12	ZINC000853639325	DF	On-Demand	Anodyne	MAOA	60	38
CCCc1cc(=O)oc2cc(OC[C@H](COC)OC)ccc12	ZINC000853639325	DF	On-Demand	Anodyne	MAOB	56	48
CCCc1cc(=O)oc2cc(OC[C@H](COC)OC)ccc12	ZINC000853639325	DF	On-Demand	Anodyne	HSD17B3	19	52
CCCc1cc(=O)oc2cc(OC[C@@H](COC)OC)ccc12	ZINC000853639326	DF	On-Demand	Anodyne	CYP11B1	18	44
CCCc1cc(=O)oc2cc(OC[C@@H](COC)OC)ccc12	ZINC000853639326	DF	On-Demand	Anodyne	MAOA	60	38
CCCc1cc(=O)oc2cc(OC[C@@H](COC)OC)ccc12	ZINC000853639326	DF	On-Demand	Anodyne	MAOB	56	48
CCCc1cc(=O)oc2cc(OC[C@@H](COC)OC)ccc12	ZINC000853639326	DF	On-Demand	Anodyne	HSD17B3	19	52
CCOc1ccccc1C=NO[C@H]1CCCN(CCC(=O)OC)C1=O	ZINC000853639346	ED	On-Demand	Mild	HCN4	40	31
CCOc1ccccc1C=NO[C@@H]1CCCN(CCC(=O)OC)C1=O	ZINC000853639347	ED	On-Demand	Mild	HCN4	40	31
COC[C@@H](COc1ccc2c3c(c(=O)oc2c1)CCCCC3)OC	ZINC000853639380	EG	On-Demand	Anodyne	MAOB	54	57
COC[C@@H](COc1ccc2c3c(c(=O)oc2c1)CCCCC3)OC	ZINC000853639380	EG	On-Demand	Anodyne	BCHE	16	42
C=C(Cl)CON=Cc1ccc(OCC)c(OC)c1	ZINC000853639382	CG	On-Demand	Mild	TUBB1	21	42
CCC(CC)CON=CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853639383	CF	On-Demand	Mild	CACNA1C	47	35
CCC(CC)CON=CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853639383	CF	On-Demand	Mild	CACNA1D	77	34
CCCn1ncnc1COc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853639384	FG	On-Demand	Anodyne	MAOA	53	39
CCCn1ncnc1COc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853639384	FG	On-Demand	Anodyne	MAOB	49	52
COC[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)OC	ZINC000853639398	EF	On-Demand	Anodyne	MAOA	61	38
COC[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)OC	ZINC000853639398	EF	On-Demand	Anodyne	MAOB	57	56
CC1(CON=CC(=O)Nc2cccc([N+](=O)[O-])c2)CCC1	ZINC000853639414	CF	On-Demand	Mild	CACNA1C	50	33
CC1(CON=CC(=O)Nc2cccc([N+](=O)[O-])c2)CCC1	ZINC000853639414	CF	On-Demand	Mild	CACNA1D	82	33
O=C(C=NOCC1C[C@@H]2C[C@H]2C1)Nc1ccccc1	ZINC000853639419	CF	On-Demand	Mild	F13A1	40	32
O=C(C=NOC[C@H]1C[C@@H]2C[C@@H]2C1)Nc1ccccc1	ZINC000853639420	CF	On-Demand	Mild	F13A1	40	32
O=C(C=NOCC1C[C@H]2C[C@@H]2C1)Nc1ccccc1	ZINC000853639421	CF	On-Demand	Mild	F13A1	40	32
CCCc1cc(=O)oc2cc(OCC3(C(=O)OC)CC3)ccc12	ZINC000853639427	DG	On-Demand	Anodyne	CYP11B1	16	42
CCCc1cc(=O)oc2cc(OCC3(C(=O)OC)CC3)ccc12	ZINC000853639427	DG	On-Demand	Anodyne	MAOA	62	44
CCCc1cc(=O)oc2cc(OCC3(C(=O)OC)CC3)ccc12	ZINC000853639427	DG	On-Demand	Anodyne	MAOB	53	48
CCCc1cc(=O)oc2cc(OCC3(C(=O)OC)CC3)ccc12	ZINC000853639427	DG	On-Demand	Anodyne	HSD17B3	20	51
O=C(C=NOCCC1(O)CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639456	DD	On-Demand	Mild	CACNA1D	44	32
O=C(C=NOCCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639471	CF	On-Demand	Mild	CACNA1C	48	36
O=C(C=NOCCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639471	CF	On-Demand	Mild	CACNA1D	77	36
CCOc1ccc(C=NOCc2ccc(C#N)cc2C(F)(F)F)cc1OC	ZINC000853639472	GJ	On-Demand	Mild	ESRRA	32	43
CCN(CCNC(=O)N(CCN1CCOCC1)CC1CC1)C(C)C	ZINC000853639474	ED	On-Demand	Anodyne	CASR	47	34
CCOc1ccc([C@@H](O)C2CCN(c3ccc(C)nn3)CC2)cc1	ZINC000853639483	EG	On-Demand	Anodyne	CACNA2D1	44	38
CCOc1ccc([C@@H](O)C2CCN(c3ccc(C)nn3)CC2)cc1	ZINC000853639483	EG	On-Demand	Anodyne	CACNA2D2	57	35
CON(C)C(=O)C1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853639491	EF	On-Demand	Anodyne	PDE3A	45	44
CON(C)C(=O)C1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853639491	EF	On-Demand	Anodyne	PDGFRB	70	49
CON(C)C(=O)C1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853639491	EF	On-Demand	Anodyne	PDE3B	50	44
CON(C)C(=O)C1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853639491	EF	On-Demand	Anodyne	SIRT3	58	33
CON(C)C(=O)C1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853639491	EF	On-Demand	Anodyne	SIRT2	53	33
CON(C)C(=O)C1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853639491	EF	On-Demand	Anodyne	SIRT1	51	32
CN(CCCCC1(C)OCCO1)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000853639516	FE	On-Demand	Anodyne	PKM	33	40
N#CCC1(COc2ccc3c(C(F)(F)F)cc(=O)oc3c2)CC1	ZINC000853639520	DH	On-Demand	Mild	MAOA	49	36
N#CCC1(COc2ccc3c(C(F)(F)F)cc(=O)oc3c2)CC1	ZINC000853639520	DH	On-Demand	Mild	MAOB	40	51
C#CCOCCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853639522	DF	On-Demand	Mild	MAOA	58	35
C#CCOCCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1	ZINC000853639522	DF	On-Demand	Mild	MAOB	49	51
COC(=O)C1(COc2ccc3c(C(F)(F)F)cc(=O)oc3c2)CC1	ZINC000853639524	EG	On-Demand	Anodyne	MAOA	63	44
COC(=O)C1(COc2ccc3c(C(F)(F)F)cc(=O)oc3c2)CC1	ZINC000853639524	EG	On-Demand	Anodyne	MAOB	52	50
CON(C)C(=O)C1CCN(c2ncnc3c2nnn3C)CC1	ZINC000853639545	DB	On-Demand	Anodyne	SIRT3	42	34
CO[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000853639557	EF	On-Demand	Mild	CACNA1C	45	35
CO[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)C1CCCC1	ZINC000853639557	EF	On-Demand	Mild	CACNA1D	70	34
CCOc1ccc([C@@H](O)C2CCN(c3nc(C#N)ccc3C)CC2)cc1	ZINC000853639564	FH	On-Demand	Mild	CACNA2D2	56	34
CCOc1ccc([C@@H](O)C2CCN(c3ccnc(C(=O)OC)n3)CC2)cc1	ZINC000853639574	FF	On-Demand	Anodyne	SORD	50	35
COC[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)OC	ZINC000853639589	DD	On-Demand	Mild	CACNA1C	50	36
COC[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)OC	ZINC000853639589	DD	On-Demand	Mild	CACNA1D	83	36
C=CCN(CCCCC1(C)OCCO1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639615	FF	On-Demand	Mild	BMP1	58	38
C=CCN(CCCCC1(C)OCCO1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639615	FF	On-Demand	Mild	MMP3	23	40
CC(C)(C)OC(=O)NCCC[C@H](Nc1cc(C#N)cnn1)c1ccccc1	ZINC000853639624	FH	On-Demand	Mild	CTRB_BOVIN	53	32
CC(C)(C)OC(=O)NCCC[C@@H](Nc1cc(C#N)cnn1)c1ccccc1	ZINC000853639625	FH	On-Demand	Mild	CTRB_BOVIN	53	32
CCCc1cc(=O)oc2cc(O[C@H]3CCN(CC)C3=O)ccc12	ZINC000853639628	DF	On-Demand	Anodyne	CYP11B1	16	40
CCCc1cc(=O)oc2cc(O[C@H]3CCN(CC)C3=O)ccc12	ZINC000853639628	DF	On-Demand	Anodyne	MAOB	30	42
CCCc1cc(=O)oc2cc(O[C@H]3CCN(CC)C3=O)ccc12	ZINC000853639628	DF	On-Demand	Anodyne	HSD17B3	20	51
CCCc1cc(=O)oc2cc(O[C@@H]3CCN(CC)C3=O)ccc12	ZINC000853639629	DF	On-Demand	Anodyne	CYP11B1	16	40
CCCc1cc(=O)oc2cc(O[C@@H]3CCN(CC)C3=O)ccc12	ZINC000853639629	DF	On-Demand	Anodyne	MAOB	30	42
CCCc1cc(=O)oc2cc(O[C@@H]3CCN(CC)C3=O)ccc12	ZINC000853639629	DF	On-Demand	Anodyne	HSD17B3	20	51
CCC(CC)CON=CC(=O)Nc1ccccc1	ZINC000853639635	BG	On-Demand	Mild	PDS	42	35
O=c1cc(C(F)(F)F)c2ccc(OCCC3SCCS3)cc2o1	ZINC000853639642	FI	On-Demand	Anodyne	MAOA	52	37
O=c1cc(C(F)(F)F)c2ccc(OCCC3SCCS3)cc2o1	ZINC000853639642	FI	On-Demand	Anodyne	MAOB	46	53
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2ccccc2)CC1	ZINC000853639657	GD	On-Demand	Mild	P2RY12	181	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2ccccc2)CC1	ZINC000853639657	GD	On-Demand	Mild	TGM2	61	46
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2ccccc2)CC1	ZINC000853639657	GD	On-Demand	Mild	F13A1	77	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2ccccc2)CC1	ZINC000853639658	GD	On-Demand	Mild	P2RY12	181	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2ccccc2)CC1	ZINC000853639658	GD	On-Demand	Mild	TGM2	61	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2ccccc2)CC1	ZINC000853639658	GD	On-Demand	Mild	F13A1	77	46
CCOc1ccccc1C=NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853639697	FH	On-Demand	Mild	HCN1	40	31
CCOc1ccccc1C=NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853639697	FH	On-Demand	Mild	HCN4	40	31
CCOc1ccccc1C=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853639698	FH	On-Demand	Mild	HCN1	40	31
CCOc1ccccc1C=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853639698	FH	On-Demand	Mild	HCN4	40	31
Cn1nnc2c(N[C@@H](CCCNC(=O)OC(C)(C)C)c3ccccc3)ncnc21	ZINC000853639702	GG	On-Demand	Anodyne	C3AR1	48	33
Cn1nnc2c(N[C@H](CCCNC(=O)OC(C)(C)C)c3ccccc3)ncnc21	ZINC000853639703	GG	On-Demand	Anodyne	C3AR1	48	33
CO[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)C1CCC1	ZINC000853639707	EI	On-Demand	Anodyne	MAOA	52	37
CO[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)C1CCC1	ZINC000853639707	EI	On-Demand	Anodyne	MAOB	43	49
CCN1CC[C@H](Oc2ccc3c(C(F)(F)F)cc(=O)oc3c2)C1=O	ZINC000853639712	EF	On-Demand	Anodyne	AR	18	47
CCN1CC[C@H](Oc2ccc3c(C(F)(F)F)cc(=O)oc3c2)C1=O	ZINC000853639712	EF	On-Demand	Anodyne	MAOB	25	45
O=c1cc(C(F)(F)F)c2ccc(OCc3cc(C4CC4)no3)cc2o1	ZINC000853639717	FI	On-Demand	Anodyne	MAOA	53	38
O=c1cc(C(F)(F)F)c2ccc(OCc3cc(C4CC4)no3)cc2o1	ZINC000853639717	FI	On-Demand	Anodyne	MAOB	48	53
CON(C)C(=O)C1CCN(c2cc(Nc3ccccc3)ncn2)CC1	ZINC000853639746	EE	On-Demand	Anodyne	MAPK10	15	44
CON(C)C(=O)C1CCN(c2cc(Nc3ccccc3)ncn2)CC1	ZINC000853639746	EE	On-Demand	Anodyne	GALR2	52	37
CN(C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)S(=O)(=O)c1ccc(F)cc1	ZINC000853639761	GE	On-Demand	Anodyne	GPR119	43	42
CCOc1ccc([C@@H](O)C2CCN(c3nccnc3-c3ccccc3)CC2)cc1	ZINC000853639765	GI	On-Demand	Anodyne	CACNA2D2	55	33
CN(Cc1csc(Cl)n1)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000853639771	FE	On-Demand	Anodyne	PKM	33	40
CON(C)C(=O)C1CCN(c2ccc(C)nn2)CC1	ZINC000853639783	CD	On-Demand	Anodyne	SCD1	47	37
CN(CCOC(F)F)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000853639798	DD	On-Demand	Anodyne	PKM	37	42
CCN(CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1)C(C)C	ZINC000853639804	DF	On-Demand	Anodyne	PRSS2	46	31
CCN(CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1)C(C)C	ZINC000853639804	DF	On-Demand	Anodyne	AMY2	43	30
CCN(CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1)C(C)C	ZINC000853639804	DF	On-Demand	Anodyne	EPHX2	22	45
CCCc1cc(=O)oc2cc(OCC3(CC#N)CC3)ccc12	ZINC000853639822	CH	On-Demand	Mild	CYP11B1	16	40
CCCc1cc(=O)oc2cc(OCC3(CC#N)CC3)ccc12	ZINC000853639822	CH	On-Demand	Mild	MAOA	50	38
CCCc1cc(=O)oc2cc(OCC3(CC#N)CC3)ccc12	ZINC000853639822	CH	On-Demand	Mild	MAOB	47	48
CCCc1cc(=O)oc2cc(OCC3(CC#N)CC3)ccc12	ZINC000853639822	CH	On-Demand	Mild	HSD17B3	15	48
CCN1CC[C@H](Oc2ccc3c4c(c(=O)oc3c2)CCCCC4)C1=O	ZINC000853639831	EG	On-Demand	Anodyne	MAOB	28	51
CCOc1ccccc1C=NOCC1(C(=O)OC)CC1	ZINC000853639834	CE	On-Demand	Mild	HCN1	52	36
CCOc1ccccc1C=NOCC1(C(=O)OC)CC1	ZINC000853639834	CE	On-Demand	Mild	HCN4	44	34
CCCc1cc(=O)oc2cc(OCCc3cncn3C)ccc12	ZINC000853639858	DG	On-Demand	Anodyne	CYP19A1	19	52
CCCc1cc(=O)oc2cc(OCCc3cncn3C)ccc12	ZINC000853639858	DG	On-Demand	Anodyne	CYP11B1	20	51
CCCc1cc(=O)oc2cc(OCCc3cncn3C)ccc12	ZINC000853639858	DG	On-Demand	Anodyne	MAOA	59	36
CCCc1cc(=O)oc2cc(OCCc3cncn3C)ccc12	ZINC000853639858	DG	On-Demand	Anodyne	MAOB	51	45
CCCc1cc(=O)oc2cc(OCCc3cncn3C)ccc12	ZINC000853639858	DG	On-Demand	Anodyne	HSD17B3	15	47
CO[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000853639866	DE	On-Demand	Mild	CACNA1C	44	35
CO[C@@H](CON=CC(=O)Nc1cccc([N+](=O)[O-])c1)C1CCC1	ZINC000853639866	DE	On-Demand	Mild	CACNA1D	68	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccccc2OC(F)F)CC1	ZINC000853639880	GE	On-Demand	Mild	P2RY12	40	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccccc2OC(F)F)CC1	ZINC000853639881	GE	On-Demand	Mild	P2RY12	40	37
O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OCCC3(O)CCC3)cc2o1	ZINC000853639920	GI	On-Demand	Bother	ALDH2	73	36
O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OCCC3(O)CCC3)cc2o1	ZINC000853639920	GI	On-Demand	Bother	MAOA	47	35
O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(OCCC3(O)CCC3)cc2o1	ZINC000853639920	GI	On-Demand	Bother	MAOB	34	45
C#Cc1cccnc1N1CCC([C@@H](O)c2ccc(OCC)cc2)CC1	ZINC000853639926	EG	On-Demand	Mild	CACNA2D2	52	32
C#Cc1cccnc1N1CCC([C@H](O)c2ccc(OCC)cc2)CC1	ZINC000853639927	EG	On-Demand	Mild	CACNA2D2	52	32
O=C(C=NOCC1CC=CC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639931	CF	On-Demand	Mild	CACNA1D	54	35
CCOc1ccc([C@@H](O)C2CCN(c3ncnc4c3nnn4C)CC2)cc1	ZINC000853639939	FE	On-Demand	Anodyne	CACNA2D2	56	35
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	BMP1	88	47
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	MMP13	40	49
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	MMP2	27	56
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	MMP3	32	56
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	MMP8	30	56
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	MMP9	42	56
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	MMP12	31	46
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	MMP1	35	56
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	DAGLA	28	40
C#CCOCCN(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853639942	FF	On-Demand	Mild	RORC	15	40
CCOc1ccc([C@@H](O)C2CCN(c3nccnc3OC3CCC3)CC2)cc1	ZINC000853639949	GH	On-Demand	Anodyne	CACNA2D2	53	32
Cc1nonc1CN(C)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000853639967	EC	On-Demand	Anodyne	PKM	34	41
CCOC(=O)c1nccc(N2CCC([C@@H](O)c3ccc(OCC)cc3)CC2)n1	ZINC000853639978	GG	On-Demand	Anodyne	SORD	58	35
CCOC(=O)c1nccc(N2CCC([C@H](O)c3ccc(OCC)cc3)CC2)n1	ZINC000853639979	GG	On-Demand	Anodyne	SORD	58	35
O=C(C=NOCCC1SCCS1)Nc1cccc([N+](=O)[O-])c1	ZINC000853639994	EF	On-Demand	Mild	CACNA1D	44	31
CS(=O)(=O)N1CC[C@@H](CON=CC(=O)Nc2ccccc2)C1	ZINC000853639996	EC	On-Demand	Mild	TGM2	61	41
CS(=O)(=O)N1CC[C@@H](CON=CC(=O)Nc2ccccc2)C1	ZINC000853639996	EC	On-Demand	Mild	F13A1	88	41
CS(=O)(=O)N1CC[C@H](CON=CC(=O)Nc2ccccc2)C1	ZINC000853639998	EC	On-Demand	Mild	TGM2	61	41
CS(=O)(=O)N1CC[C@H](CON=CC(=O)Nc2ccccc2)C1	ZINC000853639998	EC	On-Demand	Mild	F13A1	88	41
O=C(C=NOCCOC(F)F)Nc1cccc([N+](=O)[O-])c1	ZINC000853640017	DD	On-Demand	Mild	CACNA1D	40	32
O=c1cc(C(F)(F)F)c2ccc(OCc3ncnn3CCF)cc2o1	ZINC000853640033	FF	On-Demand	Anodyne	MAOA	51	38
O=c1cc(C(F)(F)F)c2ccc(OCc3ncnn3CCF)cc2o1	ZINC000853640033	FF	On-Demand	Anodyne	MAOB	47	54
CC(C)n1ncnc1CON=CC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853640041	ED	On-Demand	Mild	CACNA1D	51	32
CCCc1cc(=O)oc2cc(O[C@H]3CCCN(CCC(=O)OC)C3=O)ccc12	ZINC000853640075	GF	On-Demand	Anodyne	MAOB	16	41
CCCc1cc(=O)oc2cc(O[C@@H]3CCCN(CCC(=O)OC)C3=O)ccc12	ZINC000853640076	GF	On-Demand	Anodyne	MAOB	16	41
CO[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)[C@@H]1CCOC1	ZINC000853640086	FG	On-Demand	Anodyne	MAOA	49	34
CO[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)[C@@H]1CCOC1	ZINC000853640086	FG	On-Demand	Anodyne	MAOB	35	46
CO[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)[C@H]1CCOC1	ZINC000853640087	FG	On-Demand	Anodyne	MAOA	49	34
CO[C@@H](COc1ccc2c(C(F)(F)F)cc(=O)oc2c1)[C@H]1CCOC1	ZINC000853640087	FG	On-Demand	Anodyne	MAOB	35	46
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccccc2OC)CC1	ZINC000853640092	FD	On-Demand	Mild	P2RY12	82	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccccc2OC)CC1	ZINC000853640093	FD	On-Demand	Mild	P2RY12	82	38
O=c1cc(C(F)(F)F)c2ccc(OCCOC(F)F)cc2o1	ZINC000853640098	DG	On-Demand	Anodyne	ALDH2	57	33
O=c1cc(C(F)(F)F)c2ccc(OCCOC(F)F)cc2o1	ZINC000853640098	DG	On-Demand	Anodyne	MAOA	51	37
O=c1cc(C(F)(F)F)c2ccc(OCCOC(F)F)cc2o1	ZINC000853640098	DG	On-Demand	Anodyne	MAOB	51	43
CON(C)C(=O)C1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853640152	ED	On-Demand	Anodyne	SCD1	55	38
CCNc1nccnc1N1CCC([C@H](O)c2ccc(OCC)cc2)CC1	ZINC000853640178	FG	On-Demand	Anodyne	CACNA2D2	52	32
CCNc1nccnc1N1CCC([C@@H](O)c2ccc(OCC)cc2)CC1	ZINC000853640179	FG	On-Demand	Anodyne	CACNA2D2	52	32
CCN(CCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)C(C)C	ZINC000853640208	FD	On-Demand	Anodyne	MCHR1	24	42
CCN(CCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)C(C)C	ZINC000853640209	FD	On-Demand	Anodyne	MCHR1	24	42
CN(CCC1SCCS1)S(=O)(=O)c1ccc2c(c1)OCCO2	ZINC000853640212	FE	On-Demand	Anodyne	PKM	34	42
CCCOc1cccc(CN2C(=O)CS/C2=C/C(=O)OCC)c1	ZINC000853640223	EF	On-Demand	Anodyne	HRH2	28	41
CCCOc1cccc(CN2C(=O)CS/C2=C\C(=O)OCC)c1	ZINC000853640224	EF	On-Demand	Anodyne	HRH2	28	41
C=CCN(CCC1SCCS1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640225	FG	On-Demand	Mild	MMP3	19	44
C=CCN(CCC1SCCS1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640225	FG	On-Demand	Mild	MMP8	16	40
C=CCN(CCC1SCCS1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640225	FG	On-Demand	Mild	MMP12	15	40
C#CCCCOc1cccnc1N1CCC([C@H](O)c2ccc(OCC)cc2)CC1	ZINC000853640242	GI	On-Demand	Mild	CACNA2D2	51	32
C#CCCCOc1cccnc1N1CCC([C@@H](O)c2ccc(OCC)cc2)CC1	ZINC000853640243	GI	On-Demand	Mild	CACNA2D2	51	32
CCOC(=O)c1nccc(N2CCC([C@H](O)c3ccc(OC)cc3)CC2)n1	ZINC000853640263	FF	On-Demand	Anodyne	SORD	56	35
CCOC(=O)c1nccc(N2CCC([C@@H](O)c3ccc(OC)cc3)CC2)n1	ZINC000853640264	FF	On-Demand	Anodyne	SORD	56	35
CCOc1ccc([C@@H](O)C2CCN(c3ncnn3C)CC2)cc1	ZINC000853640278	DE	On-Demand	Anodyne	CACNA2D2	50	31
CON(C)CCNC(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000853640289	FE	On-Demand	Anodyne	CACNA1I	59	36
CON(C)CCNC(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC000853640290	FE	On-Demand	Anodyne	CACNA1I	59	36
C#CCOCCN(CC=C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640298	DD	On-Demand	Mild	MMP12	18	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccccc2C)CC1	ZINC000853640343	EE	On-Demand	Mild	P2RY12	72	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccccc2C)CC1	ZINC000853640344	EE	On-Demand	Mild	P2RY12	72	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2ccccc2)CCC1	ZINC000853640394	GH	On-Demand	Clean	STAT6	15	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2ccccc2)CCC1	ZINC000853640394	GH	On-Demand	Clean	SLC12A5	42	31
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	CHRM2	19	42
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	CHRM1	17	42
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	DRD2	19	47
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	DRD4	43	47
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	ACHE	36	42
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	DRD3	15	47
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	CHRM3	26	42
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	LTA4H	15	41
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	SIGMAR1	48	55
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	SSTR5	46	35
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	CCR3	26	40
C[C@@H](ON=Cc1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853640421	FG	On-Demand	Mild	MCHR1	39	46
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccccc2OC(C)C)CC1	ZINC000853640445	GF	On-Demand	Mild	P2RY12	46	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccccc2OC(C)C)CC1	ZINC000853640446	GF	On-Demand	Mild	P2RY12	46	38
Cc1ncoc1CNc1nc(-c2cccnc2)nc(C)c1C	ZINC000853640459	CG	On-Demand	Anodyne	ROS1	41	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2cccs2)CC1	ZINC000853640544	ED	On-Demand	Mild	P2RY12	40	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2cccs2)CC1	ZINC000853640545	ED	On-Demand	Mild	P2RY12	40	37
Cc1ncoc1CNc1ncnc2c1ncn2C1CC1	ZINC000853640556	CE	On-Demand	Anodyne	ADORA1	66	42
Cc1ncoc1CNc1ncnc2c1ncn2C1CC1	ZINC000853640556	CE	On-Demand	Anodyne	ADORA3	85	42
Cc1ncoc1CNc1ncnc2c1ncn2C1CC1	ZINC000853640556	CE	On-Demand	Anodyne	Q4VQ11_PIG	50	38
Cc1ccccc1C=NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853640558	GG	On-Demand	Mild	DRD4	18	52
Cc1ccccc1C=NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853640558	GG	On-Demand	Mild	SIGMAR1	20	47
Cc1ccccc1C=NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853640558	GG	On-Demand	Mild	MCHR1	25	41
O=C(c1ccccc1)N1CC[C@H](CON=Cc2ccc(F)cc2)C1	ZINC000853640587	EG	On-Demand	Mild	SLC18A3	17	44
O=C(c1ccccc1)N1CC[C@@H](CON=Cc2ccc(F)cc2)C1	ZINC000853640588	EG	On-Demand	Mild	SLC18A3	17	44
CN(CCO[Si](C)(C)C(C)(C)C)S(=O)(=O)c1cccs1	ZINC000853640599	EG	On-Demand	Reactive	SQLE	32	43
Cc1ncoc1CNc1nccn(C(F)F)c1=O	ZINC000853640606	CD	On-Demand	Anodyne	CASP3	70	38
Cc1ncoc1CNc1nccn(C(F)F)c1=O	ZINC000853640606	CD	On-Demand	Anodyne	CASP8	43	38
Cc1ncoc1CNc1nccn(C(F)F)c1=O	ZINC000853640606	CD	On-Demand	Anodyne	CASP1	46	33
Cc1ncoc1CNc1nccn(C(F)F)c1=O	ZINC000853640606	CD	On-Demand	Anodyne	CASP7	55	38
c1ccc2c(N3CC(CN4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853640609	FE	On-Demand	Anodyne	PIK3CA	51	44
c1ccc2c(N3CC(CN4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853640609	FE	On-Demand	Anodyne	PIK3CD	25	40
c1ccc2c(N3CC(CN4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853640609	FE	On-Demand	Anodyne	MTOR	58	41
c1ccc2c(N3CC(CN4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853640609	FE	On-Demand	Anodyne	PIK3CG	23	43
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	BMP1	62	40
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP13	60	46
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	ADAM17	17	42
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP2	38	45
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP3	57	46
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP8	41	46
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP9	59	46
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP12	32	45
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP7	35	41
C=C(Cl)CN(C)S(=O)(=O)c1ccc(OC)cc1	ZINC000853640626	CE	On-Demand	Mild	MMP1	57	45
C#CCOCCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1	ZINC000853640660	FF	On-Demand	Mild	BMP1	49	39
C#CCOCCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1	ZINC000853640660	FF	On-Demand	Mild	MMP13	19	43
C#CCOCCN(c1ccc(OC)cc1)S(=O)(=O)c1ccc(C)cc1	ZINC000853640660	FF	On-Demand	Mild	MMP9	27	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)c2cccs2)CC1	ZINC000853640681	GD	On-Demand	Anodyne	P2RY12	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)c2cccs2)CC1	ZINC000853640684	GD	On-Demand	Anodyne	P2RY12	43	37
CCC(CC)CONC(=N)CC(=O)Nc1ccccc1Cl	ZINC000853640686	DH	On-Demand	Anodyne	KCNQ2	48	36
COC(=O)N1CCC[C@@H](NC(=O)N[C@@H](C(C)C)C2(CO)CC=CC2)C1	ZINC000853640751	FD	On-Demand	Anodyne	BIRC2	22	41
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](C(C)C)C2(CO)CC=CC2)C1	ZINC000853640753	FD	On-Demand	Anodyne	BIRC2	22	41
COC(=O)N1CCC[C@@H](NC(=O)N[C@H](C(C)C)C2(CO)CC=CC2)C1	ZINC000853640755	FD	On-Demand	Anodyne	BIRC2	22	41
COC(=O)N1CCC[C@H](NC(=O)N[C@H](C(C)C)C2(CO)CC=CC2)C1	ZINC000853640757	FD	On-Demand	Anodyne	BIRC2	22	41
CCN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(C)C	ZINC000853640811	DD	On-Demand	Anodyne	MME	43	38
CCN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(C)C	ZINC000853640811	DD	On-Demand	Anodyne	NPY5R	28	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccc(F)cc2)CC1	ZINC000853640817	FD	On-Demand	Mild	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccc(F)cc2)CC1	ZINC000853640818	FD	On-Demand	Mild	P2RY12	42	36
O=C(CON=Cc1ccc(F)cc1)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853640824	GF	On-Demand	Mild	C3AR1	33	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccc(OCC)cc2)CC1	ZINC000853640826	GE	On-Demand	Mild	P2RY12	54	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccc(OCC)cc2)CC1	ZINC000853640827	GE	On-Demand	Mild	P2RY12	54	38
Cc1nc(N2CC(CN3CCOCC3)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853640829	FD	On-Demand	Anodyne	MTOR	24	51
Cc1ncoc1CNc1ncnc2c1ncn2C	ZINC000853640860	BD	On-Demand	Anodyne	ADORA1	15	46
Cc1ncoc1CNc1ncnc2c1ncn2C	ZINC000853640860	BD	On-Demand	Anodyne	ADORA3	40	36
O=C(c1ccccc1)N1CC[C@H](CON=Cc2ccccc2C(F)(F)F)C1	ZINC000853640884	GI	On-Demand	Mild	SLC9A1	27	41
O=C(c1ccccc1)N1CC[C@H](CON=Cc2ccccc2C(F)(F)F)C1	ZINC000853640884	GI	On-Demand	Mild	RBP4	64	38
O=C(c1ccccc1)N1CC[C@H](CON=Cc2ccccc2C(F)(F)F)C1	ZINC000853640884	GI	On-Demand	Mild	SFRP1	63	38
O=C(c1ccccc1)N1CC[C@@H](CON=Cc2ccccc2C(F)(F)F)C1	ZINC000853640885	GI	On-Demand	Mild	SLC9A1	27	41
O=C(c1ccccc1)N1CC[C@@H](CON=Cc2ccccc2C(F)(F)F)C1	ZINC000853640885	GI	On-Demand	Mild	RBP4	64	38
O=C(c1ccccc1)N1CC[C@@H](CON=Cc2ccccc2C(F)(F)F)C1	ZINC000853640885	GI	On-Demand	Mild	SFRP1	63	38
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(F)cc2)CC1	ZINC000853640886	GG	On-Demand	Mild	DRD4	20	49
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(F)cc2)CC1	ZINC000853640886	GG	On-Demand	Mild	SIGMAR1	23	51
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(F)cc2)CC1	ZINC000853640886	GG	On-Demand	Mild	CCR3	46	45
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(F)cc2)CC1	ZINC000853640886	GG	On-Demand	Mild	MCHR1	28	40
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(F)cc2)CC1	ZINC000853640886	GG	On-Demand	Mild	CACNA1G	34	42
Cc1ccccc1C=NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853640893	DH	On-Demand	Mild	SLC6A1	49	35
Cc1ccccc1C=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853640894	DH	On-Demand	Mild	SLC6A1	49	35
CCN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(C)C	ZINC000853640896	DD	On-Demand	Anodyne	MME	43	38
CCN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(C)C	ZINC000853640896	DD	On-Demand	Anodyne	NPY5R	28	43
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](c2ccccc2)[C@H](C)O)C1	ZINC000853640916	ED	On-Demand	Anodyne	BIRC2	48	48
COC(=O)N1CCC[C@H](NC(=O)N[C@H](c2ccccc2)[C@H](C)O)C1	ZINC000853640917	ED	On-Demand	Anodyne	BIRC2	48	48
COC(=O)N1CCC[C@H](NC(=O)N[C@H](c2ccccc2)[C@@H](C)O)C1	ZINC000853640918	ED	On-Demand	Anodyne	BIRC2	48	48
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)C1	ZINC000853640919	ED	On-Demand	Anodyne	BIRC2	48	48
Cc1ncoc1CNc1ncnc2ccc(C(C)C)cc12	ZINC000853640954	CH	On-Demand	Anodyne	DYRK1A	19	42
Cc1ncoc1CNc1ncnc2ccc(C(C)C)cc12	ZINC000853640954	CH	On-Demand	Anodyne	CLK1	20	42
Cc1ncoc1CNc1ncnc2ccc(C(C)C)cc12	ZINC000853640954	CH	On-Demand	Anodyne	CLK2	22	40
Cc1ncoc1CNc1ncnc2ccc(C(C)C)cc12	ZINC000853640954	CH	On-Demand	Anodyne	CLK4	73	43
Cc1ncoc1CNc1ncnc2ccc(C(C)C)cc12	ZINC000853640954	CH	On-Demand	Anodyne	DYRK1B	18	42
c1cncc(-c2nc(N3CC(CN4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853640969	FE	On-Demand	Anodyne	PIK3CA	46	51
c1cncc(-c2nc(N3CC(CN4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853640969	FE	On-Demand	Anodyne	PIK3CD	15	45
c1cncc(-c2nc(N3CC(CN4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853640969	FE	On-Demand	Anodyne	MTOR	45	51
c1cncc(-c2nc(N3CC(CN4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853640969	FE	On-Demand	Anodyne	PIK3CG	20	45
CN(CCOC(F)F)S(=O)(=O)c1cccs1	ZINC000853641065	CD	On-Demand	Anodyne	SQLE	18	41
Cc1nc(CNC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)nc2ccccc12	ZINC000853641128	GG	On-Demand	Anodyne	ADAM17	22	43
Cc1nc(CNC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)nc2ccccc12	ZINC000853641131	GG	On-Demand	Anodyne	ADAM17	22	43
Cc1ccccc1C=NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853641137	GG	On-Demand	Mild	CCR8	41	39
Cc1ccccc1C=NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853641137	GG	On-Demand	Mild	WNT3	40	31
COC(=O)N1CCC[C@H](NC(=O)NCC[C@@H](C)N(C)C)C1	ZINC000853641145	DC	On-Demand	Anodyne	CHRNA3	26	46
COC(=O)N1CCC[C@H](NC(=O)NCC[C@@H](C)N(C)C)C1	ZINC000853641145	DC	On-Demand	Anodyne	CHRNA4	20	46
COC(=O)N1CCC[C@H](NC(=O)NCC[C@H](C)N(C)C)C1	ZINC000853641148	DC	On-Demand	Anodyne	CHRNA3	26	46
COC(=O)N1CCC[C@H](NC(=O)NCC[C@H](C)N(C)C)C1	ZINC000853641148	DC	On-Demand	Anodyne	CHRNA4	20	46
CCn1c(=O)c(NCc2ocnc2C)nc2ccccc21	ZINC000853641155	CE	On-Demand	Anodyne	PYGM	25	46
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641170	GE	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641170	GE	On-Demand	Anodyne	PREP	49	38
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641170	GE	On-Demand	Anodyne	EPHX2	15	43
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641170	GE	On-Demand	Anodyne	MCHR1	16	43
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641170	GE	On-Demand	Anodyne	BIRC2	41	44
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641171	GE	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641171	GE	On-Demand	Anodyne	PREP	49	38
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641171	GE	On-Demand	Anodyne	EPHX2	15	43
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641171	GE	On-Demand	Anodyne	MCHR1	16	43
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853641171	GE	On-Demand	Anodyne	BIRC2	41	44
O=C(NCc1cccc(OCC(F)F)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853641183	FG	On-Demand	Anodyne	PDS	93	41
O=C(NCc1cccc(OCC(F)F)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853641184	FG	On-Demand	Anodyne	PDS	93	41
O=C(NCc1cccc(OCC(F)F)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853641185	FG	On-Demand	Anodyne	PDS	93	41
O=C(NCc1cccc(OCC(F)F)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853641186	FG	On-Demand	Anodyne	PDS	93	41
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853641236	EE	On-Demand	Anodyne	EPHX2	36	50
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853641236	EE	On-Demand	Anodyne	BIRC2	31	41
COC(=O)N1CCC[C@H](NC(=O)NC[C@@H](C)c2ccccn2)C1	ZINC000853641308	DD	On-Demand	Anodyne	EPHX2	18	42
COC(=O)N1CCC[C@H](NC(=O)NC[C@@H](C)c2ccccn2)C1	ZINC000853641308	DD	On-Demand	Anodyne	BIRC2	34	44
COC(=O)N1CCC[C@@H](NC(=O)NC[C@H](C)c2ccccn2)C1	ZINC000853641309	DD	On-Demand	Anodyne	EPHX2	18	42
COC(=O)N1CCC[C@@H](NC(=O)NC[C@H](C)c2ccccn2)C1	ZINC000853641309	DD	On-Demand	Anodyne	BIRC2	34	44
COC(=O)N1CCC[C@H](NC(=O)NC[C@H](C)c2ccccn2)C1	ZINC000853641310	DD	On-Demand	Anodyne	EPHX2	18	42
COC(=O)N1CCC[C@H](NC(=O)NC[C@H](C)c2ccccn2)C1	ZINC000853641310	DD	On-Demand	Anodyne	BIRC2	34	44
Cn1c(S)nnc1CCNC(=O)NCc1cccc(OCC(F)F)c1	ZINC000853641319	FD	On-Demand	Anodyne	PDS	79	38
CON(C)CCNC(=O)NCc1cccc(OCC(F)F)c1	ZINC000853641322	DD	On-Demand	Anodyne	HRH2	24	41
CON(C)CCNC(=O)NCc1cccc(OCC(F)F)c1	ZINC000853641322	DD	On-Demand	Anodyne	PDS	99	44
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853641327	GE	On-Demand	Anodyne	SLC6A3	16	42
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853641327	GE	On-Demand	Anodyne	EPHX2	27	48
COC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853641327	GE	On-Demand	Anodyne	BIRC2	22	41
COC(=O)N1CCC[C@H](NC(=O)NC2(c3cccc(OC)c3)CCC2)C1	ZINC000853641330	FF	On-Demand	Anodyne	MTNR1B	18	41
COC(=O)N1CCC[C@H](NC(=O)NC2(c3cccc(OC)c3)CCC2)C1	ZINC000853641330	FF	On-Demand	Anodyne	NPBWR1	44	31
COC(=O)N1CCC[C@H](NC(=O)NC(C)(C)c2cccc(C#N)c2)C1	ZINC000853641343	EE	On-Demand	Mild	LGMN	44	36
COC(=O)N1CCC[C@H](NC(=O)N(Cc2ccccc2)[C@@H]2COC(C)(C)C2)C1	ZINC000853641384	GF	On-Demand	Anodyne	BIRC2	16	40
COC(=O)N1CCC[C@H](NC(=O)N(Cc2ccccc2)[C@H]2COC(C)(C)C2)C1	ZINC000853641385	GF	On-Demand	Anodyne	BIRC2	16	40
CO[C@@H](C)CCNC(=O)NNc1cc(F)ccc1C	ZINC000853641386	CE	On-Demand	Reactive	LEF	50	32
COC(=O)c1cccc(NNC(=O)N[C@@H]2CCCN(C(=O)OC)C2)c1C	ZINC000853641397	FD	On-Demand	Reactive	CCR8	55	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C(F)(F)F)nc3ccccc32)CC1	ZINC000853641412	GF	On-Demand	Anodyne	P2RY12	176	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C(F)(F)F)nc3ccccc32)CC1	ZINC000853641412	GF	On-Demand	Anodyne	PDE6D	42	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C(F)(F)F)nc3ccccc32)CC1	ZINC000853641413	GF	On-Demand	Anodyne	P2RY12	176	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C(F)(F)F)nc3ccccc32)CC1	ZINC000853641413	GF	On-Demand	Anodyne	PDE6D	42	37
COC(=O)N1CCC[C@H](NC(=O)N[C@H](c2ccccc2)[C@@H](O)C(C)C)C1	ZINC000853641458	FE	On-Demand	Anodyne	BIRC2	45	46
COC(=O)N1CCC[C@H](NC(=O)N[C@H](c2ccccc2)[C@H](O)C(C)C)C1	ZINC000853641459	FE	On-Demand	Anodyne	BIRC2	45	46
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](c2ccccc2)[C@@H](O)C(C)C)C1	ZINC000853641460	FE	On-Demand	Anodyne	BIRC2	45	46
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](c2ccccc2)[C@H](O)C(C)C)C1	ZINC000853641461	FE	On-Demand	Anodyne	BIRC2	45	46
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](C(C)C)C2(CO)CCC2)C1	ZINC000853641471	ED	On-Demand	Anodyne	BIRC2	25	42
COC(=O)N1CCC[C@@H](NC(=O)N[C@@H](C(C)C)C2(CO)CCC2)C1	ZINC000853641472	ED	On-Demand	Anodyne	BIRC2	25	42
COC(=O)N1CCC[C@H](NC(=O)N[C@H](C(C)C)C2(CO)CCC2)C1	ZINC000853641473	ED	On-Demand	Anodyne	BIRC2	25	42
COC(=O)N1CCC[C@@H](NC(=O)N[C@H](C(C)C)C2(CO)CCC2)C1	ZINC000853641474	ED	On-Demand	Anodyne	BIRC2	25	42
COC(=O)N1CCC[C@H](NC(=O)N2CC(Cc3ccc(C)cc3)C2)C1	ZINC000853641482	EE	On-Demand	Anodyne	CCR3	41	40
COC(=O)N1CCC[C@H](NC(=O)N2CC(Cc3ccc(C)cc3)C2)C1	ZINC000853641482	EE	On-Demand	Anodyne	BIRC2	33	40
CO[C@@H](C)CCNC(=O)NNc1ccc(C)c(F)c1	ZINC000853641564	CE	On-Demand	Reactive	LEF	60	36
COC(=O)N1CCC[C@H](NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000853641593	GF	On-Demand	Anodyne	CCR1	50	42
COC(=O)N1CCC[C@H](NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)C1	ZINC000853641594	GF	On-Demand	Anodyne	CCR1	50	42
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000853641595	GF	On-Demand	Anodyne	CCR1	50	42
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)C1	ZINC000853641596	GF	On-Demand	Anodyne	CCR1	50	42
COC(=O)N1CCC[C@H](NC(=O)N(C)[C@H](CO)Cc2ccccc2)C1	ZINC000853641600	ED	On-Demand	Anodyne	ACE	48	37
COC(=O)N1CCC[C@H](NC(=O)N(C)[C@H](CO)Cc2ccccc2)C1	ZINC000853641600	ED	On-Demand	Anodyne	BIRC2	33	45
COC(=O)N1CCC[C@H](NC(=O)N(C)[C@H](CO)Cc2ccccc2)C1	ZINC000853641600	ED	On-Demand	Anodyne	BRCA1	44	31
COC(=O)N1CCC[C@H](NC(=O)N(C)[C@@H](CO)Cc2ccccc2)C1	ZINC000853641602	ED	On-Demand	Anodyne	ACE	48	37
COC(=O)N1CCC[C@H](NC(=O)N(C)[C@@H](CO)Cc2ccccc2)C1	ZINC000853641602	ED	On-Demand	Anodyne	BIRC2	33	45
COC(=O)N1CCC[C@H](NC(=O)N(C)[C@@H](CO)Cc2ccccc2)C1	ZINC000853641602	ED	On-Demand	Anodyne	BRCA1	44	31
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1cccc(OCC(F)F)c1	ZINC000853641605	GF	On-Demand	Mild	PDS	85	39
COC(=O)N1CCC[C@H](NC(=O)N[C@H](c2cccs2)C(C)(C)CO)C1	ZINC000853641654	FE	On-Demand	Anodyne	BIRC2	28	40
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](c2cccs2)C(C)(C)CO)C1	ZINC000853641655	FE	On-Demand	Anodyne	BIRC2	28	40
COC(=O)N1CCC[C@@H](NC(=O)N[C@@H](c2cccs2)C(C)(C)CO)C1	ZINC000853641656	FE	On-Demand	Anodyne	BIRC2	28	40
COC(=O)N1CCC[C@@H](NC(=O)N[C@H](c2cccs2)C(C)(C)CO)C1	ZINC000853641657	FE	On-Demand	Anodyne	BIRC2	28	40
COC(=O)N1CCC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853641680	ED	On-Demand	Anodyne	BIRC2	17	43
COC(=O)N1CCC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853641681	ED	On-Demand	Anodyne	BIRC2	17	43
COC(=O)N1CCC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853641682	ED	On-Demand	Anodyne	BIRC2	17	43
COC(=O)N1CCC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853641683	ED	On-Demand	Anodyne	BIRC2	17	43
COC(=O)N1CCC[C@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853641716	GF	On-Demand	Reactive	CSNK1D	36	42
COC(=O)N1CCC[C@@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853641717	GF	On-Demand	Reactive	CSNK1D	36	42
C#CCOCCOc1cccc(NC(=O)OCC)c1	ZINC000853641724	CE	On-Demand	Mild	FAAH	20	41
C#CCOCCOc1cccc(NC(=O)OCC)c1	ZINC000853641724	CE	On-Demand	Mild	EPHX2	16	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)On2nnc3ccccc32)CC1	ZINC000853641737	EC	On-Demand	Anodyne	P2RY12	170	42
CCOC(=O)N1CCN(C(=O)[C@H](C)On2nnc3ccccc32)CC1	ZINC000853641738	EC	On-Demand	Anodyne	P2RY12	170	42
COC[C@@H](NC(=O)N[C@@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641747	FD	On-Demand	Anodyne	MTNR1A	19	43
COC[C@@H](NC(=O)N[C@@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641747	FD	On-Demand	Anodyne	MTNR1B	25	43
COC[C@@H](NC(=O)N[C@@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641747	FD	On-Demand	Anodyne	BIRC2	21	41
COC[C@@H](NC(=O)N[C@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641748	FD	On-Demand	Anodyne	MTNR1A	19	43
COC[C@@H](NC(=O)N[C@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641748	FD	On-Demand	Anodyne	MTNR1B	25	43
COC[C@@H](NC(=O)N[C@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641748	FD	On-Demand	Anodyne	BIRC2	21	41
COC[C@H](NC(=O)N[C@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641749	FD	On-Demand	Anodyne	MTNR1A	19	43
COC[C@H](NC(=O)N[C@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641749	FD	On-Demand	Anodyne	MTNR1B	25	43
COC[C@H](NC(=O)N[C@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641749	FD	On-Demand	Anodyne	BIRC2	21	41
COC[C@H](NC(=O)N[C@@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641750	FD	On-Demand	Anodyne	MTNR1A	19	43
COC[C@H](NC(=O)N[C@@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641750	FD	On-Demand	Anodyne	MTNR1B	25	43
COC[C@H](NC(=O)N[C@@H]1CCCN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853641750	FD	On-Demand	Anodyne	BIRC2	21	41
CO[C@@H](C)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853641753	EG	On-Demand	Reactive	CSNK1D	44	49
CCN(CCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C(C)C	ZINC000853641768	DD	On-Demand	Anodyne	CPT1A	42	38
CCN(CCNC(=O)N1CCCC[C@H]1c1nc[nH]n1)C(C)C	ZINC000853641769	DD	On-Demand	Anodyne	CPT1A	42	38
COC(=O)N1CCC[C@H](NC(=O)N[C@H](c2cccs2)C2(CO)CCC2)C1	ZINC000853641803	GE	On-Demand	Anodyne	BIRC2	33	42
COC(=O)N1CCC[C@@H](NC(=O)N[C@@H](c2cccs2)C2(CO)CCC2)C1	ZINC000853641804	GE	On-Demand	Anodyne	BIRC2	33	42
COC(=O)N1CCC[C@@H](NC(=O)N[C@H](c2cccs2)C2(CO)CCC2)C1	ZINC000853641805	GE	On-Demand	Anodyne	BIRC2	33	42
COC(=O)N1CCC[C@H](NC(=O)N[C@@H](c2cccs2)C2(CO)CCC2)C1	ZINC000853641806	GE	On-Demand	Anodyne	BIRC2	33	42
C#CCCN(CCOC)C(=O)NCc1cccc(OCC(F)F)c1	ZINC000853641812	EF	On-Demand	Mild	PDS	85	39
COC(=O)N1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853641884	GD	On-Demand	Anodyne	CCR3	34	43
COC(=O)N1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853641884	GD	On-Demand	Anodyne	MCHR1	27	48
COC(=O)N1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853641885	GD	On-Demand	Anodyne	CCR3	34	43
COC(=O)N1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853641885	GD	On-Demand	Anodyne	MCHR1	27	48
COC(=O)N1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853641886	GD	On-Demand	Anodyne	CCR3	34	43
COC(=O)N1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853641886	GD	On-Demand	Anodyne	MCHR1	27	48
COC(=O)N1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853641887	GD	On-Demand	Anodyne	CCR3	34	43
COC(=O)N1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853641887	GD	On-Demand	Anodyne	MCHR1	27	48
O=C(NCCc1nnc(S)n1C1CC1)NCc1cccc(OCC(F)F)c1	ZINC000853641891	GF	On-Demand	Anodyne	PDS	59	34
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2Nc1cnc(F)cn1	ZINC000853641969	DF	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2Nc1cnc(F)cn1	ZINC000853641970	DF	On-Demand	Anodyne	GPR119	42	42
COC(=O)Cc1ccnc(NC[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)c1	ZINC000853642002	FF	On-Demand	Anodyne	ITGA4	40	35
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2Nc1nc2ncccc2cc1C#N	ZINC000853642012	GH	On-Demand	Mild	GPR119	26	41
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2Nc1nc2ncccc2cc1C#N	ZINC000853642013	GH	On-Demand	Mild	GPR119	26	41
COC(=O)C1(COc2ccc3c(C(C)C)cc(=O)oc3c2)CC1	ZINC000853642052	DG	On-Demand	Anodyne	MAOA	63	45
COC(=O)C1(COc2ccc3c(C(C)C)cc(=O)oc3c2)CC1	ZINC000853642052	DG	On-Demand	Anodyne	MAOB	53	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccc(Cl)cc2)CC1	ZINC000853642074	FE	On-Demand	Mild	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccc(Cl)cc2)CC1	ZINC000853642075	FE	On-Demand	Mild	P2RY12	41	36
CCN1CC[C@H](Oc2ccc3c(C(C)C)cc(=O)oc3c2)C1=O	ZINC000853642100	DF	On-Demand	Anodyne	MAOB	28	43
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(-c4ccccc4)on3)C2)cc1	ZINC000853642106	GG	On-Demand	Clean	MTNR1A	18	45
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(-c4ccccc4)on3)C2)cc1	ZINC000853642106	GG	On-Demand	Clean	MTNR1B	19	45
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(-c4ccccc4)on3)C2)cc1	ZINC000853642106	GG	On-Demand	Clean	EPHX2	17	42
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(-c4ccccc4)on3)C2)cc1	ZINC000853642106	GG	On-Demand	Clean	PDK1	42	38
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(-c4ccccc4)on3)C2)cc1	ZINC000853642106	GG	On-Demand	Clean	MCHR1	20	42
COc1ccc(N2CCC(NC(=O)N3CC[C@H](O)C(F)(F)C3)CC2)cc1	ZINC000853642144	FE	On-Demand	Clean	EPHX2	30	45
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](O)C(F)(F)C3)CC2)cc1	ZINC000853642146	FE	On-Demand	Clean	EPHX2	30	45
COc1ccc(N2CCC(NC(=O)NC/C=C\CO)CC2)cc1	ZINC000853642162	DD	On-Demand	Clean	MCHR1	17	45
COc1ccc(N2CCC(NC(=O)NC/C=C/CO)CC2)cc1	ZINC000853642163	DD	On-Demand	Clean	MCHR1	17	45
COc1ccc(N2CCC(NC(=O)N3CC(S(C)(=O)=O)C3)CC2)cc1	ZINC000853642164	FD	On-Demand	Clean	MMP13	43	37
COc1ccc(N2CCC(NC(=O)N3CC(S(C)(=O)=O)C3)CC2)cc1	ZINC000853642164	FD	On-Demand	Clean	EPHX2	17	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(C(C)(C)C)ncn2)C1	ZINC000853642165	EG	On-Demand	Anodyne	ADRA1A	17	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000853642171	FE	On-Demand	Bother	ADRA1A	27	43
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000853642171	FE	On-Demand	Bother	ADRA1B	16	42
N#Cc1ccc(O[C@@H]2CCN(c3cc(F)ncn3)C2)nc1	ZINC000853642177	CD	On-Demand	Mild	PDE3A	39	45
N#Cc1ccc(O[C@@H]2CCN(c3cc(F)ncn3)C2)nc1	ZINC000853642177	CD	On-Demand	Mild	DCK	61	46
N#Cc1ccc(O[C@@H]2CCN(c3cc(F)ncn3)C2)nc1	ZINC000853642177	CD	On-Demand	Mild	PDE3B	45	45
N#Cc1ccc(O[C@H]2CCN(c3cc(F)ncn3)C2)nc1	ZINC000853642178	CD	On-Demand	Mild	PDE3A	39	45
N#Cc1ccc(O[C@H]2CCN(c3cc(F)ncn3)C2)nc1	ZINC000853642178	CD	On-Demand	Mild	DCK	61	46
N#Cc1ccc(O[C@H]2CCN(c3cc(F)ncn3)C2)nc1	ZINC000853642178	CD	On-Demand	Mild	PDE3B	45	45
COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](CC#N)C3)CC2)cc1	ZINC000853642181	FF	On-Demand	Mild	CTSK	16	41
COc1ccc(N2CCC(NC(=O)N3CCC[C@H](CC#N)C3)CC2)cc1	ZINC000853642182	FF	On-Demand	Mild	CTSK	16	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(CO)cc(C)n2)C1	ZINC000853642198	EE	On-Demand	Anodyne	ADRA1A	22	41
COc1ccc(N2CCC(NC(=O)NCC[C@H](C)N(C)C)CC2)cc1	ZINC000853642203	EE	On-Demand	Clean	MTNR1A	27	42
COc1ccc(N2CCC(NC(=O)NCC[C@H](C)N(C)C)CC2)cc1	ZINC000853642203	EE	On-Demand	Clean	MTNR1B	23	42
COc1ccc(N2CCC(NC(=O)NCC[C@H](C)N(C)C)CC2)cc1	ZINC000853642203	EE	On-Demand	Clean	MCHR1	19	49
COc1ccc(N2CCC(NC(=O)NCC[C@@H](C)N(C)C)CC2)cc1	ZINC000853642204	EE	On-Demand	Clean	MTNR1A	27	42
COc1ccc(N2CCC(NC(=O)NCC[C@@H](C)N(C)C)CC2)cc1	ZINC000853642204	EE	On-Demand	Clean	MTNR1B	23	42
COc1ccc(N2CCC(NC(=O)NCC[C@@H](C)N(C)C)CC2)cc1	ZINC000853642204	EE	On-Demand	Clean	MCHR1	19	49
COc1ccc(N2CCC(NC(=O)NC[C@]3(O)C[C@H]4C=C[C@H]3C4)CC2)cc1	ZINC000853642212	FE	On-Demand	Clean	EPHX2	33	42
COc1ccc(N2CCC(NC(=O)NC[C@@]3(O)C[C@H]4C=C[C@H]3C4)CC2)cc1	ZINC000853642213	FE	On-Demand	Clean	EPHX2	33	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(N3CCC(C)(O)CC3)ncn2)C1	ZINC000853642215	GE	On-Demand	Anodyne	ADRA1A	19	41
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](O)[C@H]3n3cccn3)CC2)cc1	ZINC000853642219	GD	On-Demand	Clean	EPHX2	15	47
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(F)ncn2)C1	ZINC000853642227	DD	On-Demand	Anodyne	ADRA1A	19	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(F)ncn2)C1	ZINC000853642227	DD	On-Demand	Anodyne	MLYCD	25	40
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2Nc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000853642265	GF	On-Demand	Bother	GPR119	24	40
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2Nc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000853642266	GF	On-Demand	Bother	GPR119	24	40
Cn1nnc2c(N[C@@H]3CC34CCN(C(=O)OC(C)(C)C)CC4)ncnc21	ZINC000853642308	FD	On-Demand	Anodyne	GPR119	33	42
Cn1nnc2c(N[C@H]3CC34CCN(C(=O)OC(C)(C)C)CC4)ncnc21	ZINC000853642309	FD	On-Demand	Anodyne	GPR119	33	42
COCc1n[nH]c(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)n1	ZINC000853642311	FD	On-Demand	Clean	PDK1	44	31
COCc1n[nH]c(CNC(=O)NC2CCN(c3ccc(OC)cc3)CC2)n1	ZINC000853642311	FD	On-Demand	Clean	NPBWR1	42	30
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000853642313	ED	On-Demand	Bother	ADRA1A	27	43
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc(N)c([N+](=O)[O-])n2)C1	ZINC000853642313	ED	On-Demand	Bother	ADRA1B	16	44
COC(=O)Cc1ccnc(N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)OC)c1	ZINC000853642344	CC	On-Demand	Anodyne	TLR7	18	41
O=C(NCC1SCCS1)NC1(c2ccccc2)CC1	ZINC000853642355	CF	On-Demand	Anodyne	EPHX2	17	42
O=C(NC1CCN(c2ccc(OC(F)F)cc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853642356	FE	On-Demand	Clean	EPHX2	44	39
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	INHA	15	42
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	DRTS_LEIMA	16	40
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	GRM4	15	46
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	MTNR1A	39	46
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	MTNR1B	39	46
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	EPHX2	22	42
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	KCNK3	62	35
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	KCNK9	60	35
CC(=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853642357	BE	On-Demand	Anodyne	PDS	74	39
CCOC(=O)c1nccc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)n1	ZINC000853642370	FD	On-Demand	Anodyne	ADRA1A	23	40
CCOC(=O)c1nccc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)n1	ZINC000853642371	FD	On-Demand	Anodyne	ADRA1A	23	40
C#CCOCCOc1cccc(NC(C)=O)c1	ZINC000853642391	BD	On-Demand	Mild	MTNR1A	32	44
C#CCOCCOc1cccc(NC(C)=O)c1	ZINC000853642391	BD	On-Demand	Mild	MTNR1B	32	44
C#CCOCCOc1cccc(NC(C)=O)c1	ZINC000853642391	BD	On-Demand	Mild	EPHX2	19	46
C#CCOCCOc1cccc(NC(C)=O)c1	ZINC000853642391	BD	On-Demand	Mild	KCNK3	44	34
C#CCOCCOc1cccc(NC(C)=O)c1	ZINC000853642391	BD	On-Demand	Mild	KCNK9	48	34
COc1ccc(N2CCC(NC(=O)N(C)[C@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642414	GF	On-Demand	Clean	DRD4	21	43
COc1ccc(N2CCC(NC(=O)N(C)[C@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642414	GF	On-Demand	Clean	SIGMAR1	20	48
COc1ccc(N2CCC(NC(=O)N(C)[C@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642414	GF	On-Demand	Clean	NPY5R	16	42
COc1ccc(N2CCC(NC(=O)N(C)[C@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642414	GF	On-Demand	Clean	MCHR1	19	42
COc1ccc(N2CCC(NC(=O)N(C)[C@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642414	GF	On-Demand	Clean	PSMB8	46	35
COc1ccc(N2CCC(NC(=O)N(C)[C@@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642415	GF	On-Demand	Clean	DRD4	21	43
COc1ccc(N2CCC(NC(=O)N(C)[C@@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642415	GF	On-Demand	Clean	SIGMAR1	20	48
COc1ccc(N2CCC(NC(=O)N(C)[C@@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642415	GF	On-Demand	Clean	NPY5R	16	42
COc1ccc(N2CCC(NC(=O)N(C)[C@@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642415	GF	On-Demand	Clean	MCHR1	19	42
COc1ccc(N2CCC(NC(=O)N(C)[C@@H](CO)Cc3ccccc3)CC2)cc1	ZINC000853642415	GF	On-Demand	Clean	PSMB8	46	35
COc1ccc(N2CCC(NC(=O)NNc3cc(F)cc(Cl)c3)CC2)cc1	ZINC000853642416	GH	On-Demand	Reactive	PDK1	41	35
CC(=O)Nc1cccc(OCCC2SCCS2)c1	ZINC000853642435	CG	On-Demand	Anodyne	MTNR1A	36	44
CC(=O)Nc1cccc(OCCC2SCCS2)c1	ZINC000853642435	CG	On-Demand	Anodyne	MTNR1B	35	44
CC(=O)Nc1cccc(OCCC2SCCS2)c1	ZINC000853642435	CG	On-Demand	Anodyne	EPHX2	29	46
CC(=O)Nc1cccc(OCCC2SCCS2)c1	ZINC000853642435	CG	On-Demand	Anodyne	KCNK3	40	34
CC(=O)Nc1cccc(OCCC2SCCS2)c1	ZINC000853642435	CG	On-Demand	Anodyne	KCNK9	43	34
COC[C@@H](COc1ccc2c(C(C)C)cc(=O)oc2c1)OC	ZINC000853642455	DF	On-Demand	Anodyne	ALDH2	73	34
COC[C@@H](COc1ccc2c(C(C)C)cc(=O)oc2c1)OC	ZINC000853642455	DF	On-Demand	Anodyne	MAOA	62	39
COC[C@@H](COc1ccc2c(C(C)C)cc(=O)oc2c1)OC	ZINC000853642455	DF	On-Demand	Anodyne	MAOB	55	48
O=C(c1ccccc1)N1CC[C@H](CON=Cc2ccc(Cl)cc2)C1	ZINC000853642469	EH	On-Demand	Mild	SMO	33	40
O=C(c1ccccc1)N1CC[C@@H](CON=Cc2ccc(Cl)cc2)C1	ZINC000853642470	EH	On-Demand	Mild	SMO	33	40
COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccccc4)CC3)C2)cc1	ZINC000853642531	FG	On-Demand	Clean	NPY1R	15	41
COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccccc4)CC3)C2)cc1	ZINC000853642531	FG	On-Demand	Clean	NPBWR1	45	32
COc1ccc(N2CCC(NC(=O)N3CCCC[C@@H]3c3nc[nH]n3)CC2)cc1	ZINC000853642546	GF	On-Demand	Clean	CPT1A	82	45
COc1ccc(N2CCC(NC(=O)N3CCCC[C@H]3c3nc[nH]n3)CC2)cc1	ZINC000853642549	GF	On-Demand	Clean	CPT1A	82	45
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2Nc1cc(C#N)cnn1	ZINC000853642557	EF	On-Demand	Mild	GPR119	33	42
N#Cc1ccc(O[C@H]2CCN(c3ncnc(F)c3Br)C2)nc1	ZINC000853642558	FE	On-Demand	Mild	PDE3A	40	46
N#Cc1ccc(O[C@H]2CCN(c3ncnc(F)c3Br)C2)nc1	ZINC000853642558	FE	On-Demand	Mild	DCK	55	44
N#Cc1ccc(O[C@H]2CCN(c3ncnc(F)c3Br)C2)nc1	ZINC000853642558	FE	On-Demand	Mild	PDE3B	47	46
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2Nc1cc(C#N)cnn1	ZINC000853642559	EF	On-Demand	Mild	GPR119	33	42
N#Cc1ccc(O[C@@H]2CCN(c3ncnc(F)c3Br)C2)nc1	ZINC000853642560	FE	On-Demand	Mild	PDE3A	40	46
N#Cc1ccc(O[C@@H]2CCN(c3ncnc(F)c3Br)C2)nc1	ZINC000853642560	FE	On-Demand	Mild	DCK	55	44
N#Cc1ccc(O[C@@H]2CCN(c3ncnc(F)c3Br)C2)nc1	ZINC000853642560	FE	On-Demand	Mild	PDE3B	47	46
COC(=O)c1nccc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)n1	ZINC000853642568	ED	On-Demand	Anodyne	SORD	46	35
COC(=O)c1nccc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)n1	ZINC000853642569	ED	On-Demand	Anodyne	SORD	46	35
CC(=O)Nc1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853642582	DI	On-Demand	Reactive	INHA	15	40
CC(=O)Nc1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853642582	DI	On-Demand	Reactive	DRTS_LEIMA	17	41
CC(=O)Nc1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853642582	DI	On-Demand	Reactive	MTNR1A	28	43
CC(=O)Nc1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853642582	DI	On-Demand	Reactive	MTNR1B	27	43
CC(=O)Nc1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853642582	DI	On-Demand	Reactive	EPHX2	20	41
CC(=O)Nc1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853642582	DI	On-Demand	Reactive	KCNK3	47	33
CC(=O)Nc1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853642582	DI	On-Demand	Reactive	KCNK9	44	33
C#CCCCOc1cccnc1N1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000853642587	EF	On-Demand	Mild	PDE3A	36	40
C#CCCCOc1cccnc1N1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000853642587	EF	On-Demand	Mild	DCK	43	38
C#CCCCOc1cccnc1N1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000853642587	EF	On-Demand	Mild	PDE3B	43	40
C#CCCCOc1cccnc1N1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000853642588	EF	On-Demand	Mild	PDE3A	36	40
C#CCCCOc1cccnc1N1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000853642588	EF	On-Demand	Mild	DCK	43	38
C#CCCCOc1cccnc1N1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000853642588	EF	On-Demand	Mild	PDE3B	43	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncnn2C)C1	ZINC000853642623	CD	On-Demand	Anodyne	ADRA1A	20	45
COc1ccc(N2CCC(NC(=O)NCCCc3nc[nH]n3)CC2)cc1	ZINC000853642627	FD	On-Demand	Clean	EPHX2	20	41
COc1ccc(N2CCC(NC(=O)NCCCc3nc[nH]n3)CC2)cc1	ZINC000853642627	FD	On-Demand	Clean	PDK1	44	31
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2Nc1cc(F)ncn1	ZINC000853642638	DF	On-Demand	Anodyne	GPR119	47	38
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2Nc1cc(F)ncn1	ZINC000853642639	DF	On-Demand	Anodyne	GPR119	47	38
CCCCCOc1ccc(C=NOCc2cccnc2N)cc1OC	ZINC000853642676	EH	On-Demand	Mild	DRTS_PLAFK	33	41
COC(=O)c1nccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)OC)n1	ZINC000853642694	CC	On-Demand	Anodyne	SORD	30	41
N#Cc1ccc(O[C@@H]2CCN(c3cnc(F)cn3)C2)nc1	ZINC000853642708	CD	On-Demand	Mild	DCK	47	41
N#Cc1ccc(O[C@H]2CCN(c3cnc(F)cn3)C2)nc1	ZINC000853642712	CD	On-Demand	Mild	DCK	47	41
CCCc1ccc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)nn1	ZINC000853642716	EF	On-Demand	Anodyne	ADRA1A	20	40
CCCc1ccc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)nn1	ZINC000853642718	EF	On-Demand	Anodyne	ADRA1A	20	40
COc1ccc(N2CCC(NC(=O)N3CCC(C4CCC4)CC3)CC2)cc1	ZINC000853642720	FH	On-Demand	Clean	EPHX2	45	48
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(C#N)ccc2C)C1	ZINC000853642722	DF	On-Demand	Mild	ADRA1A	23	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853642731	DD	On-Demand	Anodyne	ADRA1A	19	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853642731	DD	On-Demand	Anodyne	MLYCD	25	41
COc1ccc(N2CCC(NC(=O)NNc3cc(F)ccc3C)CC2)cc1	ZINC000853642743	FG	On-Demand	Reactive	CCR3	24	41
COc1ccc(N2CCC(NC(=O)NNc3cc(F)ccc3C)CC2)cc1	ZINC000853642743	FG	On-Demand	Reactive	MCHR1	15	44
COc1ccc(N2CCC(NC(=O)NC[C@@H](C)S(N)(=O)=O)CC2)cc1	ZINC000853642758	FC	On-Demand	Clean	EPHX2	26	44
COc1ccc(N2CCC(NC(=O)NC[C@H](C)S(N)(=O)=O)CC2)cc1	ZINC000853642759	FC	On-Demand	Clean	EPHX2	26	44
COc1ccc(N2CCC(NC(=O)NC(C)(C)c3cccc(C#N)c3)CC2)cc1	ZINC000853642767	GH	On-Demand	Mild	IMDH_CRYPV	22	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncnc3c2nnn3C)C1	ZINC000853642770	ED	On-Demand	Anodyne	ADRA1A	22	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642781	FD	On-Demand	Anodyne	P2RY12	141	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642781	FD	On-Demand	Anodyne	TRY2_BOVIN	33	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642781	FD	On-Demand	Anodyne	MTNR1A	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642781	FD	On-Demand	Anodyne	MTNR1B	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642781	FD	On-Demand	Anodyne	ST14	34	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642781	FD	On-Demand	Anodyne	KCNK3	47	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642781	FD	On-Demand	Anodyne	KCNK9	44	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642782	FD	On-Demand	Anodyne	P2RY12	141	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642782	FD	On-Demand	Anodyne	TRY2_BOVIN	33	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642782	FD	On-Demand	Anodyne	MTNR1A	15	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642782	FD	On-Demand	Anodyne	MTNR1B	20	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642782	FD	On-Demand	Anodyne	ST14	34	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642782	FD	On-Demand	Anodyne	KCNK3	47	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(C)=O)c2)CC1	ZINC000853642782	FD	On-Demand	Anodyne	KCNK9	44	33
CC(=O)Nc1cccc(OCCc2cncn2C)c1	ZINC000853642787	CD	On-Demand	Anodyne	DRTS_LEIMA	16	40
CC(=O)Nc1cccc(OCCc2cncn2C)c1	ZINC000853642787	CD	On-Demand	Anodyne	MTNR1A	26	40
CC(=O)Nc1cccc(OCCc2cncn2C)c1	ZINC000853642787	CD	On-Demand	Anodyne	MTNR1B	22	40
CC(=O)Nc1cccc(OCCc2cncn2C)c1	ZINC000853642787	CD	On-Demand	Anodyne	EPHX2	19	41
CC(=O)Nc1cccc(OCCc2cncn2C)c1	ZINC000853642787	CD	On-Demand	Anodyne	KCNK3	45	32
CC(=O)Nc1cccc(OCCc2cncn2C)c1	ZINC000853642787	CD	On-Demand	Anodyne	KCNK9	50	31
CCOc1cc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)nc(C)n1	ZINC000853642794	EF	On-Demand	Anodyne	ADRA1A	23	41
CCOc1cc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)nc(C)n1	ZINC000853642794	EF	On-Demand	Anodyne	ADRA1B	15	41
CCOc1cc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)nc(C)n1	ZINC000853642795	EF	On-Demand	Anodyne	ADRA1A	23	41
CCOc1cc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)nc(C)n1	ZINC000853642795	EF	On-Demand	Anodyne	ADRA1B	15	41
COc1ccc(N2CCC(NC(=O)NCCN(C)CCCN(C)C)CC2)cc1	ZINC000853642797	GD	On-Demand	Clean	SLC6A5	23	40
CC(=O)Nc1cccc(OCc2oc(C)nc2C)c1	ZINC000853642808	CF	On-Demand	Anodyne	MAOB	19	48
CC(=O)Nc1cccc(OCc2oc(C)nc2C)c1	ZINC000853642808	CF	On-Demand	Anodyne	DRTS_LEIMA	18	44
CC(=O)Nc1cccc(OCc2oc(C)nc2C)c1	ZINC000853642808	CF	On-Demand	Anodyne	MTNR1A	28	42
CC(=O)Nc1cccc(OCc2oc(C)nc2C)c1	ZINC000853642808	CF	On-Demand	Anodyne	MTNR1B	29	42
CC(=O)Nc1cccc(OCc2oc(C)nc2C)c1	ZINC000853642808	CF	On-Demand	Anodyne	KCNK3	51	34
CC(=O)Nc1cccc(OCc2oc(C)nc2C)c1	ZINC000853642808	CF	On-Demand	Anodyne	KCNK9	43	33
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1	ZINC000853642815	GH	On-Demand	Bother	ADRA1A	24	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1	ZINC000853642815	GH	On-Demand	Bother	ADRA1B	15	41
COc1ccc(N2CCC(NC(=O)N3CCC[C@H](C)[C@@H]3CCO)CC2)cc1	ZINC000853642817	GF	On-Demand	Clean	PDK1	40	34
COc1ccc(N2CCC(NC(=O)N3CCC[C@H](C)[C@H]3CCO)CC2)cc1	ZINC000853642818	GF	On-Demand	Clean	PDK1	40	34
COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](C)[C@H]3CCO)CC2)cc1	ZINC000853642819	GF	On-Demand	Clean	PDK1	40	34
COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](C)[C@@H]3CCO)CC2)cc1	ZINC000853642820	GF	On-Demand	Clean	PDK1	40	34
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(C(C)=O)ccn2)C1	ZINC000853642823	DF	On-Demand	Anodyne	ADRA1A	17	41
COC(=O)Cc1ccnc(N2CC[C@@](C(=O)OC)(c3ccccc3)C2)c1	ZINC000853642831	FE	On-Demand	Anodyne	ADRA1A	18	41
COC(=O)Cc1ccnc(N2CC[C@](C(=O)OC)(c3ccccc3)C2)c1	ZINC000853642832	FE	On-Demand	Anodyne	ADRA1A	18	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)On2nnc3ccc(Cl)cc32)CC1	ZINC000853642840	GD	On-Demand	Anodyne	P2RY12	84	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)On2nnc3ccc(Cl)cc32)CC1	ZINC000853642840	GD	On-Demand	Anodyne	MC4R	55	37
CCOC(=O)N1CCN(C(=O)[C@H](C)On2nnc3ccc(Cl)cc32)CC1	ZINC000853642841	GD	On-Demand	Anodyne	P2RY12	84	38
CCOC(=O)N1CCN(C(=O)[C@H](C)On2nnc3ccc(Cl)cc32)CC1	ZINC000853642841	GD	On-Demand	Anodyne	MC4R	55	37
CC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853642847	BF	On-Demand	Anodyne	MTNR1A	19	40
CC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853642847	BF	On-Demand	Anodyne	MTNR1B	18	40
CC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853642847	BF	On-Demand	Anodyne	PLA2G4B	41	44
CC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853642847	BF	On-Demand	Anodyne	PDS	66	33
CC(=O)c1cccc(OCCC2SCCS2)c1	ZINC000853642876	CG	On-Demand	Anodyne	PLA2G4B	22	40
COc1ccc(N2CCC(NC(=O)N3CCC(c4ccon4)CC3)CC2)cc1	ZINC000853642882	GG	On-Demand	Clean	SMO	29	40
CC(=O)c1cccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853642917	EF	On-Demand	Anodyne	GPR119	39	41
CC(=O)c1cccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853642919	EF	On-Demand	Anodyne	GPR119	39	41
COc1ccc(N2CCC(NC(=O)NCC3(C#N)CCCCC3)CC2)cc1	ZINC000853642995	FG	On-Demand	Mild	CTSK	24	44
COc1ccc(N2CCC(NC(=O)NCC3(C#N)CCCCC3)CC2)cc1	ZINC000853642995	FG	On-Demand	Mild	EPHX2	25	44
COc1ccc(N2CCC(NC(=O)N[C@H]3CCCC[C@@H]3C#N)CC2)cc1	ZINC000853643008	FG	On-Demand	Mild	EPHX2	19	44
COc1ccc(N2CCC(NC(=O)N[C@@H]3CCCC[C@@H]3C#N)CC2)cc1	ZINC000853643011	FG	On-Demand	Mild	EPHX2	19	44
COc1ccc(N2CCC(NC(=O)N[C@@H]3CCCC[C@H]3C#N)CC2)cc1	ZINC000853643013	FG	On-Demand	Mild	EPHX2	19	44
COc1ccc(N2CCC(NC(=O)N[C@H]3CCCC[C@H]3C#N)CC2)cc1	ZINC000853643018	FG	On-Demand	Mild	EPHX2	19	44
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNc1nc2ncccc2cc1C#N	ZINC000853643041	FG	On-Demand	Mild	ITGA4	40	34
CS(=O)(=O)N1CC[C@@H](CONC(=N)CC(=O)Nc2ccccc2Cl)C1	ZINC000853643045	GD	On-Demand	Anodyne	EPHX2	15	42
CS(=O)(=O)N1CC[C@H](CONC(=N)CC(=O)Nc2ccccc2Cl)C1	ZINC000853643047	GD	On-Demand	Anodyne	EPHX2	15	42
COc1ccc(N2CCC(NC(=O)N3CC4CC3(C)C4)CC2)cc1	ZINC000853643048	EF	On-Demand	Clean	EPHX2	16	42
COC(=O)C1(COc2ccc([N+](=O)[O-])cc2C=O)CC1	ZINC000853643051	CD	On-Demand	Bother	CACNA1D	41	33
COc1ccc(N2CCC(NC(=O)N(C)CC(=O)N3CCCC3)CC2)cc1	ZINC000853643052	FD	On-Demand	Clean	C3AR1	16	41
COc1ccc(N2CCC(NC(=O)N(C)CC(=O)N3CCCC3)CC2)cc1	ZINC000853643052	FD	On-Demand	Clean	EPHX2	19	47
COc1ccc(N2CCC(NC(=O)N(C)CC(=O)N3CCCC3)CC2)cc1	ZINC000853643052	FD	On-Demand	Clean	MCHR1	15	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccccc2S(=O)(=O)N(C)C)C1	ZINC000853643060	GE	On-Demand	Anodyne	ADRA1A	21	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(C)c([N+](=O)[O-])c(C#N)c2)C1	ZINC000853643069	FG	On-Demand	Mild	ADRA1A	26	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(C)c([N+](=O)[O-])c(C#N)c2)C1	ZINC000853643069	FG	On-Demand	Mild	ADRA1B	15	42
COCC1(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853643071	FF	On-Demand	Clean	EPHX2	47	44
COCC1(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853643071	FF	On-Demand	Clean	NPBWR1	52	31
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(Cl)nc3cc(C)nn23)C1	ZINC000853643079	FG	On-Demand	Anodyne	ADRA1A	19	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2ncnc(F)c2Br)C1	ZINC000853643133	GF	On-Demand	Anodyne	ADRA1A	17	40
CC(=O)Nc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853643137	CF	On-Demand	Anodyne	DRTS_LEIMA	25	44
CC(=O)Nc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853643137	CF	On-Demand	Anodyne	MTNR1A	31	41
CC(=O)Nc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853643137	CF	On-Demand	Anodyne	MTNR1B	29	41
CC(=O)Nc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853643137	CF	On-Demand	Anodyne	EPHX2	26	47
CC(=O)Nc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853643137	CF	On-Demand	Anodyne	ICMT	43	35
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@H]2Nc1cnccn1	ZINC000853643173	DF	On-Demand	Anodyne	GPR119	37	50
CC(C)(C)OC(=O)N1CCC2(CC1)C[C@@H]2Nc1cnccn1	ZINC000853643174	DF	On-Demand	Anodyne	GPR119	37	50
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(Cl)cc2)CC1	ZINC000853643183	GH	On-Demand	Mild	DRD4	34	49
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(Cl)cc2)CC1	ZINC000853643183	GH	On-Demand	Mild	SIGMAR1	24	52
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(Cl)cc2)CC1	ZINC000853643183	GH	On-Demand	Mild	CCR1	17	41
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccc(Cl)cc2)CC1	ZINC000853643183	GH	On-Demand	Mild	MCHR1	28	43
CCOC(=O)c1nccc(N2C[C@H]3[C@@H](C2)[C@@H]3C(=O)OC)n1	ZINC000853643204	CC	On-Demand	Anodyne	SORD	26	44
COc1ccc(N2CCC(NC(=O)NNc3ccc(C)c(F)c3)CC2)cc1	ZINC000853643210	FG	On-Demand	Reactive	EPHX2	42	37
COc1ccc(N2CCC(NC(=O)NCC3(O)CCC(C)(C)CC3)CC2)cc1	ZINC000853643224	GG	On-Demand	Clean	EPHX2	38	47
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc(C)nc(C)c2Br)C1	ZINC000853643229	GG	On-Demand	Anodyne	ADRA1A	20	41
COc1ccc(N2CCC(NC(=O)NCC3(O)CCC(C)CC3)CC2)cc1	ZINC000853643236	GF	On-Demand	Clean	EPHX2	25	44
COc1ccc(N2CCC(NC(=O)NCC3(O)CCC(C)CC3)CC2)cc1	ZINC000853643236	GF	On-Demand	Clean	NPBWR1	61	32
COc1ccc(N2CCC(NC(=O)NCC(O)(C3CC3)C3CC3)CC2)cc1	ZINC000853643251	FF	On-Demand	Clean	MTNR1A	15	40
COc1ccc(N2CCC(NC(=O)NCC(O)(C3CC3)C3CC3)CC2)cc1	ZINC000853643251	FF	On-Demand	Clean	EPHX2	38	49
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccnc(O)c2[N+](=O)[O-])C1	ZINC000853643269	EE	On-Demand	Bother	ADRA1A	25	41
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccnc(O)c2[N+](=O)[O-])C1	ZINC000853643269	EE	On-Demand	Bother	ADRA1B	15	42
COc1ccc(N2CCC(NC(=O)N3C[C@@]45CCCC[C@]4(COC5)C3)CC2)cc1	ZINC000853643273	GG	On-Demand	Clean	NPBWR1	53	30
COc1ccc(N2CCC(NC(=O)N3C[C@]45CCCC[C@@]4(COC5)C3)CC2)cc1	ZINC000853643277	GG	On-Demand	Clean	NPBWR1	53	30
COc1ccc(N2CCC(NC(=O)N3C[C@]45CCCC[C@]4(COC5)C3)CC2)cc1	ZINC000853643280	GG	On-Demand	Clean	NPBWR1	53	30
COC(=O)[C@@H]1CCN(C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C[C@@H]1C	ZINC000853643296	GF	On-Demand	Clean	EPHX2	15	43
CO[C@@H](COc1cccc(NC(C)=O)c1)C1CCC1	ZINC000853643328	CF	On-Demand	Anodyne	ADRB1	15	40
CO[C@@H](COc1cccc(NC(C)=O)c1)C1CCC1	ZINC000853643328	CF	On-Demand	Anodyne	MTNR1A	29	43
CO[C@@H](COc1cccc(NC(C)=O)c1)C1CCC1	ZINC000853643328	CF	On-Demand	Anodyne	MTNR1B	32	43
CO[C@@H](COc1cccc(NC(C)=O)c1)C1CCC1	ZINC000853643328	CF	On-Demand	Anodyne	KCNK3	49	36
CO[C@@H](COc1cccc(NC(C)=O)c1)C1CCC1	ZINC000853643328	CF	On-Demand	Anodyne	KCNK9	50	36
CO[C@@H](COc1cccc(NC(C)=O)c1)C1CCC1	ZINC000853643328	CF	On-Demand	Anodyne	PDS	50	35
COc1ccc(N2CCC(NC(=O)NC[C@@]3(OCCO)CCOC3)CC2)cc1	ZINC000853643338	GD	On-Demand	Clean	PDK1	43	30
COc1ccc(N2CCC(NC(=O)NC[C@]3(OCCO)CCOC3)CC2)cc1	ZINC000853643340	GD	On-Demand	Clean	PDK1	43	30
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000853643348	FE	On-Demand	Mild	DRD4	44	33
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000853643349	FE	On-Demand	Mild	DRD4	44	33
C#CCCCOc1cccnc1N1CC[C@](C(=O)OC)(c2ccccc2)C1	ZINC000853643366	FG	On-Demand	Mild	ADRA1D	17	41
C#CCCCOc1cccnc1N1CC[C@](C(=O)OC)(c2ccccc2)C1	ZINC000853643366	FG	On-Demand	Mild	ADRA1A	25	41
C#CCCCOc1cccnc1N1CC[C@](C(=O)OC)(c2ccccc2)C1	ZINC000853643366	FG	On-Demand	Mild	ADRA1B	17	41
C#CCCCOc1cccnc1N1CC[C@@](C(=O)OC)(c2ccccc2)C1	ZINC000853643369	FG	On-Demand	Mild	ADRA1D	17	41
C#CCCCOc1cccnc1N1CC[C@@](C(=O)OC)(c2ccccc2)C1	ZINC000853643369	FG	On-Demand	Mild	ADRA1A	25	41
C#CCCCOc1cccnc1N1CC[C@@](C(=O)OC)(c2ccccc2)C1	ZINC000853643369	FG	On-Demand	Mild	ADRA1B	17	41
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853643372	FE	On-Demand	Anodyne	DPP8	20	45
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853643374	FE	On-Demand	Anodyne	DPP8	20	45
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853643376	FE	On-Demand	Anodyne	DPP8	20	45
O=C(NCC(=O)N1CCc2ccccc2C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853643378	FE	On-Demand	Anodyne	DPP8	20	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-n3cnnn3)cc2)CC1	ZINC000853643380	FC	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-n3cnnn3)cc2)CC1	ZINC000853643380	FC	On-Demand	Anodyne	KCNJ1	49	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-n3cnnn3)cc2)CC1	ZINC000853643382	FC	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-n3cnnn3)cc2)CC1	ZINC000853643382	FC	On-Demand	Anodyne	KCNJ1	49	37
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000853643384	DD	On-Demand	Clean	SIGMAR1	15	46
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000853643384	DD	On-Demand	Clean	EPHX2	58	52
CCN1CC[C@H](N(CC)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643396	FF	On-Demand	Clean	PDK1	40	34
CCN1CC[C@H](N(CC)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643396	FF	On-Demand	Clean	MCHR1	21	40
CCN1CC[C@@H](N(CC)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643398	FF	On-Demand	Clean	PDK1	40	34
CCN1CC[C@@H](N(CC)C(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643398	FF	On-Demand	Clean	MCHR1	21	40
CCNc1nccnc1N1CC[C@](C(=O)OC)(c2ccccc2)C1	ZINC000853643399	EE	On-Demand	Anodyne	ADRA1A	22	40
CCNc1nccnc1N1CC[C@@](C(=O)OC)(c2ccccc2)C1	ZINC000853643400	EE	On-Demand	Anodyne	ADRA1A	22	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc(OCC(F)(F)F)nn2)C1	ZINC000853643402	GF	On-Demand	Anodyne	MLYCD	26	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc(OCC(F)(F)F)nn2)C1	ZINC000853643402	GF	On-Demand	Anodyne	SCD1	30	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2ccc(C)nn2)C1	ZINC000853643408	CE	On-Demand	Anodyne	ADRA1A	21	43
Cc1ccc(OCc2nc3ccccc3n2CCOC(F)F)cc1	ZINC000853643413	EI	On-Demand	Anodyne	HRH1	25	41
Cc1ccc(OCc2nc3ccccc3n2CCOC(F)F)cc1	ZINC000853643413	EI	On-Demand	Anodyne	PDE6D	55	48
Cc1ccc(OCc2nc3ccccc3n2CCOC(F)F)cc1	ZINC000853643413	EI	On-Demand	Anodyne	GRM2	16	40
C/C=C\c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643415	CG	On-Demand	Anodyne	CYP1B1	16	42
C/C=C\c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643415	CG	On-Demand	Anodyne	APP	18	41
C/C=C\c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643415	CG	On-Demand	Anodyne	CYP1A1	18	42
C/C=C\c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643415	CG	On-Demand	Anodyne	TUBB1	47	39
C/C=C/c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643416	CG	On-Demand	Anodyne	CYP1B1	16	42
C/C=C/c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643416	CG	On-Demand	Anodyne	APP	18	41
C/C=C/c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643416	CG	On-Demand	Anodyne	CYP1A1	18	42
C/C=C/c1ccc(OCCOC(F)F)c(OC)c1	ZINC000853643416	CG	On-Demand	Anodyne	TUBB1	47	39
CO[C@@H](COc1cccc(NC(C)=O)c1)[C@@H]1CCOC1	ZINC000853643427	CE	On-Demand	Anodyne	MTNR1B	19	40
CO[C@@H](COc1cccc(NC(C)=O)c1)[C@@H]1CCOC1	ZINC000853643427	CE	On-Demand	Anodyne	KCNK3	40	33
CO[C@@H](COc1cccc(NC(C)=O)c1)[C@H]1CCOC1	ZINC000853643430	CE	On-Demand	Anodyne	MTNR1B	19	40
CO[C@@H](COc1cccc(NC(C)=O)c1)[C@H]1CCOC1	ZINC000853643430	CE	On-Demand	Anodyne	KCNK3	40	33
COc1ccc(N2CCC(NC(=O)NCCN(C)OC)CC2)cc1	ZINC000853643440	ED	On-Demand	Clean	MCHR1	18	48
COc1ccc(N2CCC(NC(=O)N(C)CC3CN(C)C3)CC2)cc1	ZINC000853643456	ED	On-Demand	Clean	MCHR1	21	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643460	FD	On-Demand	Anodyne	DRD4	43	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643460	FD	On-Demand	Anodyne	P2RY12	158	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643460	FD	On-Demand	Anodyne	TRY2_BOVIN	83	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643460	FD	On-Demand	Anodyne	ST14	28	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643462	FD	On-Demand	Anodyne	DRD4	43	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643462	FD	On-Demand	Anodyne	P2RY12	158	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643462	FD	On-Demand	Anodyne	TRY2_BOVIN	83	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)OC)c2)CC1	ZINC000853643462	FD	On-Demand	Anodyne	ST14	28	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(C)sc2[N+](=O)[O-])C1	ZINC000853643478	EG	On-Demand	Bother	ADRA1A	28	42
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(C)sc2[N+](=O)[O-])C1	ZINC000853643478	EG	On-Demand	Bother	ADRA1B	17	45
C#Cc1cccnc1N1CC[C@@](C(=O)OC)(c2ccccc2)C1	ZINC000853643488	DE	On-Demand	Mild	ADRA1A	18	40
C#Cc1cccnc1N1CC[C@](C(=O)OC)(c2ccccc2)C1	ZINC000853643489	DE	On-Demand	Mild	ADRA1A	18	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2c(C#N)cnn2C)C1	ZINC000853643498	DD	On-Demand	Mild	ADRA1A	23	40
COC(=O)[C@@]1(c2ccccc2)CCN(c2nc3ccc(N)cc3s2)C1	ZINC000853643502	FG	On-Demand	Anodyne	MLYCD	28	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643514	FD	On-Demand	Clean	SLC6A3	21	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643514	FD	On-Demand	Clean	MTNR1A	16	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643514	FD	On-Demand	Clean	MTNR1B	15	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643514	FD	On-Demand	Clean	EPHX2	50	48
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000853643514	FD	On-Demand	Clean	MMP1	19	42
CS(=O)(=O)N=S1(=O)CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853643515	EC	On-Demand	Anodyne	AKT2	54	53
CS(=O)(=O)N=S1(=O)CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853643515	EC	On-Demand	Anodyne	AKT3	34	46
CS(=O)(=O)N=S1(=O)CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853643515	EC	On-Demand	Anodyne	JAK3	18	57
CS(=O)(=O)N=S1(=O)CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853643515	EC	On-Demand	Anodyne	ROCK2	15	42
CS(=O)(=O)N=S1(=O)CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853643515	EC	On-Demand	Anodyne	AKT1	22	43
Cn1cncc1CCONC(=N)CC(=O)Nc1ccccc1Cl	ZINC000853643522	EE	On-Demand	Anodyne	EPHB3	55	34
COc1cc(N2CC[C@H](Oc3ccc(C#N)cn3)C2)c([N+](=O)[O-])cc1C	ZINC000853643528	FF	On-Demand	Mild	PDE3A	40	43
COc1cc(N2CC[C@H](Oc3ccc(C#N)cn3)C2)c([N+](=O)[O-])cc1C	ZINC000853643528	FF	On-Demand	Mild	PDE3B	47	43
COc1cc(N2CC[C@@H](Oc3ccc(C#N)cn3)C2)c([N+](=O)[O-])cc1C	ZINC000853643529	FF	On-Demand	Mild	PDE3A	40	43
COc1cc(N2CC[C@@H](Oc3ccc(C#N)cn3)C2)c([N+](=O)[O-])cc1C	ZINC000853643529	FF	On-Demand	Mild	PDE3B	47	43
CC[C@@H](O)CNC(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000853643531	DD	On-Demand	Clean	MTNR1A	20	41
CC[C@@H](O)CNC(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000853643531	DD	On-Demand	Clean	MTNR1B	17	41
CC[C@@H](O)CNC(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000853643531	DD	On-Demand	Clean	EPHX2	40	40
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4NC(=O)CC[C@@H]4C3)CC2)cc1	ZINC000853643560	GD	On-Demand	Clean	EPHX2	17	43
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4NC(=O)CC[C@@H]4C3)CC2)cc1	ZINC000853643562	GD	On-Demand	Clean	EPHX2	17	43
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4NC(=O)CC[C@H]4C3)CC2)cc1	ZINC000853643564	GD	On-Demand	Clean	EPHX2	17	43
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4NC(=O)CC[C@H]4C3)CC2)cc1	ZINC000853643567	GD	On-Demand	Clean	EPHX2	17	43
COc1ccc(N2CCC(NC(=O)N3CCC(c4ccco4)CC3)CC2)cc1	ZINC000853643577	GH	On-Demand	Clean	EPHX2	18	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2ccccc2)CC1	ZINC000853643594	FG	On-Demand	Clean	STAT6	15	43
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(=O)n(C)c(=O)n2C)C1	ZINC000853643596	EC	On-Demand	Anodyne	ADRA1A	24	46
COC(=O)[C@@]1(c2ccccc2)CCN(c2cc(=O)n(C)c(=O)n2C)C1	ZINC000853643596	EC	On-Demand	Anodyne	ADRA1B	17	46
C/C=C\c1ccc(OCCC2SCCS2)c(OC)c1	ZINC000853643600	CI	On-Demand	Anodyne	CYP1A1	16	40
C/C=C/c1ccc(OCCC2SCCS2)c(OC)c1	ZINC000853643601	CI	On-Demand	Anodyne	CYP1A1	16	40
C=CCC1(NC(=O)NC2CCN(c3ccc(OC)cc3)CC2)CCCC1	ZINC000853643609	FH	On-Demand	Mild	EPHX2	24	42
COc1ccc(N2CCC(NC(=O)NC[C@@H]3CC(=O)N(C)C3)CC2)cc1	ZINC000853643611	FD	On-Demand	Clean	EPHX2	16	42
COc1ccc(N2CCC(NC(=O)NC[C@H]3CC(=O)N(C)C3)CC2)cc1	ZINC000853643612	FD	On-Demand	Clean	EPHX2	16	42
C#CCOCCOc1ccc(/C=C/C)cc1OC	ZINC000853643619	BF	On-Demand	Mild	CYP1A1	16	40
C#CCOCCOc1ccc(/C=C\C)cc1OC	ZINC000853643620	BF	On-Demand	Mild	CYP1A1	16	40
COc1ccc(N2CCC(NC(=O)N(CCC3CC3)CC3CC3)CC2)cc1	ZINC000853643621	FH	On-Demand	Clean	MCHR1	18	44
CC(=O)Nc1cccc(OCc2nonc2C)c1	ZINC000853643662	BD	On-Demand	Anodyne	DRTS_LEIMA	18	44
CC(=O)Nc1cccc(OCc2nonc2C)c1	ZINC000853643662	BD	On-Demand	Anodyne	CACNA1D	17	51
CC(=O)Nc1cccc(OCc2nonc2C)c1	ZINC000853643662	BD	On-Demand	Anodyne	MTNR1A	18	42
CC(=O)Nc1cccc(OCc2nonc2C)c1	ZINC000853643662	BD	On-Demand	Anodyne	MTNR1B	20	42
CC(=O)Nc1cccc(OCc2nonc2C)c1	ZINC000853643662	BD	On-Demand	Anodyne	KCNK3	51	35
CC(=O)Nc1cccc(OCc2nonc2C)c1	ZINC000853643662	BD	On-Demand	Anodyne	KCNK9	48	35
COc1ccc(N2CCC(NC(=O)NC[C@@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000853643683	GG	On-Demand	Clean	EPHX2	29	42
COc1ccc(N2CCC(NC(=O)NC[C@H](O)[C@@H](C)c3ccccc3)CC2)cc1	ZINC000853643684	GG	On-Demand	Clean	EPHX2	29	42
COc1ccc(N2CCC(NC(=O)NC[C@@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000853643685	GG	On-Demand	Clean	EPHX2	29	42
COc1ccc(N2CCC(NC(=O)NC[C@H](O)[C@H](C)c3ccccc3)CC2)cc1	ZINC000853643686	GG	On-Demand	Clean	EPHX2	29	42
COCCN(CCF)C(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000853643690	FE	On-Demand	Clean	MCHR1	17	41
COc1ccc(N2CCC(NC(=O)N[C@@H](c3ccccc3)[C@H](C)O)CC2)cc1	ZINC000853643695	GG	On-Demand	Clean	EPHX2	22	43
COc1ccc(N2CCC(NC(=O)N[C@H](c3ccccc3)[C@@H](C)O)CC2)cc1	ZINC000853643696	GG	On-Demand	Clean	EPHX2	22	43
COc1ccc(N2CCC(NC(=O)N[C@@H](c3ccccc3)[C@@H](C)O)CC2)cc1	ZINC000853643697	GG	On-Demand	Clean	EPHX2	22	43
COc1ccc(N2CCC(NC(=O)N[C@H](c3ccccc3)[C@H](C)O)CC2)cc1	ZINC000853643698	GG	On-Demand	Clean	EPHX2	22	43
CC1(CONC(=N)CC(=O)Nc2ccccc2Cl)CCC1	ZINC000853643706	DG	On-Demand	Anodyne	EPHB3	41	32
COc1ccc(N2CCC(NC(=O)NC3(CC(C)C)CC3)CC2)cc1	ZINC000853643716	EH	On-Demand	Clean	EPHX2	43	44
C=CCCC(C)(C)NC(=O)NC1CCN(c2ccc(OC)cc2)CC1	ZINC000853643721	EH	On-Demand	Mild	EPHX2	27	44
COc1ccc(N2CCC(NC(=O)NCC3CCC(O)CC3)CC2)cc1	ZINC000853643727	FF	On-Demand	Clean	MTNR1A	19	40
COc1ccc(N2CCC(NC(=O)NCC3CCC(O)CC3)CC2)cc1	ZINC000853643727	FF	On-Demand	Clean	MTNR1B	17	40
COc1ccc(N2CCC(NC(=O)NCC3CCC(O)CC3)CC2)cc1	ZINC000853643727	FF	On-Demand	Clean	EPHX2	39	47
COc1ccc(N2CCC(NC(=O)NCC3CCC(O)CC3)CC2)cc1	ZINC000853643727	FF	On-Demand	Clean	PDK1	40	36
CC(C)c1ccc2ncnc(N3CCS(=O)(=NS(C)(=O)=O)CC3)c2c1	ZINC000853643745	GE	On-Demand	Anodyne	PDGFRB	26	41
COc1ccc(N2CCC(NC(=O)N3CC(Cc4ccc(C)cc4)C3)CC2)cc1	ZINC000853643747	GH	On-Demand	Clean	CCR3	43	41
COc1ccc(N2CCC(NC(=O)N3CC(Cc4ccc(C)cc4)C3)CC2)cc1	ZINC000853643747	GH	On-Demand	Clean	MCHR1	21	46
COc1ccc(N2CCC(NC(=O)N3C[C@H](C)C(O)[C@@H](C)C3)CC2)cc1	ZINC000853643751	FE	On-Demand	Clean	EPHX2	16	43
COc1ccc(N2CCC(NC(=O)N3C[C@@H](C)C(O)[C@H](C)C3)CC2)cc1	ZINC000853643752	FE	On-Demand	Clean	EPHX2	16	43
COc1ccc(N2CCC(NC(=O)N3C[C@H](C)[C@@H](O)[C@H](C)C3)CC2)cc1	ZINC000853643753	FE	On-Demand	Clean	EPHX2	16	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(C)=O)cc2OC)CC1	ZINC000853643756	GD	On-Demand	Anodyne	P2RY12	54	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2OC)CC1	ZINC000853643757	GD	On-Demand	Anodyne	P2RY12	54	39
CS(=O)(=O)N=S1(=O)CCN(c2ccnc(-c3ccccc3)n2)CC1	ZINC000853643763	FD	On-Demand	Anodyne	SORD	44	34
COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](C4CCC4)C3)CC2)cc1	ZINC000853643768	FH	On-Demand	Clean	EPHX2	17	42
COc1ccc(N2CCC(NC(=O)N3CCC[C@H](C4CCC4)C3)CC2)cc1	ZINC000853643769	FH	On-Demand	Clean	EPHX2	17	42
C#CCOCCOc1ccc(CC(=O)OC)cc1	ZINC000853643770	BD	On-Demand	Mild	LTA4H	23	40
C#CCOCCOc1ccc(CC(=O)OC)cc1	ZINC000853643770	BD	On-Demand	Mild	PLA2G4B	55	39
COc1ccc(N2CCC(NC(=O)NC3CC(CO)C3)CC2)cc1	ZINC000853643776	ED	On-Demand	Clean	SIGMAR1	15	46
COc1ccc(N2CCC(NC(=O)NC3CC(CO)C3)CC2)cc1	ZINC000853643776	ED	On-Demand	Clean	MTNR1A	15	41
COc1ccc(N2CCC(NC(=O)NC3CC(CO)C3)CC2)cc1	ZINC000853643776	ED	On-Demand	Clean	EPHX2	46	48
COc1ccc(N2CCC(NC(=O)N[C@@]3(C)CC3(C)C)CC2)cc1	ZINC000853643781	EG	On-Demand	Clean	EPHX2	45	46
COc1ccc(N2CCC(NC(=O)N[C@]3(C)CC3(C)C)CC2)cc1	ZINC000853643782	EG	On-Demand	Clean	EPHX2	45	46
COc1ccc(N2CCC(NC(=O)N3CCc4cc(OC)ccc4C3)CC2)cc1	ZINC000853643810	GG	On-Demand	Clean	DRD5	15	40
COc1ccc(N2CCC(NC(=O)N3CCc4cc(OC)ccc4C3)CC2)cc1	ZINC000853643810	GG	On-Demand	Clean	MMP13	19	42
COc1ccc(N2CCC(NC(=O)N3CCc4cc(OC)ccc4C3)CC2)cc1	ZINC000853643810	GG	On-Demand	Clean	MTNR1A	15	40
COc1ccc(N2CCC(NC(=O)N3CCc4cc(OC)ccc4C3)CC2)cc1	ZINC000853643810	GG	On-Demand	Clean	MTNR1B	17	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000853643812	GD	On-Demand	Mild	PREP	16	41
COc1ccc(N2CCC(NC(=O)N[C@H]3COc4cc(F)ccc4C3)CC2)cc1	ZINC000853643829	GG	On-Demand	Clean	NPY5R	15	42
COc1ccc(N2CCC(NC(=O)N[C@@H]3COc4cc(F)ccc4C3)CC2)cc1	ZINC000853643830	GG	On-Demand	Clean	NPY5R	15	42
CON(C)CCNC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1	ZINC000853643831	GD	On-Demand	Anodyne	PRTN3	56	35
CON(C)CCNC(=O)NCc1ccccc1NS(=O)(=O)c1ccccc1	ZINC000853643831	GD	On-Demand	Anodyne	LIMK2	32	43
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4COC[C@@H]4C3)CC2)cc1	ZINC000853643833	FE	On-Demand	Clean	EPHX2	26	46
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4COC[C@@H]4C3)CC2)cc1	ZINC000853643834	FE	On-Demand	Clean	EPHX2	26	46
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4COC[C@H]4C3)CC2)cc1	ZINC000853643835	FE	On-Demand	Clean	EPHX2	26	46
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4COC[C@H]4C3)CC2)cc1	ZINC000853643836	FE	On-Demand	Clean	EPHX2	26	46
CC(=O)c1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853643858	CG	On-Demand	Anodyne	PLA2G4B	40	43
CON(C)CCNC(=O)NCC(=O)N1CCc2ccccc2C1	ZINC000853643866	DC	On-Demand	Anodyne	DPP8	20	45
COc1ccc(N2CCC(NC(=O)N3C[C@H]4CC[C@@H](C4)C3)CC2)cc1	ZINC000853643871	EG	On-Demand	Clean	EPHX2	25	43
COc1cc(C)ccc1OC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853643884	EG	On-Demand	Anodyne	GPR119	31	40
COc1cc(C)ccc1OC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853643885	EG	On-Demand	Anodyne	GPR119	31	40
CC(C)n1ncnc1CONC(=N)CC(=O)Nc1ccccc1Cl	ZINC000853643886	FF	On-Demand	Anodyne	EPHB3	42	34
CCCOc1cccc(CONC(=N)CC(=O)Nc2ccccc2Cl)c1	ZINC000853643899	GI	On-Demand	Anodyne	PDS	51	33
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=C(C)c2cc3ccccc3o2)CC1	ZINC000853643902	GF	On-Demand	Mild	P2RY12	112	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=C(C)c2cc3ccccc3o2)CC1	ZINC000853643903	GF	On-Demand	Mild	P2RY12	112	39
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4C[C@H]4C3)CC2)cc1	ZINC000853643907	EF	On-Demand	Clean	EPHX2	36	47
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4C[C@H]4C3)CC2)cc1	ZINC000853643908	EF	On-Demand	Clean	EPHX2	36	47
COc1ccc(N2CCC(NC(=O)N3CC[C@@H]4C[C@@H]4C3)CC2)cc1	ZINC000853643909	EF	On-Demand	Clean	EPHX2	36	47
COc1ccc(N2CCC(NC(=O)N3CC[C@H]4C[C@@H]4C3)CC2)cc1	ZINC000853643910	EF	On-Demand	Clean	EPHX2	36	47
CCn1ncnc1CONC(=N)CC(=O)Nc1ccccc1Cl	ZINC000853643911	ED	On-Demand	Anodyne	EPHB3	46	34
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](Oc4ccccc4)C3)CC2)cc1	ZINC000853643926	GH	On-Demand	Clean	SLC18A3	18	40
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](Oc4ccccc4)C3)CC2)cc1	ZINC000853643926	GH	On-Demand	Clean	EPHX2	48	57
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](Oc4ccccc4)C3)CC2)cc1	ZINC000853643926	GH	On-Demand	Clean	MCHR1	15	49
COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](CCF)C3)CC2)cc1	ZINC000853643931	FG	On-Demand	Clean	CCR3	18	42
COc1ccc(N2CCC(NC(=O)N3CCC[C@@H](CCF)C3)CC2)cc1	ZINC000853643931	FG	On-Demand	Clean	NPBWR1	48	30
COc1ccc(N2CCC(NC(=O)N3CCC[C@H](CCF)C3)CC2)cc1	ZINC000853643932	FG	On-Demand	Clean	CCR3	18	42
COc1ccc(N2CCC(NC(=O)N3CCC[C@H](CCF)C3)CC2)cc1	ZINC000853643932	FG	On-Demand	Clean	NPBWR1	48	30
C/C=C/c1ccc(OCc2oc(C)nc2C)c(OC)c1	ZINC000853643935	CH	On-Demand	Anodyne	CYP1A1	15	40
C/C=C\c1ccc(OCc2oc(C)nc2C)c(OC)c1	ZINC000853643936	CH	On-Demand	Anodyne	CYP1A1	15	40
CS(=O)(=O)N=S1(=O)CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000853643940	FC	On-Demand	Anodyne	CXCR3	19	41
COc1ccc(N2CCC(NC(=O)N3CC[C@@H](C)O[C@@H](C)C3)CC2)cc1	ZINC000853643941	FF	On-Demand	Clean	EPHX2	19	43
COc1ccc(N2CCC(NC(=O)N3CCC(O)(CO)CC3)CC2)cc1	ZINC000853643949	FD	On-Demand	Clean	EPHX2	20	43
CCN1CC[C@H](ONC(=N)CC(=O)Nc2ccccc2Cl)C1=O	ZINC000853643962	ED	On-Demand	Anodyne	KCNQ2	48	41
CCN1CC[C@H](ONC(=N)CC(=O)Nc2ccccc2Cl)C1=O	ZINC000853643962	ED	On-Demand	Anodyne	EPHB3	45	31
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@@H](O)c4ccccc43)CC2)cc1	ZINC000853643973	GG	On-Demand	Clean	SIGMAR1	15	46
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@@H](O)c4ccccc43)CC2)cc1	ZINC000853643973	GG	On-Demand	Clean	EPHX2	29	48
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)CC2)cc1	ZINC000853643974	GG	On-Demand	Clean	SIGMAR1	15	46
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)CC2)cc1	ZINC000853643974	GG	On-Demand	Clean	EPHX2	29	48
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](O)c4ccccc43)CC2)cc1	ZINC000853643975	GG	On-Demand	Clean	SIGMAR1	15	46
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](O)c4ccccc43)CC2)cc1	ZINC000853643975	GG	On-Demand	Clean	EPHX2	29	48
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)c4ccccc43)CC2)cc1	ZINC000853643976	GG	On-Demand	Clean	SIGMAR1	15	46
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)c4ccccc43)CC2)cc1	ZINC000853643976	GG	On-Demand	Clean	EPHX2	29	48
COc1ccc(N2CCC(NC(=O)NCC3(O)CCC(F)(F)CC3)CC2)cc1	ZINC000853643979	GF	On-Demand	Clean	EPHX2	39	46
C#CCOCCOc1cccc(C(C)=O)c1	ZINC000853644022	BD	On-Demand	Mild	MAOB	15	48
C#CCOCCOc1cccc(C(C)=O)c1	ZINC000853644022	BD	On-Demand	Mild	PLA2G4B	27	42
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](O)C34CCC4)CC2)cc1	ZINC000853644024	FE	On-Demand	Clean	EPHX2	34	44
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](O)C34CCC4)CC2)cc1	ZINC000853644024	FE	On-Demand	Clean	NPBWR1	52	29
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@@H](O)C34CCC4)CC2)cc1	ZINC000853644025	FE	On-Demand	Clean	EPHX2	34	44
COc1ccc(N2CCC(NC(=O)N[C@@H]3C[C@@H](O)C34CCC4)CC2)cc1	ZINC000853644025	FE	On-Demand	Clean	NPBWR1	52	29
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)C34CCC4)CC2)cc1	ZINC000853644026	FE	On-Demand	Clean	EPHX2	34	44
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)C34CCC4)CC2)cc1	ZINC000853644026	FE	On-Demand	Clean	NPBWR1	52	29
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@@H](O)C34CCC4)CC2)cc1	ZINC000853644027	FE	On-Demand	Clean	EPHX2	34	44
COc1ccc(N2CCC(NC(=O)N[C@H]3C[C@@H](O)C34CCC4)CC2)cc1	ZINC000853644027	FE	On-Demand	Clean	NPBWR1	52	29
Cc1ccc2c(c1)[C@H](Nc1cc(F)ncn1)CCC2	ZINC000853644046	CG	On-Demand	Anodyne	KCNN3	19	49
CC(=O)c1ccnc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644056	GH	On-Demand	Anodyne	SLC12A5	59	33
CC(=O)c1ccnc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644057	GH	On-Demand	Anodyne	SLC12A5	59	33
CC(=O)c1ccnc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644058	GH	On-Demand	Anodyne	SLC12A5	59	33
CC(=O)c1ccnc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644059	GH	On-Demand	Anodyne	SLC12A5	59	33
O=C(CON=Cc1ccccc1F)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853644064	GF	On-Demand	Mild	EPHX2	20	42
O=C(CON=Cc1ccccc1F)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853644064	GF	On-Demand	Mild	SFRP1	40	34
O=C(CON=Cc1ccccc1F)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853644064	GF	On-Demand	Mild	WNT3	40	34
CON(C)CCNC(=O)NCCc1cccc(O)c1	ZINC000853644095	CC	On-Demand	Anodyne	MTNR1A	48	40
CON(C)CCNC(=O)NCCc1cccc(O)c1	ZINC000853644095	CC	On-Demand	Anodyne	HSD17B2	27	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(OC)ccc2C(=O)OC)CC1	ZINC000853644117	GD	On-Demand	Anodyne	P2RY12	70	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(OC)ccc2C(=O)OC)CC1	ZINC000853644117	GD	On-Demand	Anodyne	MTNR1B	39	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(OC)ccc2C(=O)OC)CC1	ZINC000853644118	GD	On-Demand	Anodyne	P2RY12	70	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(OC)ccc2C(=O)OC)CC1	ZINC000853644118	GD	On-Demand	Anodyne	MTNR1B	39	40
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	CHRM2	18	42
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	CHRM1	18	42
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	DRD2	20	47
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	DRD4	46	48
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	ACHE	36	42
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	KCNH2	15	44
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	CHRM3	26	42
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	SIGMAR1	48	57
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	SSTR5	51	36
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	CCR3	37	44
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	MCHR1	49	46
C[C@@H](ON=Cc1ccccc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644131	GG	On-Demand	Mild	CACNA1G	37	43
Cn1ncc(C#N)c1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644136	GF	On-Demand	Mild	CTSK	22	46
Cn1ncc(C#N)c1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644136	GF	On-Demand	Mild	CTSL	25	46
Cn1ncc(C#N)c1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644137	GF	On-Demand	Mild	CTSK	22	46
Cn1ncc(C#N)c1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644137	GF	On-Demand	Mild	CTSL	25	46
Cn1ncc(C#N)c1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644138	GF	On-Demand	Mild	CTSK	22	46
Cn1ncc(C#N)c1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644138	GF	On-Demand	Mild	CTSL	25	46
Cn1ncc(C#N)c1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644139	GF	On-Demand	Mild	CTSK	22	46
Cn1ncc(C#N)c1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644139	GF	On-Demand	Mild	CTSL	25	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1cccc(O)c1	ZINC000853644141	GF	On-Demand	Anodyne	GPR119	26	40
C#Cc1cccnc1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644157	GH	On-Demand	Mild	CTSK	16	42
C#Cc1cccnc1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644157	GH	On-Demand	Mild	CTSL	22	42
C#Cc1cccnc1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644158	GH	On-Demand	Mild	CTSK	16	42
C#Cc1cccnc1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644158	GH	On-Demand	Mild	CTSL	22	42
C#Cc1cccnc1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644159	GH	On-Demand	Mild	CTSK	16	42
C#Cc1cccnc1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644159	GH	On-Demand	Mild	CTSL	22	42
C#Cc1cccnc1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644160	GH	On-Demand	Mild	CTSK	16	42
C#Cc1cccnc1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644160	GH	On-Demand	Mild	CTSL	22	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2cccc(F)c2)CC1	ZINC000853644188	FD	On-Demand	Mild	P2RY12	53	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2cccc(F)c2)CC1	ZINC000853644189	FD	On-Demand	Mild	P2RY12	53	38
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccccc2F)CC1	ZINC000853644190	GG	On-Demand	Mild	DRD4	16	49
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccccc2F)CC1	ZINC000853644190	GG	On-Demand	Mild	SIGMAR1	19	50
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccccc2F)CC1	ZINC000853644190	GG	On-Demand	Mild	CCR3	20	41
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2ccccc2F)CC1	ZINC000853644190	GG	On-Demand	Mild	CCR2	15	46
Cc1ccc2cccc(OCCOC(F)F)c2n1	ZINC000853644193	CG	On-Demand	Anodyne	BDKRB2	51	34
Cn1ncnc1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644203	FE	On-Demand	Anodyne	CTSB	17	41
Cn1ncnc1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644203	FE	On-Demand	Anodyne	CTSK	23	41
Cn1ncnc1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644203	FE	On-Demand	Anodyne	CTSL	28	41
Cn1ncnc1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644203	FE	On-Demand	Anodyne	SLC12A5	44	32
Cn1ncnc1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644204	FE	On-Demand	Anodyne	CTSB	17	41
Cn1ncnc1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644204	FE	On-Demand	Anodyne	CTSK	23	41
Cn1ncnc1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644204	FE	On-Demand	Anodyne	CTSL	28	41
Cn1ncnc1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644204	FE	On-Demand	Anodyne	SLC12A5	44	32
Cn1ncnc1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644205	FE	On-Demand	Anodyne	CTSB	17	41
Cn1ncnc1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644205	FE	On-Demand	Anodyne	CTSK	23	41
Cn1ncnc1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644205	FE	On-Demand	Anodyne	CTSL	28	41
Cn1ncnc1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644205	FE	On-Demand	Anodyne	SLC12A5	44	32
Cn1ncnc1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644206	FE	On-Demand	Anodyne	CTSB	17	41
Cn1ncnc1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644206	FE	On-Demand	Anodyne	CTSK	23	41
Cn1ncnc1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644206	FE	On-Demand	Anodyne	CTSL	28	41
Cn1ncnc1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644206	FE	On-Demand	Anodyne	SLC12A5	44	32
CCOC(=O)c1nccc(N2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644209	GE	On-Demand	Anodyne	GPR119	18	46
CCOC(=O)c1nccc(N2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644210	GE	On-Demand	Anodyne	GPR119	18	46
CCOC(=O)c1nccc(N2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644211	GE	On-Demand	Anodyne	GPR119	18	46
CCOC(=O)c1nccc(N2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644212	GE	On-Demand	Anodyne	GPR119	18	46
CCNc1nccnc1N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644254	GG	On-Demand	Anodyne	GRIN2B	20	40
CCNc1nccnc1N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644255	GG	On-Demand	Anodyne	GRIN2B	20	40
CCNc1nccnc1N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644256	GG	On-Demand	Anodyne	GRIN2B	20	40
CCNc1nccnc1N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853644257	GG	On-Demand	Anodyne	GRIN2B	20	40
COC(=O)c1nccc(N2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644269	FE	On-Demand	Anodyne	GPR119	16	48
COC(=O)c1nccc(N2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644270	FE	On-Demand	Anodyne	GPR119	16	48
COC(=O)c1nccc(N2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644271	FE	On-Demand	Anodyne	GPR119	16	48
COC(=O)c1nccc(N2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)n1	ZINC000853644272	FE	On-Demand	Anodyne	GPR119	16	48
CC(C)(C)OC(=O)N1CCO[C@H](CON=Cc2cccc(F)c2)C1	ZINC000853644294	EF	On-Demand	Mild	GPR119	19	41
CC(C)(C)OC(=O)N1CCO[C@@H](CON=Cc2cccc(F)c2)C1	ZINC000853644295	EF	On-Demand	Mild	GPR119	19	41
CC(C)(C)OC(=O)N1CC[C@H]2CN(c3cc(C#N)cnn3)CC[C@@H]21	ZINC000853644306	EE	On-Demand	Mild	GPR119	19	44
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3cc(C#N)cnn3)CC[C@@H]21	ZINC000853644307	EE	On-Demand	Mild	GPR119	19	44
CC(C)(C)OC(=O)N1CC[C@H]2CN(c3cc(C#N)cnn3)CC[C@H]21	ZINC000853644308	EE	On-Demand	Mild	GPR119	19	44
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3cc(C#N)cnn3)CC[C@H]21	ZINC000853644309	EE	On-Demand	Mild	GPR119	19	44
CCCOc1ccccc1O[C@@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853644313	FF	On-Demand	Anodyne	P2RY12	195	41
CCCOc1ccccc1O[C@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853644314	FF	On-Demand	Anodyne	P2RY12	195	41
Cc1ccc2cccc(OCc3oc(C)nc3C)c2n1	ZINC000853644342	CH	On-Demand	Anodyne	BDKRB2	79	39
C#CCOCCOc1cccc2ccc(C)nc12	ZINC000853644347	BF	On-Demand	Mild	BDKRB2	41	36
CCOc1cc(N2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)nc(C)n1	ZINC000853644354	FG	On-Demand	Anodyne	GPR119	18	48
CCOc1cc(N2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)nc(C)n1	ZINC000853644355	FG	On-Demand	Anodyne	GPR119	18	48
CCOc1cc(N2CC[C@@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)nc(C)n1	ZINC000853644356	FG	On-Demand	Anodyne	GPR119	18	48
CCOc1cc(N2CC[C@@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)nc(C)n1	ZINC000853644357	FG	On-Demand	Anodyne	GPR119	18	48
Cn1cncc1CCN1C(=O)N[C@@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000853644381	ED	On-Demand	Anodyne	DYRK2	59	34
Cn1cncc1CCN1C(=O)N[C@](C)(c2ccc3c(c2)OCO3)C1=O	ZINC000853644382	ED	On-Demand	Anodyne	DYRK2	59	34
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	CHRM2	17	45
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	CHRM1	17	45
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	DRD2	25	45
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	DRD4	50	49
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	ACHE	37	44
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	DRD3	16	44
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	KCNH2	17	48
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	HTR4	15	44
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	CHRM3	29	45
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	SIGMAR1	47	58
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	SSTR5	54	37
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	CCR3	65	48
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	MLNR	43	39
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	BACE1	21	40
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	MCHR1	51	48
C[C@@H](ON=Cc1cccc(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853644420	GG	On-Demand	Mild	CACNA1G	42	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccccc2F)CC1	ZINC000853644450	FD	On-Demand	Mild	P2RY12	61	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccccc2F)CC1	ZINC000853644451	FD	On-Demand	Mild	P2RY12	61	39
COC(=O)c1ccc(OC)cc1OCCCCC1(C)OCCO1	ZINC000853644460	DF	On-Demand	Anodyne	MTNR1A	45	38
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2cccc(F)c2)CC1	ZINC000853644464	GG	On-Demand	Mild	DRD4	21	49
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2cccc(F)c2)CC1	ZINC000853644464	GG	On-Demand	Mild	SIGMAR1	19	52
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2cccc(F)c2)CC1	ZINC000853644464	GG	On-Demand	Mild	CCR3	42	45
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2cccc(F)c2)CC1	ZINC000853644464	GG	On-Demand	Mild	CCR2	17	46
Cc1ccccc1CN1CCC(NC(=O)CON=Cc2cccc(F)c2)CC1	ZINC000853644464	GG	On-Demand	Mild	MCHR1	29	40
Cc1ccc(N2CC[C@H]3[C@@H](CCN3C(=O)OC(C)(C)C)C2)nn1	ZINC000853644466	DF	On-Demand	Anodyne	GPR119	18	46
Cc1ccc(N2CC[C@H]3[C@H](CCN3C(=O)OC(C)(C)C)C2)nn1	ZINC000853644467	DF	On-Demand	Anodyne	GPR119	18	46
COCCN(CCF)C(=O)NCCc1cccc(O)c1	ZINC000853644472	CD	On-Demand	Anodyne	CRTM	40	33
C#CCOCCOc1cc(OC)ccc1C(=O)OC	ZINC000853644521	CD	On-Demand	Mild	MTNR1A	42	36
N#Cc1cnnc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644579	GF	On-Demand	Mild	CTSK	20	46
N#Cc1cnnc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644579	GF	On-Demand	Mild	CTSL	27	46
N#Cc1cnnc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644580	GF	On-Demand	Mild	CTSK	20	46
N#Cc1cnnc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644580	GF	On-Demand	Mild	CTSL	27	46
N#Cc1cnnc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644581	GF	On-Demand	Mild	CTSK	20	46
N#Cc1cnnc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644581	GF	On-Demand	Mild	CTSL	27	46
N#Cc1cnnc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644582	GF	On-Demand	Mild	CTSK	20	46
N#Cc1cnnc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)c1	ZINC000853644582	GF	On-Demand	Mild	CTSL	27	46
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3cc(C)c(C)cc32)CC1	ZINC000853644609	FF	On-Demand	Anodyne	P2RY12	57	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3cc(C)c(C)cc32)CC1	ZINC000853644610	FF	On-Demand	Anodyne	P2RY12	57	36
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(-n3cnnn3)c2)C1	ZINC000853644614	FD	On-Demand	Anodyne	GPR119	33	49
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(-n3cnnn3)c2)C1	ZINC000853644615	FD	On-Demand	Anodyne	GPR119	33	49
O=C(CON=Cc1cccc(F)c1)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853644643	GF	On-Demand	Mild	EPHX2	21	41
O=C(N[C@@H]1C[C@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644645	FG	On-Demand	Anodyne	CTSK	16	42
O=C(N[C@@H]1C[C@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644645	FG	On-Demand	Anodyne	CTSL	22	42
O=C(N[C@@H]1C[C@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644645	FG	On-Demand	Anodyne	SLC12A5	41	31
O=C(N[C@H]1C[C@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644647	FG	On-Demand	Anodyne	CTSK	16	42
O=C(N[C@H]1C[C@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644647	FG	On-Demand	Anodyne	CTSL	22	42
O=C(N[C@H]1C[C@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644647	FG	On-Demand	Anodyne	SLC12A5	41	31
O=C(N[C@H]1C[C@@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644648	FG	On-Demand	Anodyne	CTSK	16	42
O=C(N[C@H]1C[C@@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644648	FG	On-Demand	Anodyne	CTSL	22	42
O=C(N[C@H]1C[C@@H]1C1CCN(c2cc(F)ncn2)CC1)OCc1ccccc1	ZINC000853644648	FG	On-Demand	Anodyne	SLC12A5	41	31
COC(=O)c1ccc(OC)cc1OCCOC(F)F	ZINC000853644656	CE	On-Demand	Anodyne	MTNR1A	49	37
COC(=O)c1ccc(OC)cc1OCCOC(F)F	ZINC000853644656	CE	On-Demand	Anodyne	AKR1C2	40	36
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3ccnc(O)c3[N+](=O)[O-])CC[C@@H]21	ZINC000853644658	FF	On-Demand	Bother	GPR119	15	46
CC(C)(C)OC(=O)N1CC[C@H]2CN(c3ccnc(O)c3[N+](=O)[O-])CC[C@H]21	ZINC000853644659	FF	On-Demand	Bother	GPR119	15	46
CC(C)(C)OC(=O)N1CC[C@H]2CN(c3ccnc(O)c3[N+](=O)[O-])CC[C@@H]21	ZINC000853644660	FF	On-Demand	Bother	GPR119	15	46
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3ccnc(O)c3[N+](=O)[O-])CC[C@H]21	ZINC000853644661	FF	On-Demand	Bother	GPR119	15	46
Cc1ccc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644662	FG	On-Demand	Anodyne	CTSB	21	43
Cc1ccc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644662	FG	On-Demand	Anodyne	CTSK	26	43
Cc1ccc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644662	FG	On-Demand	Anodyne	CTSL	34	43
Cc1ccc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644662	FG	On-Demand	Anodyne	SCD1	46	37
Cc1ccc(N2CCC([C@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644662	FG	On-Demand	Anodyne	SLC12A5	58	34
Cc1ccc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644663	FG	On-Demand	Anodyne	CTSB	21	43
Cc1ccc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644663	FG	On-Demand	Anodyne	CTSK	26	43
Cc1ccc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644663	FG	On-Demand	Anodyne	CTSL	34	43
Cc1ccc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644663	FG	On-Demand	Anodyne	SCD1	46	37
Cc1ccc(N2CCC([C@@H]3C[C@@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644663	FG	On-Demand	Anodyne	SLC12A5	58	34
Cc1ccc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644664	FG	On-Demand	Anodyne	CTSB	21	43
Cc1ccc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644664	FG	On-Demand	Anodyne	CTSK	26	43
Cc1ccc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644664	FG	On-Demand	Anodyne	CTSL	34	43
Cc1ccc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644664	FG	On-Demand	Anodyne	SCD1	46	37
Cc1ccc(N2CCC([C@@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644664	FG	On-Demand	Anodyne	SLC12A5	58	34
Cc1ccc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644665	FG	On-Demand	Anodyne	CTSB	21	43
Cc1ccc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644665	FG	On-Demand	Anodyne	CTSK	26	43
Cc1ccc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644665	FG	On-Demand	Anodyne	CTSL	34	43
Cc1ccc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644665	FG	On-Demand	Anodyne	SCD1	46	37
Cc1ccc(N2CCC([C@H]3C[C@H]3NC(=O)OCc3ccccc3)CC2)nn1	ZINC000853644665	FG	On-Demand	Anodyne	SLC12A5	58	34
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2ccc(C)cc2)CC1	ZINC000853644700	EE	On-Demand	Mild	P2RY12	47	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2ccc(C)cc2)CC1	ZINC000853644701	EE	On-Demand	Mild	P2RY12	47	37
COC(=O)c1ccc(OC)cc1OCc1oc(C)nc1C	ZINC000853644715	CF	On-Demand	Anodyne	MTNR1A	43	35
COC(=O)c1ccc(OC)cc1OCc1oc(C)nc1C	ZINC000853644715	CF	On-Demand	Anodyne	LUCI_LUCLA	16	41
Cc1ccc2c(c1)[C@H](Nc1cnc(F)cn1)CCC2	ZINC000853644735	CG	On-Demand	Anodyne	KCNN3	19	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3cnnn3)c2)CC1	ZINC000853644737	FC	On-Demand	Anodyne	P2RY12	120	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3cnnn3)c2)CC1	ZINC000853644737	FC	On-Demand	Anodyne	KCNJ1	50	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3cnnn3)c2)CC1	ZINC000853644738	FC	On-Demand	Anodyne	P2RY12	120	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3cnnn3)c2)CC1	ZINC000853644738	FC	On-Demand	Anodyne	KCNJ1	50	36
COC(=O)c1ccc(OC)cc1OCCC1SCCS1	ZINC000853644770	DG	On-Demand	Anodyne	MTNR1A	49	40
COC(=O)c1ccc(OC)cc1OCc1nonc1C	ZINC000853644794	CD	On-Demand	Anodyne	CACNA1D	21	48
O=C(N[C@@H]1C[C@H]1C1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853644795	FG	On-Demand	Anodyne	CTSK	18	41
O=C(N[C@@H]1C[C@H]1C1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853644795	FG	On-Demand	Anodyne	CTSL	23	41
O=C(N[C@H]1C[C@H]1C1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853644797	FG	On-Demand	Anodyne	CTSK	18	41
O=C(N[C@H]1C[C@H]1C1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853644797	FG	On-Demand	Anodyne	CTSL	23	41
O=C(N[C@H]1C[C@@H]1C1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853644798	FG	On-Demand	Anodyne	CTSK	18	41
O=C(N[C@H]1C[C@@H]1C1CCN(c2cnc(F)cn2)CC1)OCc1ccccc1	ZINC000853644798	FG	On-Demand	Anodyne	CTSL	23	41
COc1cccc(C(N)=O)c1OCc1nonc1C	ZINC000853644826	CD	On-Demand	Anodyne	CACNA1D	15	45
C=C(Cl)COc1ccc(NC(=O)CCC)cc1C(C)=O	ZINC000853644834	CH	On-Demand	Mild	ENPP1	60	31
C=CCc1ccc(OCc2oc(C)nc2C)c(OC)c1	ZINC000853644855	CH	On-Demand	Mild	DRTS_PLAFK	22	40
C#CCOCCN1C(=O)S/C(=C/c2ccc(OC(F)F)c(OC)c2)C1=O	ZINC000853644956	GF	On-Demand	Mild	ESRRA	41	34
C#CCOCCN1C(=O)S/C(=C/c2ccc(OC(F)F)c(OC)c2)C1=O	ZINC000853644956	GF	On-Demand	Mild	ENPP2	30	43
C#CCOCCN1C(=O)S/C(=C\c2ccc(OC(F)F)c(OC)c2)C1=O	ZINC000853644957	GF	On-Demand	Mild	ESRRA	41	34
C#CCOCCN1C(=O)S/C(=C\c2ccc(OC(F)F)c(OC)c2)C1=O	ZINC000853644957	GF	On-Demand	Mild	ENPP2	30	43
COC[C@@H](COc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1)OC	ZINC000853644975	FH	On-Demand	Anodyne	ALDH2	81	36
COC[C@@H](COc1ccc2c(=O)c(-c3ccccc3)c(C)oc2c1)OC	ZINC000853644975	FH	On-Demand	Anodyne	MAOB	49	42
O=C(NCc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853645085	FI	On-Demand	Anodyne	DRD4	43	33
O=C(NCc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853645085	FI	On-Demand	Anodyne	HRH2	26	42
O=C(NCc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853645085	FI	On-Demand	Anodyne	GRIN2B	22	52
O=C(NCc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853645085	FI	On-Demand	Anodyne	PDS	71	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2C(N)=O)CC1	ZINC000853645139	GD	On-Demand	Anodyne	P2RY12	40	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2C(N)=O)CC1	ZINC000853645139	GD	On-Demand	Anodyne	MC4R	40	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2C(N)=O)CC1	ZINC000853645140	GD	On-Demand	Anodyne	P2RY12	40	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2C(N)=O)CC1	ZINC000853645140	GD	On-Demand	Anodyne	MC4R	40	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)cc2OCC)CC1	ZINC000853645153	GE	On-Demand	Mild	P2RY12	43	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)cc2OCC)CC1	ZINC000853645154	GE	On-Demand	Mild	P2RY12	43	36
CCOc1cc(N2CCc3c(nnn3-c3ccccc3)C2)nc(C)n1	ZINC000853645155	EE	On-Demand	Anodyne	CACNA2D2	40	31
Fc1cc(N2CC[C@@H](Sc3cccc(Cl)c3)C2)ncn1	ZINC000853645192	DH	On-Demand	Anodyne	DCK	28	41
Fc1cc(N2CC[C@H](Sc3cccc(Cl)c3)C2)ncn1	ZINC000853645193	DH	On-Demand	Anodyne	DCK	28	41
COC(=O)C1(COc2ccc3c(=O)c(-c4ccccc4)c(C)oc3c2)CC1	ZINC000853645214	FI	On-Demand	Anodyne	ALDH2	67	32
COC(=O)C1(COc2ccc3c(=O)c(-c4ccccc4)c(C)oc3c2)CC1	ZINC000853645214	FI	On-Demand	Anodyne	MAOB	47	38
Cc1ccc(OCc2nc3ccccc3n2CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853645242	JI	On-Demand	Anodyne	PIK3CA	44	42
Cc1ccc(OCc2nc3ccccc3n2CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853645242	JI	On-Demand	Anodyne	ADAM17	44	37
Cc1ccc(OCc2nc3ccccc3n2CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853645242	JI	On-Demand	Anodyne	MTOR	75	42
Cc1ccc(OCc2nc3ccccc3n2CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853645242	JI	On-Demand	Anodyne	MCHR1	20	40
Cc1ccc(OCc2nc3ccccc3n2CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853645242	JI	On-Demand	Anodyne	STAT6	53	34
Cc1ccc(OCc2nc3ccccc3n2CC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853645242	JI	On-Demand	Anodyne	IMDH_CRYPV	43	46
CCC[C@H](NC(=O)NCCN(C)OC)c1cccc(C(F)(F)F)c1	ZINC000853645258	EG	On-Demand	Anodyne	PDS	41	36
CCOC(=O)[C@@H](F)C1CN(c2nc3ncccc3cc2C#N)C1	ZINC000853645411	DD	On-Demand	Mild	P2RY12	32	42
N=C(COc1ccccc1)NOCc1cc(C2CC2)no1	ZINC000853645415	CF	On-Demand	Anodyne	CPT1A	102	37
COc1cc(N(C)CCOc2ccc(S(N)(=O)=O)cc2)c([N+](=O)[O-])cc1C	ZINC000853645419	GE	On-Demand	Bother	CA7	24	42
CCN1CC[C@H](ONC(=N)COc2ccccc2)C1=O	ZINC000853645426	CD	On-Demand	Anodyne	CPT1A	61	35
N=C(COc1ccccc1)NOCCC1CCC1	ZINC000853645429	BF	On-Demand	Anodyne	GRIN2B	15	41
CC(C)(C)OC(=O)N1CCC2(CCN(c3cc(CO)c(F)cn3)CC2)C1	ZINC000853645441	FF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CC2(C1)CN(c1cnc(F)cn1)CCO2	ZINC000853645443	DD	On-Demand	Anodyne	GPR119	18	40
C#Cc1cccnc1N1CCC2(CCN(Cc3ccccc3)CC2)C1	ZINC000853645446	EH	On-Demand	Mild	SIGMAR1	34	42
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853645469	FG	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853645470	FG	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853645471	FG	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853645472	FG	On-Demand	Anodyne	GPR119	39	47
CCCc1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853645487	FH	On-Demand	Anodyne	GPR119	21	42
COC(=O)c1nccc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853645492	GE	On-Demand	Anodyne	GPR119	16	45
COC(=O)Cc1ccnc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853645498	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC2(CCN(c3cc(F)ncn3)CC2)C1	ZINC000853645523	EF	On-Demand	Anodyne	GPR119	30	47
CC(CO)(CO)CNc1nc(-c2cccnc2)nc2ccccc12	ZINC000853645545	DE	On-Demand	Anodyne	PKN2	24	48
CC(CO)(CO)CNc1nc(-c2cccnc2)nc2ccccc12	ZINC000853645545	DE	On-Demand	Anodyne	PKN1	20	48
CC(C)(C)OC(=O)N1CCC2(CCN(c3nccc4c(N)cccc34)CC2)C1	ZINC000853645564	GI	On-Demand	Anodyne	GPR119	17	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(-c3cccs3)n2)CC1	ZINC000853645600	FD	On-Demand	Anodyne	P2RY12	50	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(-c3cccs3)n2)CC1	ZINC000853645601	FD	On-Demand	Anodyne	P2RY12	50	37
CCOC(=O)[C@@H](F)C1CN(c2cc(-c3ccccc3)nc3ccnn23)C1	ZINC000853645619	FF	On-Demand	Anodyne	P2RY12	136	37
O=c1c2ccccc2c(-c2ccc(F)c(F)c2)nn1CCC1SCCS1	ZINC000853645625	GJ	On-Demand	Anodyne	HRH1	20	40
COC(=O)Cc1ccnc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)c1	ZINC000853645643	GF	On-Demand	Anodyne	GPR119	49	53
C#Cc1cccnc1NCc1cccc(N2CCOCC2)c1	ZINC000853645661	CF	On-Demand	Mild	EPHB4	63	36
C#Cc1cccnc1NCc1cccc(N2CCOCC2)c1	ZINC000853645661	CF	On-Demand	Mild	STAT6	65	42
Fc1cnc(NCc2cccc(N3CCOCC3)c2)cn1	ZINC000853645679	CE	On-Demand	Anodyne	MAPK10	18	44
Fc1cnc(NCc2cccc(N3CCOCC3)c2)cn1	ZINC000853645679	CE	On-Demand	Anodyne	STAT6	64	44
C#CCCN(CCOC)C(=O)NC[C@@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000853645693	GE	On-Demand	Mild	CASR	43	37
C#CCCN(CCOC)C(=O)NC[C@H](c1cccc(Cl)c1)N1CCOCC1	ZINC000853645695	GE	On-Demand	Mild	CASR	43	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2nnc3ccccn23)CC1	ZINC000853645700	EC	On-Demand	Anodyne	P2RY12	127	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2nnc3ccccn23)CC1	ZINC000853645702	EC	On-Demand	Anodyne	P2RY12	127	39
NC(=NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(F)cc1	ZINC000853645733	EF	On-Demand	Mild	SLC18A3	24	47
NC(=NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(F)cc1	ZINC000853645733	EF	On-Demand	Mild	SLC9A1	24	40
NC(=NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(F)cc1	ZINC000853645733	EF	On-Demand	Mild	L3MBTL3	46	34
NC(=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(F)cc1	ZINC000853645734	EF	On-Demand	Mild	SLC18A3	24	47
NC(=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(F)cc1	ZINC000853645734	EF	On-Demand	Mild	SLC9A1	24	40
NC(=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(F)cc1	ZINC000853645734	EF	On-Demand	Mild	L3MBTL3	46	34
C#Cc1cccnc1N1CCC2(CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853645750	EG	On-Demand	Mild	GPR119	18	42
COC[C@@H](CON=Cc1cc(OC)ccc1OC)OC	ZINC000853645753	CD	On-Demand	Mild	CYP1B1	28	43
COC[C@@H](CON=Cc1cc(OC)ccc1OC)OC	ZINC000853645753	CD	On-Demand	Mild	CYP1A1	36	42
C#Cc1cccnc1NCC(=O)NCCN1CCCCCC1	ZINC000853645810	DD	On-Demand	Mild	HNMT	73	38
Cn1ncc(C#N)c1N1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CC1	ZINC000853645834	EE	On-Demand	Mild	GPR119	43	50
Cc1ccc(N2CCC[C@@H]([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)nn1	ZINC000853645855	FH	On-Demand	Anodyne	GPR119	39	46
Cc1ccc(N2CCC[C@@H]([C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)nn1	ZINC000853645859	FH	On-Demand	Anodyne	GPR119	39	46
O=C(CNc1cnc(F)cn1)NCCN1CCCCCC1	ZINC000853645878	CD	On-Demand	Anodyne	HNMT	51	33
O=C(CNc1cc(F)ncn1)NCCN1CCCCCC1	ZINC000853645891	CD	On-Demand	Anodyne	HNMT	52	33
Fc1ncnc(NCc2cccc(N3CCOCC3)c2)c1Br	ZINC000853645895	FF	On-Demand	Anodyne	STAT6	71	44
C#CCCCOc1cccnc1NCc1cccc(N2CCOCC2)c1	ZINC000853645903	FG	On-Demand	Mild	EPHB4	58	35
C#CCCCOc1cccnc1NCc1cccc(N2CCOCC2)c1	ZINC000853645903	FG	On-Demand	Mild	STAT6	51	38
COCCN(CCF)C(=O)NCC1(c2ccc(Cl)cc2)CCC1	ZINC000853645909	EG	On-Demand	Anodyne	KCNA3	40	34
Cn1nnc2c(N3CC[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]4CC3)ncnc21	ZINC000853645918	FD	On-Demand	Anodyne	SIRT3	51	40
Cn1nnc2c(N3CC[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]4CC3)ncnc21	ZINC000853645918	FD	On-Demand	Anodyne	SIRT2	41	40
Cn1nnc2c(N3CC[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]4CC3)ncnc21	ZINC000853645918	FD	On-Demand	Anodyne	SIRT1	33	40
Cn1nnc2c(N3CC[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]4CC3)ncnc21	ZINC000853645918	FD	On-Demand	Anodyne	GPR119	41	49
CCOC(=O)[C@@H](F)C1CN(c2ccnc(C(=O)OC)n2)C1	ZINC000853645921	CC	On-Demand	Anodyne	SORD	41	42
COC(=O)c1nccc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)n1	ZINC000853645973	GE	On-Demand	Anodyne	GPR119	47	58
CON(C)CCNC(=O)NCCc1c(C)[nH]c2ccccc12	ZINC000853646010	DD	On-Demand	Anodyne	MTNR1A	32	46
CON(C)CCNC(=O)NCCc1c(C)[nH]c2ccccc12	ZINC000853646010	DD	On-Demand	Anodyne	MTNR1B	26	46
C#CCCN(CCOC)C(=O)NCCc1c(C)[nH]c2ccccc12	ZINC000853646018	EF	On-Demand	Mild	GNRHR	20	40
Fc1cc(NCc2cccc(N3CCOCC3)c2)ncn1	ZINC000853646020	CE	On-Demand	Anodyne	MAPK10	15	41
Fc1cc(NCc2cccc(N3CCOCC3)c2)ncn1	ZINC000853646020	CE	On-Demand	Anodyne	STAT6	57	42
CCOC(=O)c1nccc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853646031	GF	On-Demand	Anodyne	GPR119	19	43
CC(=O)c1ccnc(N2CCC[C@@H]([C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c1	ZINC000853646035	GI	On-Demand	Anodyne	GPR119	42	47
CC(=O)c1ccnc(N2CCC[C@H]([C@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c1	ZINC000853646036	GI	On-Demand	Anodyne	GPR119	42	47
CC(=O)c1ccnc(N2CCC[C@H]([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c1	ZINC000853646037	GI	On-Demand	Anodyne	GPR119	42	47
CC(=O)c1ccnc(N2CCC[C@@H]([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)c1	ZINC000853646038	GI	On-Demand	Anodyne	GPR119	42	47
COc1cc(N(C)Cc2ccccc2S(N)(=O)=O)c([N+](=O)[O-])cc1C	ZINC000853646062	FE	On-Demand	Bother	COLA	80	35
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853646076	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853646077	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853646078	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853646079	FG	On-Demand	Anodyne	GPR119	45	49
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853646080	FG	On-Demand	Mild	GPR119	28	47
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853646081	FG	On-Demand	Mild	GPR119	28	47
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853646082	FG	On-Demand	Mild	GPR119	28	47
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853646083	FG	On-Demand	Mild	GPR119	28	47
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCN(c3cc(CO)c(F)cn3)C2)C1	ZINC000853646086	GH	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCN(c3cc(CO)c(F)cn3)C2)C1	ZINC000853646087	GH	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCN(c3cc(CO)c(F)cn3)C2)C1	ZINC000853646088	GH	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCN(c3cc(CO)c(F)cn3)C2)C1	ZINC000853646089	GH	On-Demand	Anodyne	GPR119	43	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)COc2ccccc2)CC1	ZINC000853646093	GD	On-Demand	Anodyne	P2RY12	195	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)COc2ccccc2)CC1	ZINC000853646094	GD	On-Demand	Anodyne	P2RY12	195	44
CC(CO)(CO)CNc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000853646111	CD	On-Demand	Bother	CSNK1D	40	41
COC(=O)C1(CONC(=N)c2ccccc2OC)CC1	ZINC000853646118	CD	On-Demand	Anodyne	KCNA3	52	44
C=C(Cl)CON=Cc1cc(OC)ccc1OC	ZINC000853646153	CF	On-Demand	Mild	CYP1B1	27	43
C=C(Cl)CON=Cc1cc(OC)ccc1OC	ZINC000853646153	CF	On-Demand	Mild	CYP1A1	36	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2OC)CC1	ZINC000853646161	GD	On-Demand	Anodyne	P2RY12	160	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2OC)CC1	ZINC000853646161	GD	On-Demand	Anodyne	KCNA3	46	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2OC)CC1	ZINC000853646161	GD	On-Demand	Anodyne	HCN1	55	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2OC)CC1	ZINC000853646162	GD	On-Demand	Anodyne	P2RY12	160	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2OC)CC1	ZINC000853646162	GD	On-Demand	Anodyne	KCNA3	46	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2OC)CC1	ZINC000853646162	GD	On-Demand	Anodyne	HCN1	55	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=C(N)c2ccc(Cl)cc2)CC1	ZINC000853646168	GD	On-Demand	Mild	MC4R	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=C(N)c2ccc(Cl)cc2)CC1	ZINC000853646169	GD	On-Demand	Mild	MC4R	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2cc(OC)ccc2OC)CC1	ZINC000853646177	GD	On-Demand	Mild	P2RY12	40	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2cc(OC)ccc2OC)CC1	ZINC000853646178	GD	On-Demand	Mild	P2RY12	40	38
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	DRD4	24	55
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	SIGMAR1	24	50
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	SSTR5	42	39
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	CCR3	50	46
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	CCR2	15	45
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	MCHR1	34	45
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	CACNA1G	30	41
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccc(F)cc2)CC1	ZINC000853646199	GF	On-Demand	Mild	CCR8	15	41
Fc1cc(N2CC[C@@H](c3cccc(Cl)c3)C2)ncn1	ZINC000853646206	CG	On-Demand	Anodyne	DCK	33	42
Fc1cc(N2CC[C@H](c3cccc(Cl)c3)C2)ncn1	ZINC000853646207	CG	On-Demand	Anodyne	DCK	33	42
N#Cc1ncc(Br)cc1NCC(=O)NCCN1CCCCCC1	ZINC000853646209	GE	On-Demand	Mild	HNMT	42	32
COc1cc(N2CCC(CO)(c3ccccc3)CC2)c([N+](=O)[O-])cc1C	ZINC000853646212	FG	On-Demand	Bother	HTR1A	30	42
COc1cc(N2CCC(CO)(c3ccccc3)CC2)c([N+](=O)[O-])cc1C	ZINC000853646212	FG	On-Demand	Bother	ADRA1A	34	40
C#CCCCOc1cccnc1N(C)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853646216	GE	On-Demand	Mild	CA7	23	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646226	GD	On-Demand	Anodyne	P2RY12	163	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646226	GD	On-Demand	Anodyne	TRY2_BOVIN	44	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646226	GD	On-Demand	Anodyne	ST14	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646226	GD	On-Demand	Anodyne	SCARB1	15	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646227	GD	On-Demand	Anodyne	P2RY12	163	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646227	GD	On-Demand	Anodyne	TRY2_BOVIN	44	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646227	GD	On-Demand	Anodyne	ST14	19	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(-c3cccc(OC)c3)n2)CC1	ZINC000853646227	GD	On-Demand	Anodyne	SCARB1	15	44
NC(=NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000853646245	FG	On-Demand	Mild	SMO	38	42
NC(=NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000853646245	FG	On-Demand	Mild	L3MBTL3	46	34
NC(=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000853646246	FG	On-Demand	Mild	SMO	38	42
NC(=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccc(Cl)cc1	ZINC000853646246	FG	On-Demand	Mild	L3MBTL3	46	34
Cn1ncc(C#N)c1N1CCC[C@@H]([C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853646264	FG	On-Demand	Mild	GPR119	26	41
Cn1ncc(C#N)c1N1CCC[C@H]([C@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853646265	FG	On-Demand	Mild	GPR119	26	41
Cn1ncc(C#N)c1N1CCC[C@@H]([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853646266	FG	On-Demand	Mild	GPR119	26	41
Cn1ncc(C#N)c1N1CCC[C@H]([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853646267	FG	On-Demand	Mild	GPR119	26	41
Fc1cnc(N2CCC3(CCN(Cc4ccccc4)CC3)C2)cn1	ZINC000853646272	EG	On-Demand	Anodyne	SIGMAR1	49	44
O=S1(=O)N=C(Cl)c2ccc(NCc3cccc(N4CCOCC4)c3)cc21	ZINC000853646273	GF	On-Demand	Anodyne	STAT6	50	42
CCNc1nccnc1N1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CC1	ZINC000853646289	FF	On-Demand	Anodyne	GPR119	46	54
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	CHRM2	17	45
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	CHRM1	17	41
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	DRD2	17	45
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	DRD4	40	45
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	ACHE	35	44
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	KCNH2	15	41
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	CHRM3	24	41
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	SIGMAR1	42	53
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	SSTR5	44	34
C[C@@H](ON=C(N)c1cccs1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646299	GF	On-Demand	Mild	MCHR1	39	45
CCOc1cc(N2CCOC3(CN(C(=O)OC(C)(C)C)C3)C2)nc(C)n1	ZINC000853646310	FE	On-Demand	Anodyne	GPR119	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnn(-c3ccccc3)c2=O)CC1	ZINC000853646313	FC	On-Demand	Anodyne	P2RY12	177	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnn(-c3ccccc3)c2=O)CC1	ZINC000853646313	FC	On-Demand	Anodyne	SLC5A1	15	43
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnn(-c3ccccc3)c2=O)CC1	ZINC000853646315	FC	On-Demand	Anodyne	P2RY12	177	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnn(-c3ccccc3)c2=O)CC1	ZINC000853646315	FC	On-Demand	Anodyne	SLC5A1	15	43
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)COc2ccccc2)C1	ZINC000853646318	FE	On-Demand	Anodyne	CPT1A	52	33
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)COc2ccccc2)C1	ZINC000853646325	FE	On-Demand	Anodyne	CPT1A	52	33
CON(C)CCNC(=O)NCc1ccccc1-c1ccc(Cl)cc1	ZINC000853646361	EG	On-Demand	Anodyne	UTS2	43	33
Cc1cc(CO)cc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853646377	FG	On-Demand	Anodyne	GPR119	15	44
O=C(NCC1(c2ccc(Cl)cc2)CCC1)N1CCC(N2CCOC2=O)CC1	ZINC000853646390	GG	On-Demand	Anodyne	SMO	15	41
C#CCOCCON=Cc1cc(OC)ccc1OC	ZINC000853646392	CD	On-Demand	Mild	CYP1B1	24	41
C#CCOCCON=Cc1cc(OC)ccc1OC	ZINC000853646392	CD	On-Demand	Mild	CYP1A1	35	41
CCOC(=O)c1nccc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)n1	ZINC000853646414	GF	On-Demand	Anodyne	GPR119	55	56
C#CCCCOc1cccnc1NCC(=O)NCCN1CCCCCC1	ZINC000853646437	FE	On-Demand	Mild	ADRA1D	19	41
C#CCCCOc1cccnc1NCC(=O)NCCN1CCCCCC1	ZINC000853646437	FE	On-Demand	Mild	ADRA1A	15	41
C#CCCCOc1cccnc1NCC(=O)NCCN1CCCCCC1	ZINC000853646437	FE	On-Demand	Mild	HNMT	86	35
Cc1cc(CO)cc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)n1	ZINC000853646441	FF	On-Demand	Anodyne	GPR119	40	57
CC(C)(C)OC(=O)N1CCC2(CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853646492	EF	On-Demand	Mild	GPR119	18	41
Cc1ccc(N2CCC3(CCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853646514	EG	On-Demand	Anodyne	GPR119	21	43
N#Cc1ncc(Br)cc1NCc1cccc(N2CCOCC2)c1	ZINC000853646548	FG	On-Demand	Mild	STAT6	52	39
CON(C)CCNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000853646555	GD	On-Demand	Anodyne	ROCK1	18	44
CON(C)CCNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000853646555	GD	On-Demand	Anodyne	ROCK2	40	53
CON(C)CCNC(=O)NCc1cccc(NC(=O)NCc2ccncc2)c1	ZINC000853646555	GD	On-Demand	Anodyne	NAMPT	44	39
CCOC(=O)[C@@H](F)C1CN(c2ncnc3ccc(C(C)C)cc23)C1	ZINC000853646557	EG	On-Demand	Anodyne	PDE3A	40	38
CCOC(=O)[C@@H](F)C1CN(c2ncnc3ccc(C(C)C)cc23)C1	ZINC000853646557	EG	On-Demand	Anodyne	PDGFRB	46	41
CCOC(=O)[C@@H](F)C1CN(c2ncnc3ccc(C(C)C)cc23)C1	ZINC000853646557	EG	On-Demand	Anodyne	PDE3B	44	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccsc2)CC1	ZINC000853646571	FD	On-Demand	Anodyne	P2RY12	42	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccsc2)CC1	ZINC000853646573	FD	On-Demand	Anodyne	P2RY12	42	43
CCNc1nccnc1N1CCC2(CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853646575	FG	On-Demand	Anodyne	GPR119	25	40
O=C(CNc1ccc2c(c1)S(=O)(=O)N=C2Cl)NCCN1CCCCCC1	ZINC000853646587	GD	On-Demand	Anodyne	HNMT	50	35
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	CHRM2	19	47
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	CHRM1	20	47
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	DRD2	23	49
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	DRD4	48	49
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	ACHE	39	45
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	KCNH2	17	45
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	CHRM3	26	47
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	LTA4H	19	40
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	SIGMAR1	52	58
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	SSTR5	55	36
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	CCR3	22	40
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	SLC6A5	23	42
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	MCHR1	50	48
C[C@@H](ONC(=N)c1ccsc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646591	GF	On-Demand	Anodyne	CCR8	20	42
O=C(CNc1ncnc(F)c1Br)NCCN1CCCCCC1	ZINC000853646622	FD	On-Demand	Anodyne	HNMT	44	32
C[C@@H](CF)Nc1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853646623	CE	On-Demand	Anodyne	ABCC8	49	38
CON(C)CCNC(=O)NCC1(c2ccc(Cl)cc2)CCC1	ZINC000853646630	EF	On-Demand	Anodyne	KCNA3	40	34
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2cccs2)CC1	ZINC000853646645	GE	On-Demand	Mild	DRD4	16	50
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2cccs2)CC1	ZINC000853646645	GE	On-Demand	Mild	SIGMAR1	16	47
C#Cc1cccnc1N1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CC1	ZINC000853646672	EG	On-Demand	Mild	GPR119	47	56
CC(=O)c1ccnc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3CC2)c1	ZINC000853646695	FG	On-Demand	Anodyne	GPR119	51	58
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	CHRM2	22	41
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	CHRM1	21	41
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	DRD2	32	52
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	DRD4	49	52
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	ACHE	42	48
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	HTR2A	18	48
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	DRD3	15	46
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	SLC6A3	28	43
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	KCNH2	22	49
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	CHRM3	33	41
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	LTA4H	22	41
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	SIGMAR1	57	57
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	SSTR5	59	45
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	CCR3	71	48
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	SLC18A3	16	41
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	MLNR	48	36
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	SLC6A5	28	44
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	BACE1	24	45
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	MCHR1	58	49
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	CACNA1G	44	49
C[C@@H](ON=C(N)c1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853646717	GF	On-Demand	Mild	CCR8	19	44
CC(CO)(CO)CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000853646733	CC	On-Demand	Bother	COLA	50	32
CCN1CC[C@H](ONC(=N)c2ccccc2OC)C1=O	ZINC000853646744	CD	On-Demand	Anodyne	KCNA3	42	37
CCOC(=O)c1nccc(N2CC([C@@H](F)C(=O)OCC)C2)n1	ZINC000853646750	DC	On-Demand	Anodyne	SORD	58	44
CCOC(=O)c1nccc(N2CC([C@H](F)C(=O)OCC)C2)n1	ZINC000853646751	DC	On-Demand	Anodyne	SORD	58	44
COC[C@@H](CONC(=N)c1cccc(C(F)(F)F)c1)OC	ZINC000853646802	DE	On-Demand	Anodyne	PDS	41	36
CO[C@@H](CONC(=N)c1cccc(C(F)(F)F)c1)C1CCC1	ZINC000853646852	DG	On-Demand	Anodyne	CCR2	52	41
Fc1ncnc(NCCCCCN2CCCC2)c1Br	ZINC000853646870	EG	On-Demand	Anodyne	HNMT	75	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(=O)OC)ccc2=O)CC1	ZINC000853646878	FC	On-Demand	Anodyne	P2RY12	77	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(=O)OC)ccc2=O)CC1	ZINC000853646879	FC	On-Demand	Anodyne	P2RY12	77	42
CC(C)n1ncnc1CON=CC(=O)Nc1ccccc1Cl	ZINC000853646894	DF	On-Demand	Mild	EPHB3	46	34
Fc1cnc(NCCCCCN2CCCC2)cn1	ZINC000853646916	CE	On-Demand	Anodyne	CHRNA7	16	45
Fc1cnc(NCCCCCN2CCCC2)cn1	ZINC000853646916	CE	On-Demand	Anodyne	HNMT	81	44
c1ccc(Nc2nc(N3CCC4(CC3)OCCCO4)nc3[nH]cnc23)cc1	ZINC000853646917	FF	On-Demand	Anodyne	TTK	24	41
CC(C)n1ncnc1CONC(=N)c1cccc(C(F)(F)F)c1	ZINC000853646930	EF	On-Demand	Anodyne	PDS	40	33
CCOC(=O)c1nccc(N2CCC3(CC2)OCCCO3)n1	ZINC000853646942	DD	On-Demand	Anodyne	SORD	52	37
c1ccc2c(c1)nc(N1CCC3(CC1)OCCCO3)c1cccn12	ZINC000853646978	DG	On-Demand	Anodyne	HTR3A	28	48
N=C(NOCc1cc(C2CC2)no1)c1cccc(C(F)(F)F)c1	ZINC000853646979	EH	On-Demand	Anodyne	CCR2	45	38
COC(=O)C1(CONC(=N)c2cccc(C(F)(F)F)c2)CC1	ZINC000853647041	DF	On-Demand	Anodyne	CCR2	72	39
Fc1cc(NCCCCCN2CCCC2)ncn1	ZINC000853647068	CE	On-Demand	Anodyne	HNMT	84	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)n(C)c3ccccc32)CC1	ZINC000853647097	FD	On-Demand	Anodyne	P2RY12	161	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)n(C)c3ccccc32)CC1	ZINC000853647098	FD	On-Demand	Anodyne	P2RY12	161	39
O=S1(=O)N=C(Cl)c2ccc(NCCCCCN3CCCC3)cc21	ZINC000853647157	FG	On-Demand	Anodyne	HRP1_PLAFA	43	33
O=S1(=O)N=C(Cl)c2ccc(NCCCCCN3CCCC3)cc21	ZINC000853647157	FG	On-Demand	Anodyne	CHRNA7	23	41
O=S1(=O)N=C(Cl)c2ccc(NCCCCCN3CCCC3)cc21	ZINC000853647157	FG	On-Demand	Anodyne	HNMT	79	44
COc1cccc(Nc2nc(N3CCC4(CC3)OCCCO4)nc3[nH]cnc23)c1	ZINC000853647207	GF	On-Demand	Anodyne	PDPK1	15	44
COc1cccc(Nc2nc(N3CCC4(CC3)OCCCO4)nc3[nH]cnc23)c1	ZINC000853647207	GF	On-Demand	Anodyne	GALR2	35	45
CS(=O)(=O)N1CC[C@@H](CON=CC(=O)Nc2ccccc2Cl)C1	ZINC000853647270	FD	On-Demand	Mild	EPHX2	15	44
CS(=O)(=O)N1CC[C@H](CON=CC(=O)Nc2ccccc2Cl)C1	ZINC000853647271	FD	On-Demand	Mild	EPHX2	15	44
CCC[C@H](NC(=O)N[C@H]1COC2(CCC2)C1)C(=O)N1CCc2sccc2C1	ZINC000853647273	GF	On-Demand	Anodyne	GHRHR	51	31
CCC[C@H](NC(=O)N[C@@H]1COC2(CCC2)C1)C(=O)N1CCc2sccc2C1	ZINC000853647274	GF	On-Demand	Anodyne	GHRHR	51	31
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(C(F)(F)F)c2)C1	ZINC000853647279	FD	On-Demand	Anodyne	CACNA1B	56	37
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(C(F)(F)F)c2)C1	ZINC000853647279	FD	On-Demand	Anodyne	CCR2	64	38
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(C(F)(F)F)c2)C1	ZINC000853647279	FD	On-Demand	Anodyne	ST14	43	33
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(C(F)(F)F)c2)C1	ZINC000853647280	FD	On-Demand	Anodyne	CACNA1B	56	37
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(C(F)(F)F)c2)C1	ZINC000853647280	FD	On-Demand	Anodyne	CCR2	64	38
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(C(F)(F)F)c2)C1	ZINC000853647280	FD	On-Demand	Anodyne	ST14	43	33
c1ccc(CNc2nc(N3CCC4(CC3)OCCCO4)nc3ccccc23)cc1	ZINC000853647298	GH	On-Demand	Anodyne	HRH4	20	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)ccc2C(N)=O)CC1	ZINC000853647313	FD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)ccc2C(N)=O)CC1	ZINC000853647314	FD	On-Demand	Anodyne	P2RY12	43	38
CC(C)c1ccc2ncnc(N3CCC4(CC3)OCCCO4)c2c1	ZINC000853647327	EG	On-Demand	Anodyne	PDGFRB	41	41
CC(C)c1ccc2ncnc(N3CCC4(CC3)OCCCO4)c2c1	ZINC000853647327	EG	On-Demand	Anodyne	PDE3B	41	38
CN(C)C(=O)OC1CCN(c2nc3cccc(OC(F)F)c3s2)CC1	ZINC000853647430	FH	On-Demand	Anodyne	SCD1	31	43
CN(C)C(=O)OC1CCN(c2nc3cccc(OC(F)F)c3s2)CC1	ZINC000853647430	FH	On-Demand	Anodyne	SCD	17	43
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	MMP13	73	43
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	ADAM17	43	38
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	MMP2	41	42
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	MMP3	66	43
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	MMP8	34	42
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	MMP9	51	43
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	MMP7	60	42
COC(=O)C1(CON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)CC1	ZINC000853647448	GD	On-Demand	Mild	MMP1	69	43
COC(=O)/C=C\c1ccc(OCC2(CC#N)CC2)c(OC)c1	ZINC000853647463	DF	On-Demand	Mild	NR1H4	42	35
COC(=O)/C=C\c1ccc(OCC2(CC#N)CC2)c(OC)c1	ZINC000853647463	DF	On-Demand	Mild	TUBB1	41	36
COC(=O)c1ccc(C(F)(F)F)nc1N1CCC(OC(=O)N(C)C)CC1	ZINC000853647466	GF	On-Demand	Anodyne	LIPG	43	33
CN(C)C(=O)OC1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1	ZINC000853647512	FG	On-Demand	Bother	SERPINE1	25	46
CN(C)C(=O)OC1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1	ZINC000853647512	FG	On-Demand	Bother	LIPG	42	33
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(NC(C)=O)cc2)CC1	ZINC000853647517	GF	On-Demand	Mild	TGM2	77	45
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(NC(C)=O)cc2)CC1	ZINC000853647517	GF	On-Demand	Mild	F13A1	101	45
COC(=O)/C=C\c1ccc(OCCCCC2(C)OCCO2)c(OC)c1	ZINC000853647523	FG	On-Demand	Anodyne	APP	20	45
COC(=O)/C=C\c1ccc(OCCCCC2(C)OCCO2)c(OC)c1	ZINC000853647523	FG	On-Demand	Anodyne	TUBB1	41	36
CN(C)C(=O)OC1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853647531	EE	On-Demand	Anodyne	SCD1	77	43
CN(C)C(=O)OC1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853647531	EE	On-Demand	Anodyne	LIPG	43	36
CN(C)C(=O)OC1CCN(c2ccc(OCC(F)(F)F)nn2)CC1	ZINC000853647531	EE	On-Demand	Anodyne	SCD	38	43
CNC(=O)c1nn(Cc2oc(C)nc2C)c(=O)c2ccccc12	ZINC000853647537	DD	On-Demand	Anodyne	AKR1B1	41	38
CC(=O)c1ccc(C(F)(F)F)nc1N1CCC(OC(=O)N(C)C)CC1	ZINC000853647538	FF	On-Demand	Anodyne	TRPV1	21	40
CC(=O)c1ccc(C(F)(F)F)nc1N1CCC(OC(=O)N(C)C)CC1	ZINC000853647538	FF	On-Demand	Anodyne	LIPG	46	34
COC[C@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1ccccc1	ZINC000853647609	GE	On-Demand	Anodyne	MAPK1	40	43
COC[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1ccccc1	ZINC000853647610	GE	On-Demand	Anodyne	MAPK1	40	43
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2cccc(Cl)c2)C1	ZINC000853647626	FF	On-Demand	Anodyne	CACNA1I	28	40
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2cccc(Cl)c2)C1	ZINC000853647627	FF	On-Demand	Anodyne	CACNA1I	28	40
Cn1ncc(CCCNc2ccnc3c(F)cc(Cl)cc23)n1	ZINC000853647637	DG	On-Demand	Anodyne	HRP1_PLAFA	120	38
Cn1ncc(CCCNc2ccnc3c(F)cc(Cl)cc23)n1	ZINC000853647637	DG	On-Demand	Anodyne	HNMT	54	39
CN(C)C(=O)OC1CCN(c2nc3ncccc3cc2C#N)CC1	ZINC000853647693	EE	On-Demand	Mild	P2RY12	27	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NOCC3CC=CC3)CC2)cc1	ZINC000853647712	GF	On-Demand	Mild	TGM2	63	40
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NOCC3CC=CC3)CC2)cc1	ZINC000853647712	GF	On-Demand	Mild	F13A1	83	40
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NO[C@@H](C)C(C)C)CC2)cc1	ZINC000853647716	GF	On-Demand	Mild	TGM2	65	40
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NO[C@@H](C)C(C)C)CC2)cc1	ZINC000853647716	GF	On-Demand	Mild	F13A1	84	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NO[C@H](C)C(C)C)CC2)cc1	ZINC000853647717	GF	On-Demand	Mild	TGM2	65	40
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NO[C@H](C)C(C)C)CC2)cc1	ZINC000853647717	GF	On-Demand	Mild	F13A1	84	42
C#CCOCCON=C(C)c1ccc(NC(C)=O)cc1	ZINC000853647729	CE	On-Demand	Mild	ACR	40	34
C#CCOCCON=C(C)c1ccc(NC(C)=O)cc1	ZINC000853647729	CE	On-Demand	Mild	PPO2	18	40
Cc1cc(C(F)(F)F)cc(N2CCC(OC(=O)N(C)C)CC2)n1	ZINC000853647730	EG	On-Demand	Anodyne	LIPG	52	36
Fc1ncnc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1Br	ZINC000853647736	FH	On-Demand	Anodyne	PDE3A	46	45
Fc1ncnc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1Br	ZINC000853647736	FH	On-Demand	Anodyne	DCK	51	45
Fc1ncnc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1Br	ZINC000853647736	FH	On-Demand	Anodyne	PDE3B	53	44
Fc1ncnc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)c1Br	ZINC000853647737	FH	On-Demand	Anodyne	PDE3A	46	45
Fc1ncnc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)c1Br	ZINC000853647737	FH	On-Demand	Anodyne	DCK	51	45
Fc1ncnc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)c1Br	ZINC000853647737	FH	On-Demand	Anodyne	PDE3B	53	44
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)Cn1c(COc2ccccc2)nc2ccccc21	ZINC000853647760	HG	On-Demand	Anodyne	CAPN2	58	33
CC[C@H](C)NC(=O)[C@H](C)OC(=O)Cn1c(COc2ccccc2)nc2ccccc21	ZINC000853647763	HG	On-Demand	Anodyne	CAPN2	58	33
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NOCC3(C)CCC3)CC2)cc1	ZINC000853647789	GF	On-Demand	Mild	TGM2	64	42
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NOCC3(C)CCC3)CC2)cc1	ZINC000853647789	GF	On-Demand	Mild	F13A1	84	42
CC(=NOCCc1ccc(C#N)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000853647822	EH	On-Demand	Mild	PFKFB3	44	35
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(Cl)c2)C1	ZINC000853647853	ED	On-Demand	Anodyne	CACNA1I	46	42
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(Cl)c2)C1	ZINC000853647855	ED	On-Demand	Anodyne	CACNA1I	46	42
CS(=O)(=O)N1CC[C@@H](CON=CC(=O)Nc2cccc(F)c2)C1	ZINC000853647859	ED	On-Demand	Mild	CCR3	50	38
O=C(C=NOC[C@H]1CCN(C(=O)c2ccccc2)C1)Nc1ccc(F)cc1	ZINC000853647860	FF	On-Demand	Mild	F13A1	57	36
CS(=O)(=O)N1CC[C@H](CON=CC(=O)Nc2cccc(F)c2)C1	ZINC000853647861	ED	On-Demand	Mild	CCR3	50	38
O=C(C=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)Nc1ccc(F)cc1	ZINC000853647862	FF	On-Demand	Mild	F13A1	57	36
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2	ZINC000853647873	GH	On-Demand	Anodyne	EPHX2	22	53
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C12CC3CC(CC(C3)C1)C2	ZINC000853647875	GH	On-Demand	Anodyne	EPHX2	22	53
CC(=NOC[C@H]1CCN(S(C)(=O)=O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000853647900	GE	On-Demand	Mild	EPHX2	30	46
CC(=NOC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccc(NC(=O)C2CC2)cc1	ZINC000853647902	GE	On-Demand	Mild	EPHX2	30	46
CON(C)CCNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853647951	ED	On-Demand	Anodyne	EPHX2	40	50
CON(C)CCNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853647951	ED	On-Demand	Anodyne	MCHR1	17	41
CON(C)CCNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853647951	ED	On-Demand	Anodyne	L3MBTL3	60	38
CN(C)C(=O)OC1CCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853647968	EG	On-Demand	Anodyne	HTR3A	36	47
CCN1CC[C@H](ON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)C1=O	ZINC000853647982	GD	On-Demand	Mild	MMP13	43	42
CCN1CC[C@H](ON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)C1=O	ZINC000853647982	GD	On-Demand	Mild	MMP2	25	42
CCN1CC[C@H](ON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)C1=O	ZINC000853647982	GD	On-Demand	Mild	MMP3	45	42
CCN1CC[C@H](ON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)C1=O	ZINC000853647982	GD	On-Demand	Mild	MMP8	21	42
CCN1CC[C@H](ON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)C1=O	ZINC000853647982	GD	On-Demand	Mild	MMP9	30	42
CCN1CC[C@H](ON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)C1=O	ZINC000853647982	GD	On-Demand	Mild	MMP7	49	42
CCN1CC[C@H](ON=C2CCN(S(=O)(=O)c3ccc(OC)cc3)CC2)C1=O	ZINC000853647982	GD	On-Demand	Mild	MMP1	40	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Oc3ccccn3)cc2)CC1	ZINC000853647988	GF	On-Demand	Anodyne	P2RY12	111	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Oc3ccccn3)cc2)CC1	ZINC000853647989	GF	On-Demand	Anodyne	P2RY12	111	41
CCN1CC[C@H](ONC(=N)c2cccc(Cl)c2)C1=O	ZINC000853648039	CD	On-Demand	Anodyne	CACNA1I	21	41
COC[C@@H](CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1)OC	ZINC000853648086	GD	On-Demand	Mild	MMP7	44	38
CC(C)(C)OC(=O)N1CCO[C@H](CON=CC(=O)Nc2cccc(F)c2)C1	ZINC000853648125	GE	On-Demand	Mild	GPR119	15	41
CC(C)(C)OC(=O)N1CCO[C@@H](CON=CC(=O)Nc2cccc(F)c2)C1	ZINC000853648126	GE	On-Demand	Mild	GPR119	15	41
COC[C@@H](NC(=O)NCCN(C)OC)c1ccccc1	ZINC000853648200	CD	On-Demand	Anodyne	UTS2	45	39
COC[C@H](NC(=O)NCCN(C)OC)c1ccccc1	ZINC000853648202	CD	On-Demand	Anodyne	UTS2	45	39
OC[C@@H]1CCCN(c2nccnc2OC2CCC2)CC1	ZINC000853648208	CE	On-Demand	Anodyne	PDE10A	17	45
OC[C@H]1CCCN(c2nccnc2OC2CCC2)CC1	ZINC000853648209	CE	On-Demand	Anodyne	PDE10A	17	45
O=[N+]([O-])c1cc(N2CCC[C@H](CO)CC2)ccc1C(F)(F)F	ZINC000853648211	DG	On-Demand	Bother	SERPINE1	24	45
O=[N+]([O-])c1cc(N2CCC[C@@H](CO)CC2)ccc1C(F)(F)F	ZINC000853648212	DG	On-Demand	Bother	SERPINE1	24	45
OC[C@H]1CCCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853648232	CG	On-Demand	Anodyne	HTR3A	37	50
OC[C@H]1CCCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853648232	CG	On-Demand	Anodyne	PDE10A	21	42
OC[C@@H]1CCCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853648233	CG	On-Demand	Anodyne	HTR3A	37	50
OC[C@@H]1CCCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853648233	CG	On-Demand	Anodyne	PDE10A	21	42
COC(=O)N(C)CCNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853648236	GD	On-Demand	Anodyne	EPHX2	34	45
COC(=O)N(C)CCNC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853648236	GD	On-Demand	Anodyne	L3MBTL3	45	37
CN(C)C(=O)OC1CCN(c2cnc(F)cn2)CC1	ZINC000853648283	CD	On-Demand	Anodyne	SCD1	20	41
CCOc1cc(Nc2ccc(N3CCN(C(=O)OC)CC3)nc2)nc(C)n1	ZINC000853648284	FE	On-Demand	Anodyne	GALR2	40	32
CCOc1cc(Nc2ccc(N3CCN(C(=O)OC)CC3)nc2)nc(C)n1	ZINC000853648284	FE	On-Demand	Anodyne	DGAT1	38	44
COC(=O)/C=C\c1ccc(OCCO[C@@H]2CC2(F)F)c(OC)c1	ZINC000853648294	EF	On-Demand	Anodyne	APP	20	45
COC(=O)/C=C\c1ccc(OCCO[C@@H]2CC2(F)F)c(OC)c1	ZINC000853648294	EF	On-Demand	Anodyne	NR1H4	45	37
COC(=O)/C=C\c1ccc(OCCO[C@@H]2CC2(F)F)c(OC)c1	ZINC000853648294	EF	On-Demand	Anodyne	TUBB1	43	37
COC(=O)/C=C\c1ccc(OCCO[C@H]2CC2(F)F)c(OC)c1	ZINC000853648295	EF	On-Demand	Anodyne	APP	20	45
COC(=O)/C=C\c1ccc(OCCO[C@H]2CC2(F)F)c(OC)c1	ZINC000853648295	EF	On-Demand	Anodyne	NR1H4	45	37
COC(=O)/C=C\c1ccc(OCCO[C@H]2CC2(F)F)c(OC)c1	ZINC000853648295	EF	On-Demand	Anodyne	TUBB1	43	37
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NOCCC3CCC3)CC2)cc1	ZINC000853648334	GF	On-Demand	Mild	TGM2	69	39
CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NOCCC3CCC3)CC2)cc1	ZINC000853648334	GF	On-Demand	Mild	F13A1	91	41
C#C[C@H](NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1)C1CCOCC1	ZINC000853648400	GE	On-Demand	Mild	EPHX2	25	49
C#C[C@H](NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1)C1CCOCC1	ZINC000853648400	GE	On-Demand	Mild	L3MBTL3	59	35
C#C[C@@H](NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1)C1CCOCC1	ZINC000853648403	GE	On-Demand	Mild	EPHX2	25	49
C#C[C@@H](NC(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1)C1CCOCC1	ZINC000853648403	GE	On-Demand	Mild	L3MBTL3	59	35
Nc1ccc(N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)nc1[N+](=O)[O-]	ZINC000853648406	FD	On-Demand	Bother	SCD1	17	42
COc1ccc(-c2nccc(N3CCC[C@H](CO)CC3)n2)cc1	ZINC000853648408	DF	On-Demand	Anodyne	SORD	63	39
COc1ccc(-c2nccc(N3CCC[C@@H](CO)CC3)n2)cc1	ZINC000853648411	DF	On-Demand	Anodyne	SORD	63	39
COC(=O)/C=C\c1ccc(OCC2(C(=O)OC)CC2)c(OC)c1	ZINC000853648437	DE	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OCC2(C(=O)OC)CC2)c(OC)c1	ZINC000853648437	DE	On-Demand	Anodyne	NR1H4	42	35
COC(=O)/C=C\c1ccc(OCC2(C(=O)OC)CC2)c(OC)c1	ZINC000853648437	DE	On-Demand	Anodyne	TUBB1	48	39
COC[C@@H](CON=C(C)c1ccc(NC(C)=O)cc1)OC	ZINC000853648479	CE	On-Demand	Mild	ACR	45	35
COC[C@@H](CON=C(C)c1ccc(NC(C)=O)cc1)OC	ZINC000853648479	CE	On-Demand	Mild	PPO2	18	41
OC[C@H]1CCCN(c2nccnc2-c2ccccc2)CC1	ZINC000853648485	CF	On-Demand	Anodyne	PDE10A	21	40
OC[C@@H]1CCCN(c2nccnc2-c2ccccc2)CC1	ZINC000853648488	CF	On-Demand	Anodyne	PDE10A	21	40
CS(=O)(=O)N1CC[C@@H](CON=CC(=O)Nc2ccc(F)cc2)C1	ZINC000853648502	ED	On-Demand	Mild	CCR3	35	40
CS(=O)(=O)N1CC[C@@H](CON=CC(=O)Nc2ccc(F)cc2)C1	ZINC000853648502	ED	On-Demand	Mild	TGM2	51	39
CS(=O)(=O)N1CC[C@@H](CON=CC(=O)Nc2ccc(F)cc2)C1	ZINC000853648502	ED	On-Demand	Mild	F13A1	86	39
CS(=O)(=O)N1CC[C@H](CON=CC(=O)Nc2ccc(F)cc2)C1	ZINC000853648504	ED	On-Demand	Mild	CCR3	35	40
CS(=O)(=O)N1CC[C@H](CON=CC(=O)Nc2ccc(F)cc2)C1	ZINC000853648504	ED	On-Demand	Mild	TGM2	51	39
CS(=O)(=O)N1CC[C@H](CON=CC(=O)Nc2ccc(F)cc2)C1	ZINC000853648504	ED	On-Demand	Mild	F13A1	86	39
COc1cccc(Nc2nc(NCCCc3cnn(C)n3)nc3[nH]cnc23)c1	ZINC000853648545	GE	On-Demand	Anodyne	CDK1	22	50
COc1cccc(Nc2nc(NCCCc3cnn(C)n3)nc3[nH]cnc23)c1	ZINC000853648545	GE	On-Demand	Anodyne	CCNB_PATPE	43	34
Cn1ncc(CCCNc2cc(Nc3ccccc3)ncn2)n1	ZINC000853648550	DE	On-Demand	Anodyne	EGFR	15	43
COc1cccc(Nc2nc(N3CCC[C@@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648575	FF	On-Demand	Anodyne	CCR4	40	42
COc1cccc(Nc2nc(N3CCC[C@@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648575	FF	On-Demand	Anodyne	PDPK1	15	43
COc1cccc(Nc2nc(N3CCC[C@@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648575	FF	On-Demand	Anodyne	GALR2	23	46
COc1cccc(Nc2nc(N3CCC[C@@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648575	FF	On-Demand	Anodyne	CDK1	18	41
COc1cccc(Nc2nc(N3CCC[C@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648576	FF	On-Demand	Anodyne	CCR4	40	42
COc1cccc(Nc2nc(N3CCC[C@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648576	FF	On-Demand	Anodyne	PDPK1	15	43
COc1cccc(Nc2nc(N3CCC[C@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648576	FF	On-Demand	Anodyne	GALR2	23	46
COc1cccc(Nc2nc(N3CCC[C@H](CO)CC3)nc3[nH]cnc23)c1	ZINC000853648576	FF	On-Demand	Anodyne	CDK1	18	41
COc1cccc(SCCON=C2CCN(C(=O)C(C)C)CC2)c1	ZINC000853648582	FG	On-Demand	Mild	DRD4	40	30
COc1cccc(SCCON=C2CCN(C(=O)C(C)C)CC2)c1	ZINC000853648582	FG	On-Demand	Mild	MTNR1B	18	46
Cc1c(N2CCC[C@H](CO)CC2)ncnc1N1CCC[C@@H](CO)CC1	ZINC000853648637	ED	On-Demand	Anodyne	SIRT3	64	36
Cc1c(N2CCC[C@H](CO)CC2)ncnc1N1CCC[C@@H](CO)CC1	ZINC000853648637	ED	On-Demand	Anodyne	SIRT2	53	35
Cc1c(N2CCC[C@H](CO)CC2)ncnc1N1CCC[C@@H](CO)CC1	ZINC000853648637	ED	On-Demand	Anodyne	SIRT1	50	33
Cc1c(N2CCC[C@@H](CO)CC2)ncnc1N1CCC[C@@H](CO)CC1	ZINC000853648638	ED	On-Demand	Anodyne	SIRT3	64	36
Cc1c(N2CCC[C@@H](CO)CC2)ncnc1N1CCC[C@@H](CO)CC1	ZINC000853648638	ED	On-Demand	Anodyne	SIRT2	53	35
Cc1c(N2CCC[C@@H](CO)CC2)ncnc1N1CCC[C@@H](CO)CC1	ZINC000853648638	ED	On-Demand	Anodyne	SIRT1	50	33
Cc1c(N2CCC[C@H](CO)CC2)ncnc1N1CCC[C@H](CO)CC1	ZINC000853648639	ED	On-Demand	Anodyne	SIRT3	64	36
Cc1c(N2CCC[C@H](CO)CC2)ncnc1N1CCC[C@H](CO)CC1	ZINC000853648639	ED	On-Demand	Anodyne	SIRT2	53	35
Cc1c(N2CCC[C@H](CO)CC2)ncnc1N1CCC[C@H](CO)CC1	ZINC000853648639	ED	On-Demand	Anodyne	SIRT1	50	33
OC[C@@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)CC1	ZINC000853648650	EI	On-Demand	Anodyne	PTGES	17	40
OC[C@H]1CCCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)CC1	ZINC000853648651	EI	On-Demand	Anodyne	PTGES	17	40
COC(=O)/C=C\c1ccc(OC[C@H](OC)C2CCCC2)c(OC)c1	ZINC000853648659	EG	On-Demand	Anodyne	NR1H4	52	43
COC(=O)/C=C\c1ccc(OC[C@H](OC)C2CCCC2)c(OC)c1	ZINC000853648659	EG	On-Demand	Anodyne	TUBB1	43	37
COC(=O)/C=C\c1ccc(OC[C@H](OC)C2CCCC2)c(OC)c1	ZINC000853648659	EG	On-Demand	Anodyne	ACKR3	48	34
COC(=O)/C=C\c1ccc(OC[C@@H](OC)C2CCCC2)c(OC)c1	ZINC000853648660	EG	On-Demand	Anodyne	NR1H4	52	43
COC(=O)/C=C\c1ccc(OC[C@@H](OC)C2CCCC2)c(OC)c1	ZINC000853648660	EG	On-Demand	Anodyne	TUBB1	43	37
COC(=O)/C=C\c1ccc(OC[C@@H](OC)C2CCCC2)c(OC)c1	ZINC000853648660	EG	On-Demand	Anodyne	ACKR3	48	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2ccc(F)cc2)CC1	ZINC000853648661	GD	On-Demand	Mild	P2RY12	45	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2ccc(F)cc2)CC1	ZINC000853648661	GD	On-Demand	Mild	TGM2	41	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2ccc(F)cc2)CC1	ZINC000853648661	GD	On-Demand	Mild	F13A1	69	47
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2ccc(F)cc2)CC1	ZINC000853648663	GD	On-Demand	Mild	P2RY12	45	35
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2ccc(F)cc2)CC1	ZINC000853648663	GD	On-Demand	Mild	TGM2	41	47
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2ccc(F)cc2)CC1	ZINC000853648663	GD	On-Demand	Mild	F13A1	69	47
CN(C)C(=O)OC1CCN(c2ncnc3c2nnn3C)CC1	ZINC000853648728	DC	On-Demand	Anodyne	SIRT3	42	32
Fc1cnc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)cn1	ZINC000853648738	CF	On-Demand	Anodyne	DCK	41	44
Fc1cnc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)cn1	ZINC000853648739	CF	On-Demand	Anodyne	DCK	41	44
O=C(NCc1cn2c(n1)CCCC2)NNc1nc2ccc(Cl)cc2s1	ZINC000853648746	GG	On-Demand	Reactive	CSNK1D	28	41
C#CCOCCON=C1CCN(S(=O)(=O)c2ccc(NC(C)=O)cc2)CC1	ZINC000853648753	GD	On-Demand	Mild	TGM2	59	39
C#CCOCCON=C1CCN(S(=O)(=O)c2ccc(NC(C)=O)cc2)CC1	ZINC000853648753	GD	On-Demand	Mild	F13A1	79	40
COC(=O)c1nccc(N2CCC(OC(=O)N(C)C)CC2)n1	ZINC000853648769	DC	On-Demand	Anodyne	SORD	40	39
CC(C)c1ccc2ncnc(N3CCC(OC(=O)N(C)C)CC3)c2c1	ZINC000853648781	EG	On-Demand	Anodyne	PDE3A	49	47
CC(C)c1ccc2ncnc(N3CCC(OC(=O)N(C)C)CC3)c2c1	ZINC000853648781	EG	On-Demand	Anodyne	PDGFRB	60	46
CC(C)c1ccc2ncnc(N3CCC(OC(=O)N(C)C)CC3)c2c1	ZINC000853648781	EG	On-Demand	Anodyne	AKT3	40	33
CC(C)c1ccc2ncnc(N3CCC(OC(=O)N(C)C)CC3)c2c1	ZINC000853648781	EG	On-Demand	Anodyne	PDE3B	54	47
CC(C)c1ccc2ncnc(N3CCC(OC(=O)N(C)C)CC3)c2c1	ZINC000853648781	EG	On-Demand	Anodyne	SIRT3	59	34
CC(C)c1ccc2ncnc(N3CCC(OC(=O)N(C)C)CC3)c2c1	ZINC000853648781	EG	On-Demand	Anodyne	SIRT2	54	34
CC(C)c1ccc2ncnc(N3CCC(OC(=O)N(C)C)CC3)c2c1	ZINC000853648781	EG	On-Demand	Anodyne	SIRT1	52	32
COC(=O)/C=C\c1ccc(OCCc2cncn2C)c(OC)c1	ZINC000853648790	DE	On-Demand	Anodyne	APP	21	48
COC(=O)/C=C\c1ccc(OCCc2cncn2C)c(OC)c1	ZINC000853648790	DE	On-Demand	Anodyne	TUBB1	41	35
CCOC(=O)c1nccc(N2CCC(OC(=O)N(C)C)CC2)n1	ZINC000853648820	DD	On-Demand	Anodyne	SORD	49	37
COC[C@@H](COc1ccc(/C=C/C(=O)OC)cc1OC)OC	ZINC000853648826	DD	On-Demand	Anodyne	APP	21	46
COC[C@@H](COc1ccc(/C=C/C(=O)OC)cc1OC)OC	ZINC000853648826	DD	On-Demand	Anodyne	NR1H4	46	42
COC[C@@H](COc1ccc(/C=C/C(=O)OC)cc1OC)OC	ZINC000853648826	DD	On-Demand	Anodyne	TUBB1	57	39
COC[C@H](NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000853648980	GG	On-Demand	Anodyne	GPR119	28	40
COC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2)c1ccccc1	ZINC000853648981	GG	On-Demand	Anodyne	GPR119	28	40
COC[C@@H](COc1ccc(/C=C\C(=O)OC)cc1OC)OC	ZINC000853648982	DD	On-Demand	Anodyne	APP	21	46
COC[C@@H](COc1ccc(/C=C\C(=O)OC)cc1OC)OC	ZINC000853648982	DD	On-Demand	Anodyne	NR1H4	46	42
COC[C@@H](COc1ccc(/C=C\C(=O)OC)cc1OC)OC	ZINC000853648982	DD	On-Demand	Anodyne	TUBB1	57	39
CCCc1ccc(N2CCC(OC(=O)N(C)C)CC2)nn1	ZINC000853649017	CE	On-Demand	Anodyne	SCD1	54	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649020	GD	On-Demand	Anodyne	P2RY12	99	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649020	GD	On-Demand	Anodyne	MC4R	54	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649020	GD	On-Demand	Anodyne	TRY2_BOVIN	72	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649020	GD	On-Demand	Anodyne	ST14	37	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649022	GD	On-Demand	Anodyne	P2RY12	99	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649022	GD	On-Demand	Anodyne	MC4R	54	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649022	GD	On-Demand	Anodyne	TRY2_BOVIN	72	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(Cl)c2)CC1	ZINC000853649022	GD	On-Demand	Anodyne	ST14	37	43
COC(=O)c1ccc2ccccc2c1OCCOC(F)F	ZINC000853649133	CG	On-Demand	Anodyne	KCNJ11	47	35
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	CHRM2	18	40
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	MMP13	42	43
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	MMP2	22	43
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	MMP3	45	43
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	MMP8	19	43
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	MMP9	30	43
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	PKM	17	57
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	MMP7	48	43
C=C(Cl)CON=C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1	ZINC000853649148	FF	On-Demand	Mild	MMP1	41	43
Cc1ccc(N2CCC(OC(=O)N(C)C)CC2)nn1	ZINC000853649173	CD	On-Demand	Anodyne	SCD1	68	45
Cc1ccc(N2CCC(OC(=O)N(C)C)CC2)nn1	ZINC000853649173	CD	On-Demand	Anodyne	SCD	26	41
Fc1cc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)ncn1	ZINC000853649181	CF	On-Demand	Anodyne	PDE3A	44	44
Fc1cc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)ncn1	ZINC000853649181	CF	On-Demand	Anodyne	DCK	58	53
Fc1cc(N2CC[C@@H](Oc3ccc(Cl)cc3)C2)ncn1	ZINC000853649181	CF	On-Demand	Anodyne	PDE3B	52	43
Fc1cc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)ncn1	ZINC000853649183	CF	On-Demand	Anodyne	PDE3A	44	44
Fc1cc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)ncn1	ZINC000853649183	CF	On-Demand	Anodyne	DCK	58	53
Fc1cc(N2CC[C@H](Oc3ccc(Cl)cc3)C2)ncn1	ZINC000853649183	CF	On-Demand	Anodyne	PDE3B	52	43
COC(=O)C1(CON=C(C)c2ccc(NC(C)=O)cc2)CC1	ZINC000853649216	DE	On-Demand	Mild	ACR	44	34
COC(=O)C1(CON=C(C)c2ccc(NC(C)=O)cc2)CC1	ZINC000853649216	DE	On-Demand	Mild	PPO2	19	40
CN(C)C(=O)OC1CCN(c2nc(C(F)F)nc3ccc(F)cc23)CC1	ZINC000853649218	FG	On-Demand	Anodyne	DHODH	46	34
C#CCCCOc1cccnc1N1CCC[C@H](CO)CC1	ZINC000853649248	CE	On-Demand	Mild	PDE10A	21	44
C#CCCCOc1cccnc1N1CCC[C@@H](CO)CC1	ZINC000853649249	CE	On-Demand	Mild	PDE10A	21	44
CCOC(=O)c1nccc(N2CCC[C@@H](CO)CC2)n1	ZINC000853649280	CD	On-Demand	Anodyne	SORD	78	39
CCOC(=O)c1nccc(N2CCC[C@H](CO)CC2)n1	ZINC000853649281	CD	On-Demand	Anodyne	SORD	78	39
C#CCCN(CCOC)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853649289	FE	On-Demand	Mild	L3MBTL3	53	34
CC(C)c1ccc2ncnc(N3CCC[C@H](CO)CC3)c2c1	ZINC000853649296	CG	On-Demand	Anodyne	PDE3A	44	43
CC(C)c1ccc2ncnc(N3CCC[C@H](CO)CC3)c2c1	ZINC000853649296	CG	On-Demand	Anodyne	PDGFRB	70	44
CC(C)c1ccc2ncnc(N3CCC[C@H](CO)CC3)c2c1	ZINC000853649296	CG	On-Demand	Anodyne	PDE3B	48	43
CC(C)c1ccc2ncnc(N3CCC[C@H](CO)CC3)c2c1	ZINC000853649296	CG	On-Demand	Anodyne	SIRT3	66	36
CC(C)c1ccc2ncnc(N3CCC[C@H](CO)CC3)c2c1	ZINC000853649296	CG	On-Demand	Anodyne	SIRT2	55	33
CC(C)c1ccc2ncnc(N3CCC[C@H](CO)CC3)c2c1	ZINC000853649296	CG	On-Demand	Anodyne	SIRT1	53	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2cccc(F)c2)CC1	ZINC000853649301	GD	On-Demand	Mild	P2RY12	85	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2cccc(F)c2)CC1	ZINC000853649301	GD	On-Demand	Mild	TGM2	27	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=CC(=O)Nc2cccc(F)c2)CC1	ZINC000853649301	GD	On-Demand	Mild	F13A1	46	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2cccc(F)c2)CC1	ZINC000853649302	GD	On-Demand	Mild	P2RY12	85	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2cccc(F)c2)CC1	ZINC000853649302	GD	On-Demand	Mild	TGM2	27	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=CC(=O)Nc2cccc(F)c2)CC1	ZINC000853649302	GD	On-Demand	Mild	F13A1	46	40
O=C(C=NOC[C@H]1CCN(C(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000853649346	FF	On-Demand	Mild	CCR3	47	40
O=C(C=NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)Nc1cccc(F)c1	ZINC000853649347	FF	On-Demand	Mild	CCR3	47	40
COC[C@@H](NC(=O)NCCc1nnc(S)n1C)c1ccccc1	ZINC000853649373	ED	On-Demand	Anodyne	TACR3	15	42
COC[C@H](NC(=O)NCCc1nnc(S)n1C)c1ccccc1	ZINC000853649374	ED	On-Demand	Anodyne	TACR3	15	42
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3c(c2)OCCO3)C1	ZINC000853649388	FE	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3c(c2)OCCO3)C1	ZINC000853649389	FE	On-Demand	Anodyne	GPR119	33	40
CC(C)c1ccc2ncnc(N3CCC[C@@H](CO)CC3)c2c1	ZINC000853649392	CG	On-Demand	Anodyne	PDE3A	44	43
CC(C)c1ccc2ncnc(N3CCC[C@@H](CO)CC3)c2c1	ZINC000853649392	CG	On-Demand	Anodyne	PDGFRB	70	44
CC(C)c1ccc2ncnc(N3CCC[C@@H](CO)CC3)c2c1	ZINC000853649392	CG	On-Demand	Anodyne	PDE3B	48	43
CC(C)c1ccc2ncnc(N3CCC[C@@H](CO)CC3)c2c1	ZINC000853649392	CG	On-Demand	Anodyne	SIRT3	66	36
CC(C)c1ccc2ncnc(N3CCC[C@@H](CO)CC3)c2c1	ZINC000853649392	CG	On-Demand	Anodyne	SIRT2	55	33
CC(C)c1ccc2ncnc(N3CCC[C@@H](CO)CC3)c2c1	ZINC000853649392	CG	On-Demand	Anodyne	SIRT1	53	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3cc(F)c(F)cc32)CC1	ZINC000853649458	FE	On-Demand	Anodyne	P2RY12	49	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3cc(F)c(F)cc32)CC1	ZINC000853649459	FE	On-Demand	Anodyne	P2RY12	49	35
CCCn1ncnc1CON=CC(=O)Nc1ccc(F)cc1	ZINC000853649468	DD	On-Demand	Mild	FAAH	16	40
CCNc1nccnc1N1CCC[C@@H](CO)CC1	ZINC000853649495	CD	On-Demand	Anodyne	PDE10A	15	40
CCNc1nccnc1N1CCC[C@H](CO)CC1	ZINC000853649496	CD	On-Demand	Anodyne	PDE10A	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)ccc2C(=O)OC)CC1	ZINC000853649527	GE	On-Demand	Anodyne	P2RY12	60	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)ccc2C(=O)OC)CC1	ZINC000853649527	GE	On-Demand	Anodyne	MC4R	46	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)ccc2C(=O)OC)CC1	ZINC000853649528	GE	On-Demand	Anodyne	P2RY12	60	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)ccc2C(=O)OC)CC1	ZINC000853649528	GE	On-Demand	Anodyne	MC4R	46	39
COCCN(CCF)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853649530	FE	On-Demand	Anodyne	EPHX2	19	40
COCCN(CCF)C(=O)NC1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC000853649530	FE	On-Demand	Anodyne	L3MBTL3	47	35
Cn1nnc2c(N3CCC[C@@H](CO)CC3)ncnc21	ZINC000853649546	CC	On-Demand	Anodyne	SIRT3	58	35
Cn1nnc2c(N3CCC[C@@H](CO)CC3)ncnc21	ZINC000853649546	CC	On-Demand	Anodyne	SIRT2	48	35
Cn1nnc2c(N3CCC[C@@H](CO)CC3)ncnc21	ZINC000853649546	CC	On-Demand	Anodyne	SIRT1	41	32
Cn1nnc2c(N3CCC[C@H](CO)CC3)ncnc21	ZINC000853649547	CC	On-Demand	Anodyne	SIRT3	58	35
Cn1nnc2c(N3CCC[C@H](CO)CC3)ncnc21	ZINC000853649547	CC	On-Demand	Anodyne	SIRT2	48	35
Cn1nnc2c(N3CCC[C@H](CO)CC3)ncnc21	ZINC000853649547	CC	On-Demand	Anodyne	SIRT1	41	32
C#Cc1cccnc1N1CCC[C@@H](CO)CC1	ZINC000853649577	BD	On-Demand	Mild	PDE10A	20	40
C#Cc1cccnc1N1CCC[C@H](CO)CC1	ZINC000853649579	BD	On-Demand	Mild	PDE10A	20	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)n(CC)c3ccccc32)CC1	ZINC000853649595	FD	On-Demand	Anodyne	P2RY12	69	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)n(CC)c3ccccc32)CC1	ZINC000853649596	FD	On-Demand	Anodyne	P2RY12	69	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)OCCO3)CC1	ZINC000853649626	FD	On-Demand	Anodyne	P2RY12	60	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)OCCO3)CC1	ZINC000853649627	FD	On-Demand	Anodyne	P2RY12	60	38
O=[N+]([O-])c1ccc(N2CC[C@@H]2C(F)F)c([N+](=O)[O-])c1	ZINC000853649664	CE	On-Demand	Bother	PNMT	17	41
O=[N+]([O-])c1ccc(N2CC[C@H]2C(F)F)c([N+](=O)[O-])c1	ZINC000853649665	CE	On-Demand	Bother	PNMT	17	41
N#Cc1cc([N+](=O)[O-])ccc1N1CC[C@H]1C(F)F	ZINC000853649681	CE	On-Demand	Mild	AR	29	40
N#Cc1cc([N+](=O)[O-])ccc1N1CC[C@@H]1C(F)F	ZINC000853649682	CE	On-Demand	Mild	AR	29	40
C#Cc1cccnc1N1C[C@@H](C(=O)OC)[C@H](c2ccc(O)cc2)C1	ZINC000853649688	DE	On-Demand	Mild	SLC6A3	20	44
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NCC1CCC(O)CC1	ZINC000853649693	GG	On-Demand	Anodyne	GRIN2B	27	41
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NCC1CCC(O)CC1	ZINC000853649693	GG	On-Demand	Anodyne	VCP	45	36
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NCC1CCC(O)CC1	ZINC000853649693	GG	On-Demand	Anodyne	SLC12A5	61	36
C[C@H]1[C@H](C)CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853649739	CE	On-Demand	Bother	PNMT	19	40
O=C(OCc1ccccc1)c1cccc(CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)c1	ZINC000853649749	GF	On-Demand	Anodyne	SLC12A5	48	33
Fc1cccc2oc(N3CC[C@@H]3C(F)F)nc12	ZINC000853649799	BF	On-Demand	Anodyne	HTR3A	21	41
Fc1cccc2oc(N3CC[C@H]3C(F)F)nc12	ZINC000853649800	BF	On-Demand	Anodyne	HTR3A	21	41
CN1CCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)CCC1=O	ZINC000853649924	GE	On-Demand	Anodyne	P2RY12	15	41
COC(=O)[C@@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])C[C@H]1c1ccc(O)cc1	ZINC000853649930	GH	On-Demand	Bother	SLC6A3	27	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3nnco3)c2)CC1	ZINC000853649972	FD	On-Demand	Anodyne	P2RY12	146	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3nnco3)c2)CC1	ZINC000853649973	FD	On-Demand	Anodyne	P2RY12	146	38
COC(=O)c1sc(N2CCC3(CCC(N(C)C)CC3)CC2)nc1Cl	ZINC000853649974	FH	On-Demand	Anodyne	PARE	72	35
N#CC[C@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649975	GH	On-Demand	Mild	CTSK	15	40
N#CC[C@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649975	GH	On-Demand	Mild	CTSL	15	40
N#CC[C@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649975	GH	On-Demand	Mild	PREP	49	43
N#CC[C@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649975	GH	On-Demand	Mild	LGMN	46	36
N#CC[C@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649975	GH	On-Demand	Mild	TMPRSS11D	46	35
N#CC[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649976	GH	On-Demand	Mild	CTSK	15	40
N#CC[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649976	GH	On-Demand	Mild	CTSL	15	40
N#CC[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649976	GH	On-Demand	Mild	PREP	49	43
N#CC[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649976	GH	On-Demand	Mild	LGMN	46	36
N#CC[C@@H]1CCCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853649976	GH	On-Demand	Mild	TMPRSS11D	46	35
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650007	GG	On-Demand	Anodyne	PLG	46	36
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650007	GG	On-Demand	Anodyne	TMPRSS11D	41	34
CN(C)C1CCC2(CC1)CCN(c1ccc([N+](=O)[O-])cc1)CC2	ZINC000853650021	DH	On-Demand	Bother	SSTR1	38	41
CN(C(=O)NCCSC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853650029	DF	On-Demand	Anodyne	MME	43	38
CN(C(=O)NCCSC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853650029	DF	On-Demand	Anodyne	NPY5R	16	41
CN(C(=O)NCCSC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853650030	DF	On-Demand	Anodyne	MME	43	38
CN(C(=O)NCCSC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853650030	DF	On-Demand	Anodyne	NPY5R	16	41
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853650045	GD	On-Demand	Anodyne	SFRP1	68	33
CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853650045	GD	On-Demand	Anodyne	WNT3	54	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853650048	GD	On-Demand	Anodyne	SFRP1	68	33
CNS(=O)(=O)c1cccc([C@H](C)NC(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853650048	GD	On-Demand	Anodyne	WNT3	54	33
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)N[C@H]1C[C@H](O)C1	ZINC000853650062	FE	On-Demand	Anodyne	EPHX2	24	45
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)N[C@H]1C[C@H](O)C1	ZINC000853650062	FE	On-Demand	Anodyne	SLC12A5	66	36
CON(C)CCNC(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000853650068	EF	On-Demand	Anodyne	KCNA3	40	33
CON(C)CCNC(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000853650068	EF	On-Demand	Anodyne	SOAT1	15	47
CCOC(=O)c1nccc(N2CCN(C(=O)OC(C)(C)C)C[C@](C)(F)C2)n1	ZINC000853650101	GE	On-Demand	Anodyne	GPR119	33	42
CCOC(=O)c1nccc(N2CCN(C(=O)OC(C)(C)C)C[C@@](C)(F)C2)n1	ZINC000853650103	GE	On-Demand	Anodyne	GPR119	33	42
CC[C@@H](O)CNC(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650118	FF	On-Demand	Anodyne	CTSB	44	37
CC[C@@H](O)CNC(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650118	FF	On-Demand	Anodyne	PAPA1_CARPA	44	33
CC[C@@H](O)CNC(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650118	FF	On-Demand	Anodyne	CAPN1	52	37
CC[C@@H](O)CNC(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650118	FF	On-Demand	Anodyne	CAPN2	101	37
CC[C@@H](O)CNC(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650118	FF	On-Demand	Anodyne	NPR	54	34
CC[C@@H](O)CNC(=O)NCc1cccc(C(=O)OCc2ccccc2)c1	ZINC000853650118	FF	On-Demand	Anodyne	PDS	78	45
O=C(OCc1ccccc1)c1cccc(CNC(=O)N2CCC3(COC3)C2)c1	ZINC000853650146	GF	On-Demand	Anodyne	SLC12A5	65	37
O=C1OCCN1C[C@H]1CCN(c2nc(C(F)F)nc3ccc(F)cc23)C1	ZINC000853650167	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	37
O=C1OCCN1C[C@@H]1CCN(c2nc(C(F)F)nc3ccc(F)cc23)C1	ZINC000853650169	FF	On-Demand	Anodyne	Q8MHZ5_SHEEP	42	37
Cn1c(S)nnc1CCNC(=O)NCC1(c2ccccc2)CCCCCC1	ZINC000853650224	GG	On-Demand	Anodyne	KCNA3	46	37
Cn1c(S)nnc1CCNC(=O)NCC1(c2ccccc2)CCCCCC1	ZINC000853650224	GG	On-Demand	Anodyne	NMBR	44	37
CC(C)(C)OC(=O)N1CCN(c2nc3ncccc3cc2C#N)C[C@](C)(F)C1	ZINC000853650268	GG	On-Demand	Mild	GPR119	21	44
CC(C)(C)OC(=O)N1CCN(c2nc3ncccc3cc2C#N)C[C@@](C)(F)C1	ZINC000853650270	GG	On-Demand	Mild	GPR119	21	44
COC(=O)[C@@H]1CN(c2cnc(F)cn2)C[C@H]1c1ccc(O)cc1	ZINC000853650271	DD	On-Demand	Anodyne	SLC6A3	33	40
CC(C)(C)OC(=O)N1CCN(c2cnc(N3CCCC3=O)cn2)C[C@](C)(F)C1	ZINC000853650281	GE	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1CCN(c2cnc(N3CCCC3=O)cn2)C[C@@](C)(F)C1	ZINC000853650283	GE	On-Demand	Anodyne	GPR119	19	40
C[C@H]1[C@H](C)CN1c1ccc([N+](=O)[O-])cc1	ZINC000853650338	BE	On-Demand	Bother	KCNJ1	16	40
C[C@@]1(C#N)CCN(C(=O)NCc2cccc(C(=O)OCc3ccccc3)c2)C1	ZINC000853650363	GG	On-Demand	Mild	SLC12A5	68	39
COC[C@H](NC(=O)NCCSC(C)(C)C)c1cccc(OC)c1	ZINC000853650366	EG	On-Demand	Anodyne	MTNR1A	38	47
COC[C@H](NC(=O)NCCSC(C)(C)C)c1cccc(OC)c1	ZINC000853650366	EG	On-Demand	Anodyne	MTNR1B	37	47
COC[C@@H](NC(=O)NCCSC(C)(C)C)c1cccc(OC)c1	ZINC000853650368	EG	On-Demand	Anodyne	MTNR1A	38	47
COC[C@@H](NC(=O)NCCSC(C)(C)C)c1cccc(OC)c1	ZINC000853650368	EG	On-Demand	Anodyne	MTNR1B	37	47
CON(C)CCNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	ZINC000853650377	FC	On-Demand	Anodyne	DRD4	42	32
CON(C)CCNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1	ZINC000853650377	FC	On-Demand	Anodyne	ROCK2	25	46
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)N[C@@H](CO)C1CCC1	ZINC000853650468	GG	On-Demand	Anodyne	PROC	43	33
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)N[C@H](CO)C1CCC1	ZINC000853650469	GG	On-Demand	Anodyne	PROC	43	33
O=C(OCc1ccccc1)c1cccc(CNC(=O)N2CCC(CO)(CO)C2)c1	ZINC000853650501	GD	On-Demand	Anodyne	SLC12A5	68	36
C[C@@H](CCCNC(=O)OC(C)(C)C)Nc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853650511	GE	On-Demand	Anodyne	CA2	15	48
CO[C@@H](CSc1nc2ccccc2c(=O)n1-c1cccnc1)C1CCC1	ZINC000853650597	FH	On-Demand	Anodyne	CCKBR	17	40
CO[C@@H](CSc1nc2ccccc2c(=O)n1-c1cccnc1)C1CCC1	ZINC000853650597	FH	On-Demand	Anodyne	VCP	58	36
C[C@H]1[C@H](C)CN1c1ccc([N+](=O)[O-])cc1F	ZINC000853650746	BF	On-Demand	Bother	F2RL3	45	33
CC(C)(C)OC(=O)N1CCN(c2cc(F)ncn2)C[C@](C)(F)C1	ZINC000853650789	EE	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1CCN(c2cc(F)ncn2)C[C@@](C)(F)C1	ZINC000853650791	EE	On-Demand	Anodyne	GPR119	36	46
Cc1cc(CO)cc(N2CCN(C(=O)OC(C)(C)C)C[C@](C)(F)C2)n1	ZINC000853650819	FF	On-Demand	Anodyne	GPR119	20	42
Cc1cc(CO)cc(N2CCN(C(=O)OC(C)(C)C)C[C@@](C)(F)C2)n1	ZINC000853650820	FF	On-Demand	Anodyne	GPR119	20	42
O=C(OCc1ccccc1)c1cccc(CNC(=O)N2CCC(O)(CO)CC2)c1	ZINC000853650836	GE	On-Demand	Anodyne	SLC12A5	65	35
CON(C)CCNC(=O)NCC1(c2ccc(Cl)cc2)CC1	ZINC000853650867	DE	On-Demand	Anodyne	KCNA3	42	35
CC(C)c1ccc2ncnc(N[C@H]3CCn4ccnc43)c2c1	ZINC000853650912	CH	On-Demand	Anodyne	CD38	61	37
CC(C)c1ccc2ncnc(N[C@@H]3CCn4ccnc43)c2c1	ZINC000853650914	CH	On-Demand	Anodyne	CD38	61	37
CCOC(=O)c1nc(=N[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc[nH]1	ZINC000853650938	DE	On-Demand	Bother	CACNA1D	43	37
O=C(NCc1cccc(C(=O)OCc2ccccc2)c1)NC1CC(CO)C1	ZINC000853650942	FF	On-Demand	Anodyne	EPHX2	17	41
CC(C)c1ccc2ncnc(N3CC[C@H](CN4CCOC4=O)C3)c2c1	ZINC000853650946	EG	On-Demand	Anodyne	PDE3A	43	42
CC(C)c1ccc2ncnc(N3CC[C@H](CN4CCOC4=O)C3)c2c1	ZINC000853650946	EG	On-Demand	Anodyne	PDE3B	47	42
CC(C)c1ccc2ncnc(N3CC[C@@H](CN4CCOC4=O)C3)c2c1	ZINC000853650949	EG	On-Demand	Anodyne	PDE3A	43	42
CC(C)c1ccc2ncnc(N3CC[C@@H](CN4CCOC4=O)C3)c2c1	ZINC000853650949	EG	On-Demand	Anodyne	PDE3B	47	42
COC(=O)/C=C\c1ccc(N2CC[C@H]2C(F)F)c([N+](=O)[O-])c1	ZINC000853651010	DF	On-Demand	Clean	NR1H4	41	33
COC(=O)/C=C\c1ccc(N2CC[C@@H]2C(F)F)c([N+](=O)[O-])c1	ZINC000853651012	DF	On-Demand	Clean	NR1H4	41	33
C[C@@H](CCCNC(=O)OC(C)(C)C)Nc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853651102	GF	On-Demand	Anodyne	CA2	19	52
CC(C)(C)OC(=O)N1CCN(c2cnc(F)cn2)C[C@](C)(F)C1	ZINC000853651105	EE	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCN(c2cnc(F)cn2)C[C@@](C)(F)C1	ZINC000853651106	EE	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CCN(c2cc(CO)c(F)cn2)C[C@](C)(F)C1	ZINC000853651108	FE	On-Demand	Anodyne	GPR119	34	47
CC(C)(C)OC(=O)N1CCN(c2cc(CO)c(F)cn2)C[C@@](C)(F)C1	ZINC000853651109	FE	On-Demand	Anodyne	GPR119	34	47
C#Cc1cccnc1N1CCN(C(=O)OC(C)(C)C)C[C@](C)(F)C1	ZINC000853651323	EF	On-Demand	Mild	GPR119	24	42
C#Cc1cccnc1N1CCN(C(=O)OC(C)(C)C)C[C@@](C)(F)C1	ZINC000853651324	EF	On-Demand	Mild	GPR119	24	42
CCOc1ccccc1CCNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853651354	EG	On-Demand	Anodyne	HCN1	42	30
CCOc1ccccc1CCNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853651354	EG	On-Demand	Anodyne	HCN4	40	30
CCOc1ccccc1CCNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853651355	EG	On-Demand	Anodyne	HCN1	42	30
CCOc1ccccc1CCNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853651355	EG	On-Demand	Anodyne	HCN4	40	30
CCOc1ccccc1CCNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853651356	EG	On-Demand	Anodyne	HCN1	42	30
CCOc1ccccc1CCNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853651356	EG	On-Demand	Anodyne	HCN4	40	30
CCOc1ccccc1CCNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853651357	EG	On-Demand	Anodyne	HCN1	42	30
CCOc1ccccc1CCNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853651357	EG	On-Demand	Anodyne	HCN4	40	30
CCOc1ccccc1CCNC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853651360	GE	On-Demand	Anodyne	HCN1	43	33
COc1cccc(SCCSCCO)c1	ZINC000853651382	BF	On-Demand	Anodyne	MTNR1A	20	56
COc1cccc(SCCSCCO)c1	ZINC000853651382	BF	On-Demand	Anodyne	MTNR1B	23	56
CC(C)c1ccc2ncnc(NC(CF)CF)c2c1	ZINC000853651395	CG	On-Demand	Anodyne	CLK4	62	36
CC(C)c1ccc2ncnc(NC(CF)CF)c2c1	ZINC000853651395	CG	On-Demand	Anodyne	CD38	43	43
COc1nc(C)cc(C)c1CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853651421	FF	On-Demand	Reactive	CACNA1D	47	33
CCOC(=O)c1nccc(N2CC3(CC3)C2)n1	ZINC000853651427	BD	On-Demand	Anodyne	SORD	26	40
COC(=O)c1nccc(N2CCN(C(=O)OC(C)(C)C)C[C@@](C)(F)C2)n1	ZINC000853651438	FE	On-Demand	Anodyne	GPR119	28	44
COC(=O)c1nccc(N2CCN(C(=O)OC(C)(C)C)C[C@](C)(F)C2)n1	ZINC000853651439	FE	On-Demand	Anodyne	GPR119	28	44
COC(=O)Cc1ccnc(N2CCN(C(=O)OC(C)(C)C)C[C@@](C)(F)C2)c1	ZINC000853651440	GF	On-Demand	Anodyne	GPR119	32	43
COC(=O)Cc1ccnc(N2CCN(C(=O)OC(C)(C)C)C[C@](C)(F)C2)c1	ZINC000853651441	GF	On-Demand	Anodyne	GPR119	32	43
CC(C)(C)OC(=O)NC[C@@H](O)CNc1ncnc2c1ncn2-c1ccccc1	ZINC000853651456	GE	On-Demand	Anodyne	ADORA3	45	37
CC(C)(C)OC(=O)NC[C@H](O)CNc1ncnc2c1ncn2-c1ccccc1	ZINC000853651458	GE	On-Demand	Anodyne	ADORA3	45	37
CC(C)(C)OC(=O)N1CCN(c2cc(C#N)cnn2)C[C@](C)(F)C1	ZINC000853651477	EE	On-Demand	Mild	GPR119	22	42
CC(C)(C)OC(=O)N1CCN(c2cc(C#N)cnn2)C[C@@](C)(F)C1	ZINC000853651478	EE	On-Demand	Mild	GPR119	22	42
CC(=O)c1ccnc(N2CCN(C(=O)OC(C)(C)C)C[C@](C)(F)C2)c1	ZINC000853651502	FG	On-Demand	Anodyne	GPR119	31	43
CC(=O)c1ccnc(N2CCN(C(=O)OC(C)(C)C)C[C@@](C)(F)C2)c1	ZINC000853651503	FG	On-Demand	Anodyne	GPR119	31	43
Cn1c(S)nnc1CCNC(=O)NCc1ccc2c(c1)OCCCO2	ZINC000853651533	FD	On-Demand	Anodyne	NOS2	61	34
C#C[C@H](NC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000853651563	FH	On-Demand	Mild	IMDH_CRYPV	40	34
C#C[C@@H](NC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000853651564	FH	On-Demand	Mild	IMDH_CRYPV	40	34
CC(C)(C)OC(=O)NC[C@H](O)CNc1nc2ncccc2cc1C#N	ZINC000853651583	ED	On-Demand	Mild	CASR	42	38
CC(C)(C)OC(=O)NC[C@H](O)CNc1nc2ncccc2cc1C#N	ZINC000853651583	ED	On-Demand	Mild	SUCNR1	44	34
CC(C)(C)OC(=O)NC[C@@H](O)CNc1nc2ncccc2cc1C#N	ZINC000853651584	ED	On-Demand	Mild	CASR	42	38
CC(C)(C)OC(=O)NC[C@@H](O)CNc1nc2ncccc2cc1C#N	ZINC000853651584	ED	On-Demand	Mild	SUCNR1	44	34
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853651585	GE	On-Demand	Mild	LTA4H	22	42
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853651585	GE	On-Demand	Mild	HRH3	16	42
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853651585	GE	On-Demand	Mild	SIGMAR1	21	40
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853651585	GE	On-Demand	Mild	CCR3	33	40
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)cc1	ZINC000853651585	GE	On-Demand	Mild	MCHR1	25	42
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853651586	GE	On-Demand	Mild	LTA4H	22	42
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853651586	GE	On-Demand	Mild	HRH3	16	42
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853651586	GE	On-Demand	Mild	SIGMAR1	21	40
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853651586	GE	On-Demand	Mild	CCR3	33	40
N#CCOc1ccc(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC000853651586	GE	On-Demand	Mild	MCHR1	25	42
COC(=O)N(C)CCNC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1	ZINC000853651600	FF	On-Demand	Anodyne	IMDH_CRYPV	60	37
O=C(NCCc1nnc(S)n1C1CC1)NCc1ccc2c(c1)OCCCO2	ZINC000853651630	GE	On-Demand	Anodyne	NOS2	55	34
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853651647	GF	On-Demand	Anodyne	HCN1	49	36
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853651647	GF	On-Demand	Anodyne	HCN4	40	34
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853651648	GE	On-Demand	Anodyne	HCN1	50	36
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853651648	GE	On-Demand	Anodyne	HCN4	44	36
CCOc1ccccc1CCNC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853651691	GF	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1CCNC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853651691	GF	On-Demand	Anodyne	HCN4	41	32
CCOc1ccccc1CCNC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853651692	GF	On-Demand	Anodyne	HCN1	41	32
CCOc1ccccc1CCNC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853651692	GF	On-Demand	Anodyne	HCN4	41	32
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000853651714	EE	On-Demand	Mild	CPT1A	99	38
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000853651715	EE	On-Demand	Mild	CPT1A	99	38
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1CC	ZINC000853651739	FE	On-Demand	Anodyne	HCN1	48	32
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1CC	ZINC000853651739	FE	On-Demand	Anodyne	HCN4	40	32
CCOc1ccccc1CCNC(=O)NCCN(C)OC	ZINC000853651778	CD	On-Demand	Anodyne	MTNR1A	57	46
CCOc1ccccc1CCNC(=O)NCCN(C)OC	ZINC000853651778	CD	On-Demand	Anodyne	HCN1	46	31
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853651788	EE	On-Demand	Mild	CCR5	28	54
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853651789	EE	On-Demand	Mild	CCR5	28	54
Cn1c(S)nnc1CCNC(=O)NC(C)(C)c1cccc(C(F)(F)F)c1	ZINC000853651798	GF	On-Demand	Anodyne	IMDH_CRYPV	49	34
C[C@@H]1CCCN(C(=O)NCc2ccc(OCC#N)cc2)[C@H]1CCO	ZINC000853651829	EE	On-Demand	Mild	LGMN	60	35
C[C@@H]1CCCN(C(=O)NCc2ccc(OCC#N)cc2)[C@@H]1CCO	ZINC000853651830	EE	On-Demand	Mild	LGMN	60	35
CON(C)CCNC(=O)NCc1ccc2c(c1)OCCCO2	ZINC000853651842	DD	On-Demand	Anodyne	NOS2	44	32
CC[C@H](C)N(CC)C(=O)NCc1ccc(OCC#N)cc1	ZINC000853651872	CF	On-Demand	Mild	PDS	46	37
c1cncc(-c2nc(N3CCC[C@@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651906	GF	On-Demand	Anodyne	PIK3CA	40	49
c1cncc(-c2nc(N3CCC[C@@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651906	GF	On-Demand	Anodyne	PRKD1	15	40
c1cncc(-c2nc(N3CCC[C@@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651906	GF	On-Demand	Anodyne	MTOR	42	49
c1cncc(-c2nc(N3CCC[C@@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651906	GF	On-Demand	Anodyne	PIK3CG	18	42
c1cncc(-c2nc(N3CCC[C@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651907	GF	On-Demand	Anodyne	PIK3CA	40	49
c1cncc(-c2nc(N3CCC[C@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651907	GF	On-Demand	Anodyne	PRKD1	15	40
c1cncc(-c2nc(N3CCC[C@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651907	GF	On-Demand	Anodyne	MTOR	42	49
c1cncc(-c2nc(N3CCC[C@H](N4CCOCC4)C3)c3ccccc3n2)c1	ZINC000853651907	GF	On-Demand	Anodyne	PIK3CG	18	42
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1C	ZINC000853651914	ED	On-Demand	Anodyne	HCN1	49	34
CCOc1ccccc1CCNC(=O)NCCc1nnc(S)n1C	ZINC000853651914	ED	On-Demand	Anodyne	HCN4	40	31
COC[C@H](NC(=O)NCc1ccc(OCC#N)cc1)c1cccc(OC)c1	ZINC000853651928	FF	On-Demand	Mild	PTGER3	19	40
COC[C@H](NC(=O)NCc1ccc(OCC#N)cc1)c1cccc(OC)c1	ZINC000853651928	FF	On-Demand	Mild	PDS	51	40
COC[C@@H](NC(=O)NCc1ccc(OCC#N)cc1)c1cccc(OC)c1	ZINC000853651929	FF	On-Demand	Mild	PTGER3	19	40
COC[C@@H](NC(=O)NCc1ccc(OCC#N)cc1)c1cccc(OC)c1	ZINC000853651929	FF	On-Demand	Mild	PDS	51	40
COC(=O)c1nccc(N2CC3(CC3)C2)n1	ZINC000853651932	BC	On-Demand	Anodyne	SORD	27	42
COC(=O)/C=C\c1ccc(N2CC(CN(C)C)C2)c([N+](=O)[O-])c1	ZINC000853651933	DD	On-Demand	Clean	NR1H4	40	34
CS(=O)(=O)C1CN(C(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853652023	DC	On-Demand	Mild	MMP13	29	40
CS(=O)(=O)C1CN(C(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853652023	DC	On-Demand	Mild	ADAM17	42	37
CS(=O)(=O)C1CN(C(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853652023	DC	On-Demand	Mild	MMP1	20	40
CC(C)c1ccc2ncnc(N3CC4(CC4)C3)c2c1	ZINC000853652063	CG	On-Demand	Anodyne	PDE3B	42	39
CN(C)CC1CN(c2ccc([N+](=O)[O-])cc2)C1	ZINC000853652070	BD	On-Demand	Bother	SSTR1	38	41
CC(C)n1ncnc1COc1cccc(C(N)=O)c1	ZINC000853652073	CD	On-Demand	Anodyne	ACR	18	40
CO[C@@H](COc1cccc(C(N)=O)c1)[C@H]1CCOC1	ZINC000853652095	CD	On-Demand	Anodyne	KCNH2	42	37
CC(C)(C)OC(=O)NC[C@H](O)CNc1c(Br)cccc1[N+](=O)[O-]	ZINC000853652099	GF	On-Demand	Bother	COLA	69	39
CC(C)(C)OC(=O)NC[C@@H](O)CNc1c(Br)cccc1[N+](=O)[O-]	ZINC000853652101	GF	On-Demand	Bother	COLA	69	39
CO[C@@H](COc1cccc(C(N)=O)c1)[C@@H]1CCOC1	ZINC000853652104	CD	On-Demand	Anodyne	KCNH2	42	37
N#CCOc1ccc(CNC(=O)N[C@H]2C[C@H](O)C2)cc1	ZINC000853652114	CC	On-Demand	Mild	EPHX2	15	40
c1ccc2c(N3CCC[C@@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652127	GF	On-Demand	Anodyne	PIK3CA	44	42
c1ccc2c(N3CCC[C@@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652127	GF	On-Demand	Anodyne	PRKD1	15	43
c1ccc2c(N3CCC[C@@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652127	GF	On-Demand	Anodyne	MTOR	51	39
c1ccc2c(N3CCC[C@@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652127	GF	On-Demand	Anodyne	PIK3CG	21	42
c1ccc2c(N3CCC[C@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652128	GF	On-Demand	Anodyne	PIK3CA	44	42
c1ccc2c(N3CCC[C@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652128	GF	On-Demand	Anodyne	PRKD1	15	43
c1ccc2c(N3CCC[C@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652128	GF	On-Demand	Anodyne	MTOR	51	39
c1ccc2c(N3CCC[C@H](N4CCOCC4)C3)nc(-c3ccncc3)nc2c1	ZINC000853652128	GF	On-Demand	Anodyne	PIK3CG	21	42
N#CCOc1ccc(CNC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853652147	FD	On-Demand	Mild	CASR	42	38
CN(C)C(=O)c1ccc(OCCC2CCC2)cc1	ZINC000853652169	BF	On-Demand	Anodyne	GRIN2B	16	47
CN(C)C(=O)c1ccc(OCCC2CCC2)cc1	ZINC000853652169	BF	On-Demand	Anodyne	PLA2G4B	51	36
CN(C)C(=O)c1ccc(OCCC2CCC2)cc1	ZINC000853652169	BF	On-Demand	Anodyne	LSS	28	42
CN(C)C(=O)c1ccc(OCCC2CCC2)cc1	ZINC000853652169	BF	On-Demand	Anodyne	HPGD	20	42
CN(C)C(=O)c1ccc(OCCC2SCCS2)cc1	ZINC000853652198	CF	On-Demand	Anodyne	LSS	22	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=C2CCOc3ccccc32)CC1	ZINC000853652205	GD	On-Demand	Mild	P2RY12	123	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=C2CCOc3ccccc32)CC1	ZINC000853652206	GD	On-Demand	Mild	P2RY12	123	40
C[C@@H](CCNC(=O)NCCS(C)(=O)=O)N(C)C	ZINC000853652225	CB	On-Demand	Anodyne	CHRNA4	19	40
COc1cccc(C2(NC(=O)NCCS(C)(=O)=O)CCC2)c1	ZINC000853652254	ED	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C2(NC(=O)NCCS(C)(=O)=O)CCC2)c1	ZINC000853652254	ED	On-Demand	Anodyne	MTNR1A	50	37
COc1cccc(C2(NC(=O)NCCS(C)(=O)=O)CCC2)c1	ZINC000853652254	ED	On-Demand	Anodyne	MTNR1B	45	37
CC[C@@H](O)CNC(=O)NCc1ccc(OCC#N)cc1	ZINC000853652255	CD	On-Demand	Mild	PDS	50	38
COC(=O)C1(COc2cccc(C(N)=O)c2)CC1	ZINC000853652270	BD	On-Demand	Anodyne	DRD4	41	31
COC(=O)C1(COc2cccc(C(N)=O)c2)CC1	ZINC000853652270	BD	On-Demand	Anodyne	KCNH2	42	39
NC(=O)c1cccc(OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853652299	BE	On-Demand	Anodyne	KCNH2	48	44
NC(=O)c1cccc(OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853652299	BE	On-Demand	Anodyne	CHEK2	39	40
NC(=O)c1cccc(OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853652299	BE	On-Demand	Anodyne	CHRNA10	42	57
NC(=O)c1cccc(OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853652299	BE	On-Demand	Anodyne	ACR	22	40
NC(=O)c1cccc(OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853652300	BE	On-Demand	Anodyne	KCNH2	48	44
NC(=O)c1cccc(OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853652300	BE	On-Demand	Anodyne	CHEK2	39	40
NC(=O)c1cccc(OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853652300	BE	On-Demand	Anodyne	CHRNA10	42	57
NC(=O)c1cccc(OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853652300	BE	On-Demand	Anodyne	ACR	22	40
NC(=O)c1cccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853652301	BE	On-Demand	Anodyne	KCNH2	48	44
NC(=O)c1cccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853652301	BE	On-Demand	Anodyne	CHEK2	39	40
NC(=O)c1cccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853652301	BE	On-Demand	Anodyne	CHRNA10	42	57
NC(=O)c1cccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853652301	BE	On-Demand	Anodyne	ACR	22	40
CC(C)n1ncnc1CON=C1CCOc2ccccc21	ZINC000853652302	CF	On-Demand	Mild	PIK3CB	16	48
CN(C)C(=O)c1ccc(OCCC2(O)CCC2)cc1	ZINC000853652305	CE	On-Demand	Anodyne	PLA2G4B	56	36
CCn1ncnc1COc1cccc(C(N)=O)c1	ZINC000853652324	BC	On-Demand	Anodyne	KCNH2	40	36
CCn1ncnc1COc1cccc(C(N)=O)c1	ZINC000853652324	BC	On-Demand	Anodyne	ACR	18	41
NC(=O)c1cccc(OCCC2CCC2)c1	ZINC000853652330	BE	On-Demand	Anodyne	KCNH2	47	43
NC(=O)c1cccc(OCCC2CCC2)c1	ZINC000853652330	BE	On-Demand	Anodyne	GRIN2B	18	43
NC(=O)c1cccc(OCCC2CCC2)c1	ZINC000853652330	BE	On-Demand	Anodyne	CHEK2	45	43
NC(=O)c1cccc(OCCC2CCC2)c1	ZINC000853652330	BE	On-Demand	Anodyne	PLA2G4B	20	40
NC(=O)c1cccc(OCCC2CCC2)c1	ZINC000853652330	BE	On-Demand	Anodyne	CHRNA10	38	56
NC(=O)c1cccc(OCCC2CCC2)c1	ZINC000853652330	BE	On-Demand	Anodyne	PLAU	20	40
CN(C)C(=O)c1ccc(OCCOC(F)F)cc1	ZINC000853652344	CE	On-Demand	Anodyne	PLA2G4B	67	38
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652365	ED	On-Demand	Anodyne	KCNH2	40	36
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652365	ED	On-Demand	Anodyne	CHRNA10	25	43
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652365	ED	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652366	ED	On-Demand	Anodyne	KCNH2	40	36
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652366	ED	On-Demand	Anodyne	CHRNA10	25	43
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652366	ED	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCS(C)(=O)=O	ZINC000853652393	FC	On-Demand	Anodyne	GPR119	27	40
CCC(CC)COc1ccc(C(=O)N(C)C)cc1	ZINC000853652397	BG	On-Demand	Anodyne	PDS	58	40
NC(=O)c1cccc(OCCO[C@H]2CC2(F)F)c1	ZINC000853652401	CD	On-Demand	Anodyne	KCNH2	42	38
NC(=O)c1cccc(OCCO[C@@H]2CC2(F)F)c1	ZINC000853652402	CD	On-Demand	Anodyne	KCNH2	42	38
COC[C@@H](COc1cccc(C(N)=O)c1)OC	ZINC000853652408	BC	On-Demand	Anodyne	KCNH2	40	37
COC[C@@H](COc1cccc(C(N)=O)c1)OC	ZINC000853652408	BC	On-Demand	Anodyne	CHEK2	15	45
COC[C@@H](COc1cccc(C(N)=O)c1)OC	ZINC000853652408	BC	On-Demand	Anodyne	PDS	83	44
N#CCOc1ccc(CNC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853652409	EH	On-Demand	Mild	LGMN	40	32
N#CCOc1ccc(CNC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853652410	EH	On-Demand	Mild	LGMN	40	32
N#CCC1(COc2cccc(C(N)=O)c2)CC1	ZINC000853652452	BD	On-Demand	Mild	KCNH2	40	37
CN(C)C(=O)c1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853652465	DF	On-Demand	Anodyne	PLA2G4B	61	36
CN(C)C(=O)c1ccc(OCCO[Si](C)(C)C(C)(C)C)cc1	ZINC000853652472	DH	On-Demand	Reactive	PLA2G4B	41	35
CN(C)C(=O)c1ccc(OCCO[Si](C)(C)C(C)(C)C)cc1	ZINC000853652472	DH	On-Demand	Reactive	MT-ND1	18	49
NC(=O)c1cccc(OCCCC2CCC2)c1	ZINC000853652477	BF	On-Demand	Anodyne	KCNH2	46	42
NC(=O)c1cccc(OCCCC2CCC2)c1	ZINC000853652477	BF	On-Demand	Anodyne	PLA2G4B	26	42
NC(=O)c1cccc(OCCCC2CCC2)c1	ZINC000853652477	BF	On-Demand	Anodyne	EPHX2	15	40
NC(=O)c1cccc(OCCCC2CCC2)c1	ZINC000853652477	BF	On-Demand	Anodyne	CHRNA10	37	55
NC(=O)c1cccc(OCCCC2CCC2)c1	ZINC000853652477	BF	On-Demand	Anodyne	ACR	30	41
C#CCOCCOc1cccc(C(N)=O)c1	ZINC000853652486	BC	On-Demand	Mild	CHEK2	31	40
C#CCOCCOc1cccc(C(N)=O)c1	ZINC000853652486	BC	On-Demand	Mild	PLA2G4B	22	40
C#CCOCCOc1ccc(C(=O)N(C)C)cc1	ZINC000853652488	BD	On-Demand	Mild	PLA2G4B	62	36
C#CCOCCOc1ccc(C(=O)N(C)C)cc1	ZINC000853652488	BD	On-Demand	Mild	ESRRG	43	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652511	EC	On-Demand	Anodyne	KCNH2	42	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652511	EC	On-Demand	Anodyne	P2RY12	110	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652511	EC	On-Demand	Anodyne	TRY2_BOVIN	85	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652511	EC	On-Demand	Anodyne	TRY1_BOVIN	15	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652511	EC	On-Demand	Anodyne	ST14	47	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652512	EC	On-Demand	Anodyne	KCNH2	42	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652512	EC	On-Demand	Anodyne	P2RY12	110	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652512	EC	On-Demand	Anodyne	TRY2_BOVIN	85	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652512	EC	On-Demand	Anodyne	TRY1_BOVIN	15	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(N)=O)c2)CC1	ZINC000853652512	EC	On-Demand	Anodyne	ST14	47	44
NC(=O)c1cccc(OC[C@H]2COCCO2)c1	ZINC000853652520	BC	On-Demand	Anodyne	KCNH2	42	38
NC(=O)c1cccc(OC[C@@H]2COCCO2)c1	ZINC000853652521	BC	On-Demand	Anodyne	KCNH2	42	38
CCCn1ncnc1COc1ccc(C(=O)N(C)C)cc1	ZINC000853652522	CD	On-Demand	Anodyne	PLA2G4B	45	35
CC1(COc2cccc(C(N)=O)c2)CCC1	ZINC000853652525	BE	On-Demand	Anodyne	KCNH2	43	39
CN(C(=O)NCCS(C)(=O)=O)[C@@H](CO)Cc1ccccc1	ZINC000853652526	DC	On-Demand	Anodyne	MME	46	43
CN(C(=O)NCCS(C)(=O)=O)[C@@H](CO)Cc1ccccc1	ZINC000853652526	DC	On-Demand	Anodyne	NPY5R	20	43
CN(C(=O)NCCS(C)(=O)=O)[C@H](CO)Cc1ccccc1	ZINC000853652527	DC	On-Demand	Anodyne	MME	46	43
CN(C(=O)NCCS(C)(=O)=O)[C@H](CO)Cc1ccccc1	ZINC000853652527	DC	On-Demand	Anodyne	NPY5R	20	43
CN(C)C(=O)c1ccc(OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853652550	CF	On-Demand	Anodyne	SHC	33	41
CN(C)C(=O)c1ccc(OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853652550	CF	On-Demand	Anodyne	LSS	19	41
CN(C)C(=O)c1ccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853652551	CF	On-Demand	Anodyne	SHC	33	41
CN(C)C(=O)c1ccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853652551	CF	On-Demand	Anodyne	LSS	19	41
CN(C)C(=O)c1ccc(OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853652552	CF	On-Demand	Anodyne	SHC	33	41
CN(C)C(=O)c1ccc(OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853652552	CF	On-Demand	Anodyne	LSS	19	41
NC(=O)c1cccc(OC[C@@H]2CC[C@H]3C[C@@H]3C2)c1	ZINC000853652556	BF	On-Demand	Anodyne	KCNH2	47	43
NC(=O)c1cccc(OC[C@@H]2CC[C@H]3C[C@@H]3C2)c1	ZINC000853652556	BF	On-Demand	Anodyne	CHEK2	35	40
NC(=O)c1cccc(OC[C@@H]2CC[C@H]3C[C@@H]3C2)c1	ZINC000853652556	BF	On-Demand	Anodyne	CHRNA10	45	56
NC(=O)c1cccc(OC[C@@H]2CC[C@@H]3C[C@H]3C2)c1	ZINC000853652557	BF	On-Demand	Anodyne	KCNH2	47	43
NC(=O)c1cccc(OC[C@@H]2CC[C@@H]3C[C@H]3C2)c1	ZINC000853652557	BF	On-Demand	Anodyne	CHEK2	35	40
NC(=O)c1cccc(OC[C@@H]2CC[C@@H]3C[C@H]3C2)c1	ZINC000853652557	BF	On-Demand	Anodyne	CHRNA10	45	56
NC(=O)c1cccc(OC[C@@H]2CC[C@H]3C[C@H]3C2)c1	ZINC000853652558	BF	On-Demand	Anodyne	KCNH2	47	43
NC(=O)c1cccc(OC[C@@H]2CC[C@H]3C[C@H]3C2)c1	ZINC000853652558	BF	On-Demand	Anodyne	CHEK2	35	40
NC(=O)c1cccc(OC[C@@H]2CC[C@H]3C[C@H]3C2)c1	ZINC000853652558	BF	On-Demand	Anodyne	CHRNA10	45	56
NC(=O)c1cccc(OC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1	ZINC000853652559	BF	On-Demand	Anodyne	KCNH2	47	43
NC(=O)c1cccc(OC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1	ZINC000853652559	BF	On-Demand	Anodyne	CHEK2	35	40
NC(=O)c1cccc(OC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1	ZINC000853652559	BF	On-Demand	Anodyne	CHRNA10	45	56
Cc1nc(N2CCC[C@@H](N3CCOCC3)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853652565	GE	On-Demand	Anodyne	MTOR	23	48
Cc1nc(N2CCC[C@H](N3CCOCC3)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853652566	GE	On-Demand	Anodyne	MTOR	23	48
NC(=O)c1cccc(OCC23CCC(CC2)C3)c1	ZINC000853652571	BF	On-Demand	Anodyne	KCNH2	47	44
NC(=O)c1cccc(OCCC2(O)CCC2)c1	ZINC000853652580	BD	On-Demand	Anodyne	KCNH2	42	38
NC(=O)c1cccc(OCCC2(O)CCC2)c1	ZINC000853652580	BD	On-Demand	Anodyne	PLA2G4B	21	40
Cn1c(S)nnc1CCNC(=O)NCCCCCc1ccccc1	ZINC000853652618	EE	On-Demand	Anodyne	SCNN1A	40	38
Cn1c(S)nnc1CCNC(=O)NCCCCCc1ccccc1	ZINC000853652618	EE	On-Demand	Anodyne	SCN2A	17	40
Cn1c(S)nnc1CCNC(=O)NCCCCCc1ccccc1	ZINC000853652618	EE	On-Demand	Anodyne	FAAH	65	40
Cn1c(S)nnc1CCNC(=O)NCCCCCc1ccccc1	ZINC000853652618	EE	On-Demand	Anodyne	CES1	63	35
Cn1c(S)nnc1CCNC(=O)NCCCCCc1ccccc1	ZINC000853652618	EE	On-Demand	Anodyne	AMP1_PLAFQ	22	42
Cn1c(S)nnc1CCNC(=O)NCCCCCc1ccccc1	ZINC000853652618	EE	On-Demand	Anodyne	CES1D	43	31
CS(=O)(=O)N1CC[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652620	CC	On-Demand	Anodyne	F2	15	42
CS(=O)(=O)N1CC[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652620	CC	On-Demand	Anodyne	KCNH2	44	40
CS(=O)(=O)N1CC[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652620	CC	On-Demand	Anodyne	TRY2_BOVIN	42	33
CS(=O)(=O)N1CC[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652620	CC	On-Demand	Anodyne	CHEK2	37	41
CS(=O)(=O)N1CC[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652620	CC	On-Demand	Anodyne	CHRNA10	52	50
CS(=O)(=O)N1CC[C@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652620	CC	On-Demand	Anodyne	ST14	54	33
CS(=O)(=O)N1CC[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652621	CC	On-Demand	Anodyne	F2	15	42
CS(=O)(=O)N1CC[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652621	CC	On-Demand	Anodyne	KCNH2	44	40
CS(=O)(=O)N1CC[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652621	CC	On-Demand	Anodyne	TRY2_BOVIN	42	33
CS(=O)(=O)N1CC[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652621	CC	On-Demand	Anodyne	CHEK2	37	41
CS(=O)(=O)N1CC[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652621	CC	On-Demand	Anodyne	CHRNA10	52	50
CS(=O)(=O)N1CC[C@@H](COc2cccc(C(N)=O)c2)C1	ZINC000853652621	CC	On-Demand	Anodyne	ST14	54	33
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc3ncccc23)C1	ZINC000853652629	EG	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc3ncccc23)C1	ZINC000853652630	EG	On-Demand	Anodyne	GPR119	34	41
NC(=O)c1cccc(OCCC2SCCS2)c1	ZINC000853652651	CE	On-Demand	Anodyne	KCNH2	44	40
NC(=O)c1cccc(OCC2CC=CC2)c1	ZINC000853652652	BE	On-Demand	Anodyne	KCNH2	45	42
NC(=O)c1cccc(OCC2CC=CC2)c1	ZINC000853652652	BE	On-Demand	Anodyne	CHRNA10	45	59
NC(=O)c1cccc(OCC2CC=CC2)c1	ZINC000853652652	BE	On-Demand	Anodyne	ACR	23	41
COc1cccc(SCCOc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652654	EH	On-Demand	Anodyne	MTNR1A	53	55
COc1cccc(SCCOc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652654	EH	On-Demand	Anodyne	MTNR1B	52	55
COc1cccc(SCCOc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652654	EH	On-Demand	Anodyne	PLA2G4B	50	34
COc1cccc(SCCOc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652654	EH	On-Demand	Anodyne	HSD17B2	24	43
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	ALOX5	26	50
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	ACHE	15	42
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	MAOB	70	40
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	PLA2G4B	80	45
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	GYS1	47	39
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	CYP26A1	19	44
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	FFAR1	70	50
CCCOc1cccc(COc2ccc(C(=O)N(C)C)cc2)c1	ZINC000853652666	DH	On-Demand	Anodyne	PDS	56	32
NC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853652668	BD	On-Demand	Anodyne	KCNH2	40	37
NC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853652668	BD	On-Demand	Anodyne	TRY1_BOVIN	16	42
NC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853652668	BD	On-Demand	Anodyne	CHEK2	15	41
NC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853652668	BD	On-Demand	Anodyne	PLA2G4B	26	41
NC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853652668	BD	On-Demand	Anodyne	ACR	40	41
NC(=O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652672	DE	On-Demand	Anodyne	KCNH2	46	44
NC(=O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652672	DE	On-Demand	Anodyne	GRIN2B	47	44
NC(=O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652672	DE	On-Demand	Anodyne	CHEK2	35	55
NC(=O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652672	DE	On-Demand	Anodyne	CHRNA10	55	51
NC(=O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652672	DE	On-Demand	Anodyne	ST14	35	40
NC(=O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652672	DE	On-Demand	Anodyne	L3MBTL3	45	38
NC(=O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652673	DE	On-Demand	Anodyne	KCNH2	46	44
NC(=O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652673	DE	On-Demand	Anodyne	GRIN2B	47	44
NC(=O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652673	DE	On-Demand	Anodyne	CHEK2	35	55
NC(=O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652673	DE	On-Demand	Anodyne	CHRNA10	55	51
NC(=O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652673	DE	On-Demand	Anodyne	ST14	35	40
NC(=O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853652673	DE	On-Demand	Anodyne	L3MBTL3	45	38
CN(C)C(=O)c1ccc(OCC[C@@H]2CCc3ccccc32)cc1	ZINC000853652682	DH	On-Demand	Anodyne	PPARG	38	43
CN(C)C(=O)c1ccc(OCC[C@@H]2CCc3ccccc32)cc1	ZINC000853652682	DH	On-Demand	Anodyne	LTA4H	25	41
CN(C)C(=O)c1ccc(OCC[C@@H]2CCc3ccccc32)cc1	ZINC000853652682	DH	On-Demand	Anodyne	NQO2	21	45
CN(C)C(=O)c1ccc(OCC[C@@H]2CCc3ccccc32)cc1	ZINC000853652682	DH	On-Demand	Anodyne	PPARD	55	43
CN(C)C(=O)c1ccc(OCC[C@@H]2CCc3ccccc32)cc1	ZINC000853652682	DH	On-Demand	Anodyne	PLA2G4B	40	32
CN(C)C(=O)c1ccc(OCC[C@H]2CCc3ccccc32)cc1	ZINC000853652683	DH	On-Demand	Anodyne	PPARG	38	43
CN(C)C(=O)c1ccc(OCC[C@H]2CCc3ccccc32)cc1	ZINC000853652683	DH	On-Demand	Anodyne	LTA4H	25	41
CN(C)C(=O)c1ccc(OCC[C@H]2CCc3ccccc32)cc1	ZINC000853652683	DH	On-Demand	Anodyne	NQO2	21	45
CN(C)C(=O)c1ccc(OCC[C@H]2CCc3ccccc32)cc1	ZINC000853652683	DH	On-Demand	Anodyne	PPARD	55	43
CN(C)C(=O)c1ccc(OCC[C@H]2CCc3ccccc32)cc1	ZINC000853652683	DH	On-Demand	Anodyne	PLA2G4B	40	32
O=C(NCCCCCc1ccccc1)NCCc1nnc(S)n1C1CC1	ZINC000853652684	FG	On-Demand	Anodyne	CES1	41	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)NC)cc2)CC1	ZINC000853652696	FD	On-Demand	Anodyne	P2RY12	127	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)NC)cc2)CC1	ZINC000853652697	FD	On-Demand	Anodyne	P2RY12	127	44
CN(C)C(=O)c1ccc(OCCCC2CCC2)cc1	ZINC000853652707	CG	On-Demand	Anodyne	GRIN2B	15	41
CN(C)C(=O)c1ccc(OCCCC2CCC2)cc1	ZINC000853652707	CG	On-Demand	Anodyne	HRH3	33	41
CN(C)C(=O)c1ccc(OCCCC2CCC2)cc1	ZINC000853652707	CG	On-Demand	Anodyne	PLA2G4B	63	38
CN(C)C(=O)c1ccc(OCCCC2CCC2)cc1	ZINC000853652707	CG	On-Demand	Anodyne	LSS	35	44
NC(=O)c1cccc(OCC[C@@H]2CCc3ccccc32)c1	ZINC000853652708	CG	On-Demand	Anodyne	PPARG	41	43
NC(=O)c1cccc(OCC[C@@H]2CCc3ccccc32)c1	ZINC000853652708	CG	On-Demand	Anodyne	KCNH2	44	48
NC(=O)c1cccc(OCC[C@@H]2CCc3ccccc32)c1	ZINC000853652708	CG	On-Demand	Anodyne	NQO2	19	42
NC(=O)c1cccc(OCC[C@@H]2CCc3ccccc32)c1	ZINC000853652708	CG	On-Demand	Anodyne	PPARD	55	43
NC(=O)c1cccc(OCC[C@H]2CCc3ccccc32)c1	ZINC000853652709	CG	On-Demand	Anodyne	PPARG	41	43
NC(=O)c1cccc(OCC[C@H]2CCc3ccccc32)c1	ZINC000853652709	CG	On-Demand	Anodyne	KCNH2	44	48
NC(=O)c1cccc(OCC[C@H]2CCc3ccccc32)c1	ZINC000853652709	CG	On-Demand	Anodyne	NQO2	19	42
NC(=O)c1cccc(OCC[C@H]2CCc3ccccc32)c1	ZINC000853652709	CG	On-Demand	Anodyne	PPARD	55	43
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	ALOX5	23	52
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	MAOB	22	43
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	PPARA	26	42
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	LTA4H	57	44
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	PLA2G4B	78	43
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	LSS	23	40
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	ESRRG	51	39
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	FAAH	17	40
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	TAAR1	15	41
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	FFAR1	38	41
CN(C)C(=O)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853652719	CF	On-Demand	Anodyne	LIMK2	21	44
CCCn1ncnc1COc1cccc(C(N)=O)c1	ZINC000853652724	CD	On-Demand	Anodyne	PLA2G4B	26	40
NC(=O)c1cccc(OCc2cc(C3CC3)no2)c1	ZINC000853652741	CE	On-Demand	Anodyne	KCNH2	43	39
NC(=O)c1cccc(OCc2cc(C3CC3)no2)c1	ZINC000853652741	CE	On-Demand	Anodyne	CPT1A	51	43
NC(=O)c1cccc(OCc2cc(C3CC3)no2)c1	ZINC000853652741	CE	On-Demand	Anodyne	ACR	18	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853652742	GF	On-Demand	Mild	ADAM17	17	43
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853652742	GF	On-Demand	Mild	GPR119	16	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853652743	GF	On-Demand	Mild	ADAM17	17	43
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2ccc(OCC#N)cc2)C1	ZINC000853652743	GF	On-Demand	Mild	GPR119	16	48
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	SIGMAR1	19	47
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	SCN2A	21	45
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	S1PR3	18	45
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	MTNR1A	44	46
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	MTNR1B	42	46
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	FAAH	66	46
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	S1PR2	25	45
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	CES1	64	39
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	AMP1_PLAFQ	24	47
CON(C)CCNC(=O)NCCCCCc1ccccc1	ZINC000853652746	CE	On-Demand	Anodyne	CRTM	42	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)N(C)C)cc2)CC1	ZINC000853652753	GD	On-Demand	Anodyne	P2RY12	54	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)N(C)C)cc2)CC1	ZINC000853652754	GD	On-Demand	Anodyne	P2RY12	54	38
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCS(C)(=O)=O	ZINC000853652761	FF	On-Demand	Anodyne	MME	78	44
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCS(C)(=O)=O	ZINC000853652761	FF	On-Demand	Anodyne	FCER2	57	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCS(C)(=O)=O	ZINC000853652761	FF	On-Demand	Anodyne	CAPN1	42	35
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCS(C)(=O)=O	ZINC000853652761	FF	On-Demand	Anodyne	CAPN2	54	33
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCS(C)(=O)=O	ZINC000853652761	FF	On-Demand	Anodyne	ACE2	43	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCS(C)(=O)=O	ZINC000853652761	FF	On-Demand	Anodyne	PTGES	19	41
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCCCC1	ZINC000853652765	CF	On-Demand	Anodyne	KCNH2	44	40
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCCCC1	ZINC000853652765	CF	On-Demand	Anodyne	FAAH	21	48
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCCCC1	ZINC000853652765	CF	On-Demand	Anodyne	CHRNA10	25	50
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCCC1	ZINC000853652774	CE	On-Demand	Anodyne	KCNH2	45	40
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCCC1	ZINC000853652774	CE	On-Demand	Anodyne	FAAH	18	46
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCCC1	ZINC000853652774	CE	On-Demand	Anodyne	CHRNA10	26	51
N#CCOc1ccc(CNC(=O)N2CCC[C@@H](N3CCOCC3)CC2)cc1	ZINC000853652782	FD	On-Demand	Mild	L3MBTL3	66	37
N#CCOc1ccc(CNC(=O)N2CCC[C@H](N3CCOCC3)CC2)cc1	ZINC000853652783	FD	On-Demand	Mild	L3MBTL3	66	37
C#CCOCCOc1cccc(C(=O)NC)c1	ZINC000853652786	BD	On-Demand	Mild	DRD4	41	32
C#CCOCCOc1cccc(C(=O)NC)c1	ZINC000853652786	BD	On-Demand	Mild	PLA2G4B	25	40
COC[C@@H](NC(=O)NCCS(C)(=O)=O)c1cccc(OC)c1	ZINC000853652798	EC	On-Demand	Anodyne	MTNR1A	52	41
COC[C@@H](NC(=O)NCCS(C)(=O)=O)c1cccc(OC)c1	ZINC000853652798	EC	On-Demand	Anodyne	MTNR1B	50	41
COC[C@H](NC(=O)NCCS(C)(=O)=O)c1cccc(OC)c1	ZINC000853652799	EC	On-Demand	Anodyne	MTNR1A	52	41
COC[C@H](NC(=O)NCCS(C)(=O)=O)c1cccc(OC)c1	ZINC000853652799	EC	On-Demand	Anodyne	MTNR1B	50	41
C[C@@H]1CCCC[C@H]1COc1ccc(C(=O)N(C)C)cc1	ZINC000853652825	CH	On-Demand	Anodyne	SHC	32	46
C[C@@H]1CCCC[C@H]1COc1ccc(C(=O)N(C)C)cc1	ZINC000853652825	CH	On-Demand	Anodyne	LSS	16	46
C[C@@H]1CCCC[C@@H]1COc1ccc(C(=O)N(C)C)cc1	ZINC000853652826	CH	On-Demand	Anodyne	SHC	32	46
C[C@@H]1CCCC[C@@H]1COc1ccc(C(=O)N(C)C)cc1	ZINC000853652826	CH	On-Demand	Anodyne	LSS	16	46
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	AVPR1A	19	47
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	GRIN2B	39	41
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	HRH3	19	40
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	SIGMAR1	16	44
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	CHEK2	21	47
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	SLC18A3	17	46
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	MCHR1	18	40
CN(C)C(=O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652852	FF	On-Demand	Anodyne	L3MBTL3	57	36
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	AVPR1A	19	47
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	GRIN2B	39	41
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	HRH3	19	40
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	SIGMAR1	16	44
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	CHEK2	21	47
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	SLC18A3	17	46
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	MCHR1	18	40
CN(C)C(=O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853652853	FF	On-Demand	Anodyne	L3MBTL3	57	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652855	FD	On-Demand	Anodyne	DRD4	45	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652855	FD	On-Demand	Anodyne	P2RY12	176	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652855	FD	On-Demand	Anodyne	TRY2_BOVIN	77	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652855	FD	On-Demand	Anodyne	ST14	26	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652856	FD	On-Demand	Anodyne	DRD4	45	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652856	FD	On-Demand	Anodyne	P2RY12	176	45
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652856	FD	On-Demand	Anodyne	TRY2_BOVIN	77	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC)c2)CC1	ZINC000853652856	FD	On-Demand	Anodyne	ST14	26	42
CCN1CC[C@@H](N(CC)C(=O)NCCS(C)(=O)=O)C1	ZINC000853652859	CC	On-Demand	Anodyne	CCR5	16	42
CCN1CC[C@H](N(CC)C(=O)NCCS(C)(=O)=O)C1	ZINC000853652860	CC	On-Demand	Anodyne	CCR5	16	42
CN(C)C(=O)c1ccc(OC[C@@H]2CC[C@@H]3C[C@H]3C2)cc1	ZINC000853652871	CG	On-Demand	Anodyne	SHC	23	40
CN(C)C(=O)c1ccc(OC[C@@H]2CC[C@H]3C[C@@H]3C2)cc1	ZINC000853652872	CG	On-Demand	Anodyne	SHC	23	40
CN(C)C(=O)c1ccc(OC[C@@H]2CC[C@H]3C[C@H]3C2)cc1	ZINC000853652873	CG	On-Demand	Anodyne	SHC	23	40
CN(C)C(=O)c1ccc(OC[C@@H]2CC[C@@H]3C[C@@H]3C2)cc1	ZINC000853652874	CG	On-Demand	Anodyne	SHC	23	40
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCCCc2ccccc2)C1	ZINC000853652877	GG	On-Demand	Anodyne	FKBP1A	34	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCCCc2ccccc2)C1	ZINC000853652877	GG	On-Demand	Anodyne	OPRM1	19	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCCCc2ccccc2)C1	ZINC000853652877	GG	On-Demand	Anodyne	PREP	60	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCCCc2ccccc2)C1	ZINC000853652878	GG	On-Demand	Anodyne	FKBP1A	34	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCCCc2ccccc2)C1	ZINC000853652878	GG	On-Demand	Anodyne	OPRM1	19	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCCCc2ccccc2)C1	ZINC000853652878	GG	On-Demand	Anodyne	PREP	60	37
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCC1	ZINC000853652893	BD	On-Demand	Anodyne	KCNH2	45	40
CO[C@@H](COc1cccc(C(N)=O)c1)C1CCC1	ZINC000853652893	BD	On-Demand	Anodyne	CHRNA10	26	51
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3ncccc23)CC1	ZINC000853652907	FE	On-Demand	Anodyne	P2RY12	66	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3ncccc23)CC1	ZINC000853652907	FE	On-Demand	Anodyne	NR5A1	25	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3ncccc23)CC1	ZINC000853652908	FE	On-Demand	Anodyne	P2RY12	66	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3ncccc23)CC1	ZINC000853652908	FE	On-Demand	Anodyne	NR5A1	25	40
CCC(CC)COc1cccc(C(N)=O)c1	ZINC000853652912	BF	On-Demand	Anodyne	KCNH2	42	39
CCC(CC)COc1cccc(C(N)=O)c1	ZINC000853652912	BF	On-Demand	Anodyne	TRY1_BOVIN	16	43
CCC(CC)COc1cccc(C(N)=O)c1	ZINC000853652912	BF	On-Demand	Anodyne	ACR	23	42
CCC(CC)COc1cccc(C(N)=O)c1	ZINC000853652912	BF	On-Demand	Anodyne	PDS	96	47
COC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@@H](OC(=O)N(C)C)C1	ZINC000853652943	FE	On-Demand	Anodyne	LIPG	45	36
COC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@H](OC(=O)N(C)C)C1	ZINC000853652944	FE	On-Demand	Anodyne	LIPG	45	36
CC(C)c1ccc2ncnc(N3CC[C@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652947	EG	On-Demand	Anodyne	PDE3A	54	52
CC(C)c1ccc2ncnc(N3CC[C@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652947	EG	On-Demand	Anodyne	PDGFRB	50	43
CC(C)c1ccc2ncnc(N3CC[C@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652947	EG	On-Demand	Anodyne	PDE3B	60	52
CC(C)c1ccc2ncnc(N3CC[C@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652947	EG	On-Demand	Anodyne	SIRT3	51	31
CC(C)c1ccc2ncnc(N3CC[C@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652947	EG	On-Demand	Anodyne	SIRT2	44	31
CC(C)c1ccc2ncnc(N3CC[C@@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652948	EG	On-Demand	Anodyne	PDE3A	54	52
CC(C)c1ccc2ncnc(N3CC[C@@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652948	EG	On-Demand	Anodyne	PDGFRB	50	43
CC(C)c1ccc2ncnc(N3CC[C@@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652948	EG	On-Demand	Anodyne	PDE3B	60	52
CC(C)c1ccc2ncnc(N3CC[C@@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652948	EG	On-Demand	Anodyne	SIRT3	51	31
CC(C)c1ccc2ncnc(N3CC[C@@H](OC(=O)N(C)C)C3)c2c1	ZINC000853652948	EG	On-Demand	Anodyne	SIRT2	44	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(=O)NC)CC1	ZINC000853652956	FD	On-Demand	Anodyne	P2RY12	167	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(=O)NC)CC1	ZINC000853652956	FD	On-Demand	Anodyne	HCN1	77	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(=O)NC)CC1	ZINC000853652956	FD	On-Demand	Anodyne	HCN4	53	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(=O)NC)CC1	ZINC000853652957	FD	On-Demand	Anodyne	P2RY12	167	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(=O)NC)CC1	ZINC000853652957	FD	On-Demand	Anodyne	HCN1	77	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(=O)NC)CC1	ZINC000853652957	FD	On-Demand	Anodyne	HCN4	53	36
CC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@H](OC(=O)N(C)C)C1	ZINC000853652977	EF	On-Demand	Anodyne	LIPG	47	37
CC(=O)c1ccc(C(F)(F)F)nc1N1CC[C@@H](OC(=O)N(C)C)C1	ZINC000853652978	EF	On-Demand	Anodyne	LIPG	47	37
CCn1ncnc1CONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853652985	DE	On-Demand	Anodyne	CCR2	73	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)N(C)C)c2)CC1	ZINC000853653014	GD	On-Demand	Anodyne	DRD4	40	31
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)N(C)C)c2)CC1	ZINC000853653014	GD	On-Demand	Anodyne	P2RY12	91	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)N(C)C)c2)CC1	ZINC000853653014	GD	On-Demand	Anodyne	TRY2_BOVIN	41	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)N(C)C)c2)CC1	ZINC000853653015	GD	On-Demand	Anodyne	DRD4	40	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)N(C)C)c2)CC1	ZINC000853653015	GD	On-Demand	Anodyne	P2RY12	91	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)N(C)C)c2)CC1	ZINC000853653015	GD	On-Demand	Anodyne	TRY2_BOVIN	41	41
C[C@H](O)CCc1ccc(OCC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000853653023	EF	On-Demand	Anodyne	FFAR1	22	41
C[C@H](O)CCc1ccc(OCC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000853653023	EF	On-Demand	Anodyne	FFAR4	42	40
CO[C@@H](COc1cccc(C(=O)N(C)C)c1)C1CCC1	ZINC000853653046	CF	On-Demand	Anodyne	PDS	42	34
CCN1CC[C@H](ONC(=O)c2cccc(C(F)(F)F)c2)C1=O	ZINC000853653053	DD	On-Demand	Anodyne	CACNA1B	42	33
CCN1CC[C@H](ONC(=O)c2cccc(C(F)(F)F)c2)C1=O	ZINC000853653053	DD	On-Demand	Anodyne	CCR2	104	44
CCN1CC[C@H](ONC(=O)c2cccc(C(F)(F)F)c2)C1=O	ZINC000853653053	DD	On-Demand	Anodyne	EPHX2	15	41
CCN1CC[C@H](ONC(=O)c2cccc(C(F)(F)F)c2)C1=O	ZINC000853653053	DD	On-Demand	Anodyne	PDS	40	33
CC(C)n1ncnc1CONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853653094	EF	On-Demand	Anodyne	CCR2	73	40
CC(C)n1ncnc1CONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853653094	EF	On-Demand	Anodyne	PDS	42	34
COC[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)OC	ZINC000853653112	DE	On-Demand	Anodyne	CCR2	74	42
COC[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)OC	ZINC000853653112	DE	On-Demand	Anodyne	KCNK3	25	44
COC[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)OC	ZINC000853653112	DE	On-Demand	Anodyne	PDS	43	38
O=C(NOCc1ncnn1CCF)c1cccc(C(F)(F)F)c1	ZINC000853653125	EE	On-Demand	Anodyne	CCR2	61	36
Cc1ccc(N2CC[C@H](OC(=O)N(C)C)C2)nn1	ZINC000853653149	CD	On-Demand	Anodyne	SCD1	41	39
CCCn1ncnc1CONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853653152	EF	On-Demand	Anodyne	CCR2	70	36
C#CCOCCONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853653290	CE	On-Demand	Mild	CCR2	66	37
C#CCOCCONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853653290	CE	On-Demand	Mild	TEK	15	40
CS(=O)(=O)N1CC[C@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653300	FD	On-Demand	Anodyne	CACNA1B	59	37
CS(=O)(=O)N1CC[C@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653300	FD	On-Demand	Anodyne	CCR2	94	44
CS(=O)(=O)N1CC[C@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653300	FD	On-Demand	Anodyne	EPHX2	20	40
CS(=O)(=O)N1CC[C@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653300	FD	On-Demand	Anodyne	ST14	43	33
CS(=O)(=O)N1CC[C@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653300	FD	On-Demand	Anodyne	CACNA1I	18	40
CS(=O)(=O)N1CC[C@@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653302	FD	On-Demand	Anodyne	CACNA1B	59	37
CS(=O)(=O)N1CC[C@@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653302	FD	On-Demand	Anodyne	CCR2	94	44
CS(=O)(=O)N1CC[C@@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653302	FD	On-Demand	Anodyne	EPHX2	20	40
CS(=O)(=O)N1CC[C@@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653302	FD	On-Demand	Anodyne	ST14	43	33
CS(=O)(=O)N1CC[C@@H](CONC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000853653302	FD	On-Demand	Anodyne	CACNA1I	18	40
C[C@H](O)CCc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853653319	CH	On-Demand	Anodyne	ADRB1	17	40
COc1cccc(Nc2nc(N3CC[C@H](OC(=O)N(C)C)C3)nc3[nH]cnc23)c1	ZINC000853653323	GE	On-Demand	Anodyne	PDPK1	15	44
COc1cccc(Nc2nc(N3CC[C@@H](OC(=O)N(C)C)C3)nc3[nH]cnc23)c1	ZINC000853653324	GE	On-Demand	Anodyne	PDPK1	15	44
O=C(NOC[C@H]1COCCO1)c1cccc(C(F)(F)F)c1	ZINC000853653327	DD	On-Demand	Anodyne	CCR2	81	39
O=C(NOC[C@@H]1COCCO1)c1cccc(C(F)(F)F)c1	ZINC000853653328	DD	On-Demand	Anodyne	CCR2	81	39
COC[C@@H](COc1ccc(NC(=O)OC)cc1)OC	ZINC000853653338	CD	On-Demand	Anodyne	ADRB1	27	44
COC[C@@H](COc1ccc(NC(=O)OC)cc1)OC	ZINC000853653338	CD	On-Demand	Anodyne	ADRB3	16	41
COC[C@@H](COc1ccc(NC(=O)OC)cc1)OC	ZINC000853653338	CD	On-Demand	Anodyne	FAAH	21	42
COC[C@@H](COc1ccc(NC(=O)OC)cc1)OC	ZINC000853653338	CD	On-Demand	Anodyne	PDS	46	38
CN(C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)S(=O)(=O)c1ccc(C#N)cc1	ZINC000853653364	GD	On-Demand	Mild	GPR119	38	42
C#CCOCCOc1ccc(NC(=O)C2CC2)cc1	ZINC000853653382	CE	On-Demand	Mild	EPHX2	16	41
C=C(Cl)COc1ccc(NC(=O)C2CC2)cc1	ZINC000853653410	CG	On-Demand	Mild	LTA4H	16	43
COC(=O)C1(CONC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000853653429	DE	On-Demand	Anodyne	CCR2	85	43
CCOc1cc(N2CC[C@H](OC(=O)N(C)C)C2)c(F)cn1	ZINC000853653438	CD	On-Demand	Anodyne	LIPG	47	39
CCOc1cc(N2CC[C@@H](OC(=O)N(C)C)C2)c(F)cn1	ZINC000853653439	CD	On-Demand	Anodyne	LIPG	47	39
O=C(NOCCC1SCCS1)c1cccc(C(F)(F)F)c1	ZINC000853653470	EH	On-Demand	Anodyne	CCR2	77	41
N#CCC1(CONC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000853653478	CG	On-Demand	Mild	CCR2	77	40
O=C(NOCCO[C@H]1CC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000853653486	EF	On-Demand	Anodyne	CCR2	79	40
O=C(NOCCO[C@@H]1CC1(F)F)c1cccc(C(F)(F)F)c1	ZINC000853653487	EF	On-Demand	Anodyne	CCR2	79	40
Cc1c(N2CC[C@H](F)C2)ncnc1N1CC[C@@H](F)C1	ZINC000853653499	CD	On-Demand	Anodyne	PDE3B	42	34
CC1(C)C[C@@H](ONC(=O)c2cccc(C(F)(F)F)c2)CO1	ZINC000853653508	DF	On-Demand	Anodyne	CCR2	87	42
O=C1N[C@@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653520	GG	On-Demand	Anodyne	HTR1A	31	40
O=C1N[C@@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653520	GG	On-Demand	Anodyne	SLC6A1	15	40
O=C1N[C@@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653520	GG	On-Demand	Anodyne	ADRA1A	15	40
O=C1N[C@@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653520	GG	On-Demand	Anodyne	SIGMAR1	21	43
O=C1N[C@@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653520	GG	On-Demand	Anodyne	EBP	22	40
O=C1N[C@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653521	GG	On-Demand	Anodyne	HTR1A	31	40
O=C1N[C@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653521	GG	On-Demand	Anodyne	SLC6A1	15	40
O=C1N[C@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653521	GG	On-Demand	Anodyne	ADRA1A	15	40
O=C1N[C@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653521	GG	On-Demand	Anodyne	SIGMAR1	21	43
O=C1N[C@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCN1CCCCC1	ZINC000853653521	GG	On-Demand	Anodyne	EBP	22	40
C=C(Cl)CONC(=N)c1ccc(OC)c(OC)c1	ZINC000853653522	CE	On-Demand	Mild	KLK_PIG	40	31
O=C(NOCC1C[C@H]2C[C@@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000853653525	CG	On-Demand	Anodyne	CACNA1B	44	31
O=C(NOCC1C[C@H]2C[C@@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000853653525	CG	On-Demand	Anodyne	CCR2	81	42
O=C(NOCC1C[C@@H]2C[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000853653526	CG	On-Demand	Anodyne	CACNA1B	44	31
O=C(NOCC1C[C@@H]2C[C@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000853653526	CG	On-Demand	Anodyne	CCR2	81	42
O=C(NOC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000853653527	CG	On-Demand	Anodyne	CACNA1B	44	31
O=C(NOC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(C(F)(F)F)c1	ZINC000853653527	CG	On-Demand	Anodyne	CCR2	81	42
O=C(Nc1ccc(OCCC2SCCS2)cc1)C1CC1	ZINC000853653601	DH	On-Demand	Anodyne	EPHX2	19	40
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)C1CCCC1	ZINC000853653696	EH	On-Demand	Anodyne	CACNA1B	40	38
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)C1CCCC1	ZINC000853653696	EH	On-Demand	Anodyne	AMY2	42	29
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)C1CCCC1	ZINC000853653696	EH	On-Demand	Anodyne	CCR2	98	49
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)C1CCCC1	ZINC000853653696	EH	On-Demand	Anodyne	KCNK3	21	43
COc1cc(N2C[C@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])cc1C	ZINC000853653775	FG	On-Demand	Bother	CACNA1D	46	31
COc1cc(N2C[C@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])cc1C	ZINC000853653776	FG	On-Demand	Bother	CACNA1D	46	31
COc1cc(N2C[C@@H](c3ccccc3)[C@](F)(CO)C2)c([N+](=O)[O-])cc1C	ZINC000853653777	FG	On-Demand	Bother	CACNA1D	46	31
COc1cc(N2C[C@@H](c3ccccc3)[C@@](F)(CO)C2)c([N+](=O)[O-])cc1C	ZINC000853653778	FG	On-Demand	Bother	CACNA1D	46	31
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653784	GE	On-Demand	Anodyne	P2RY12	132	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653784	GE	On-Demand	Anodyne	EPHX2	29	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653784	GE	On-Demand	Anodyne	TGM2	30	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653784	GE	On-Demand	Anodyne	DPP7	15	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653784	GE	On-Demand	Anodyne	F13A1	48	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653785	GE	On-Demand	Anodyne	P2RY12	132	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653785	GE	On-Demand	Anodyne	EPHX2	29	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653785	GE	On-Demand	Anodyne	TGM2	30	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653785	GE	On-Demand	Anodyne	DPP7	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C3CC3)cc2)CC1	ZINC000853653785	GE	On-Demand	Anodyne	F13A1	48	41
C#CCOCCOc1ccc(NC(=O)OC)cc1	ZINC000853653791	BD	On-Demand	Mild	FAAH	23	43
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc3c(c2)S(=O)(=O)N=C3Cl)C1	ZINC000853653867	GE	On-Demand	Anodyne	CHRNA4	25	45
CCOC(=O)N1CCN(C(=O)[C@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653881	JG	On-Demand	Anodyne	P2RY12	159	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653881	JG	On-Demand	Anodyne	HTR7	19	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653881	JG	On-Demand	Anodyne	CCKBR	21	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653881	JG	On-Demand	Anodyne	CXCR3	23	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653883	JG	On-Demand	Anodyne	P2RY12	159	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653883	JG	On-Demand	Anodyne	HTR7	19	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653883	JG	On-Demand	Anodyne	CCKBR	21	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Sc2nc3ccccc3c(=O)n2-c2ccc(OC)cc2)CC1	ZINC000853653883	JG	On-Demand	Anodyne	CXCR3	23	40
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)C1CCC1	ZINC000853653893	DG	On-Demand	Anodyne	CACNA1B	40	36
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)C1CCC1	ZINC000853653893	DG	On-Demand	Anodyne	CCR2	95	49
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)C1CCC1	ZINC000853653893	DG	On-Demand	Anodyne	KCNK3	21	43
O=C(NOCCC1(O)CCC1)c1cccc(C(F)(F)F)c1	ZINC000853653913	DF	On-Demand	Anodyne	CCR2	78	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853653926	FD	On-Demand	Bother	CACNA1D	40	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853653932	FD	On-Demand	Bother	CACNA1D	40	34
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2cc(F)ncn2)C1	ZINC000853653934	CD	On-Demand	Anodyne	CHRNA4	29	50
Cc1cc(C(F)(F)F)cc(N2CC[C@@H](OC(=O)N(C)C)C2)n1	ZINC000853654030	DF	On-Demand	Anodyne	LIPG	58	38
O=C1O[C@H]2C[C@H]1N(c1nc(NCc3ccc(Cl)cc3)c3ccccc3n1)C2	ZINC000853654032	GG	On-Demand	Anodyne	HRH4	15	43
Cc1cc(C(F)(F)F)cc(N2CC[C@H](OC(=O)N(C)C)C2)n1	ZINC000853654033	DF	On-Demand	Anodyne	LIPG	58	38
CCNc1nccnc1N[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000853654044	DF	On-Demand	Anodyne	CTSK	15	40
CCNc1nccnc1N[C@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000853654046	DF	On-Demand	Anodyne	CTSK	15	40
CCNc1nccnc1N[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C	ZINC000853654048	DF	On-Demand	Anodyne	CTSK	15	40
CCNc1nccnc1N[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000853654049	DF	On-Demand	Anodyne	CTSK	15	40
O=C(Nc1ccc(OCCOC(F)F)cc1)C1CC1	ZINC000853654060	CF	On-Demand	Anodyne	EPHX2	26	43
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)Nc1nc2ccc(N)cc2s1	ZINC000853654085	EH	On-Demand	Anodyne	CSNK1D	41	40
Cn1nnc2c(NCc3ccc4c(c3)CCCN4C(=O)OC(C)(C)C)ncnc21	ZINC000853654132	GG	On-Demand	Anodyne	EIF2AK3	48	31
CC(C)(C)OC(=O)N1CCCc2cc(CNc3cc(CO)c(F)cn3)ccc21	ZINC000853654254	GI	On-Demand	Anodyne	AVPR2	17	40
N#Cc1ncc(Br)cc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000853654281	FF	On-Demand	Mild	CHRNA4	25	44
COC(=O)c1nccc(N2CC[C@@H](OC(=O)N(C)C)C2)n1	ZINC000853654282	CC	On-Demand	Anodyne	SORD	29	40
COC(=O)c1nccc(N2CC[C@H](OC(=O)N(C)C)C2)n1	ZINC000853654284	CC	On-Demand	Anodyne	SORD	29	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(CC[C@@H](C)O)cc2)CC1	ZINC000853654286	GE	On-Demand	Anodyne	P2RY12	58	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(CC[C@H](C)O)cc2)CC1	ZINC000853654288	GE	On-Demand	Anodyne	P2RY12	58	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(CC[C@@H](C)O)cc2)CC1	ZINC000853654290	GE	On-Demand	Anodyne	P2RY12	58	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(CC[C@H](C)O)cc2)CC1	ZINC000853654292	GE	On-Demand	Anodyne	P2RY12	58	38
CC(=O)c1ccc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(S(N)(=O)=O)c1	ZINC000853654299	GD	On-Demand	Anodyne	CHRNA4	27	52
CCC(CC)CONC(=N)c1ccc(OC)c(OC)c1	ZINC000853654302	CF	On-Demand	Anodyne	KLK_PIG	40	30
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1	ZINC000853654307	FG	On-Demand	Bother	CHRNA4	24	42
O=C1N[C@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCn1ccnc1	ZINC000853654311	FE	On-Demand	Anodyne	TBXAS1	31	43
O=C1N[C@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCn1ccnc1	ZINC000853654311	FE	On-Demand	Anodyne	QPCT	15	42
O=C1N[C@@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCn1ccnc1	ZINC000853654313	FE	On-Demand	Anodyne	TBXAS1	31	43
O=C1N[C@@H](c2ccccc2OC(F)(F)F)C(=O)N1CCCn1ccnc1	ZINC000853654313	FE	On-Demand	Anodyne	QPCT	15	42
COc1cc(N2CC[C@@H](OC(=O)N(C)C)C2)c(Br)cn1	ZINC000853654333	EE	On-Demand	Anodyne	LIPG	45	40
COc1cc(N2CC[C@H](OC(=O)N(C)C)C2)c(Br)cn1	ZINC000853654335	EE	On-Demand	Anodyne	LIPG	45	40
O=C(NOCC1CC=CC1)c1cccc(C(F)(F)F)c1	ZINC000853654344	CG	On-Demand	Anodyne	KCNJ11	23	41
O=C(NOCC1CC=CC1)c1cccc(C(F)(F)F)c1	ZINC000853654344	CG	On-Demand	Anodyne	CCR2	82	43
O=C(NOCC1CC=CC1)c1cccc(C(F)(F)F)c1	ZINC000853654344	CG	On-Demand	Anodyne	KCNK3	15	47
O=C(NOCc1cc(C2CC2)no1)c1cccc(C(F)(F)F)c1	ZINC000853654346	EG	On-Demand	Anodyne	CCR2	83	43
O=C(NOCCC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000853654361	CH	On-Demand	Anodyne	KCNJ11	32	42
O=C(NOCCC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000853654361	CH	On-Demand	Anodyne	CCR2	89	47
O=C(NOCCC1CCC1)c1cccc(C(F)(F)F)c1	ZINC000853654361	CH	On-Demand	Anodyne	LIPG	20	40
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	TACR1	24	41
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	CACNA1B	55	35
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	SLC9A1	26	40
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	CCR2	101	55
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	RBP4	27	48
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	CACNA1I	22	43
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	LIPG	49	37
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	SFRP1	73	39
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	SMO	32	40
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654363	GH	On-Demand	Anodyne	MAP3K12	28	42
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	TACR1	24	41
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	CACNA1B	55	35
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	SLC9A1	26	40
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	CCR2	101	55
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	RBP4	27	48
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	CACNA1I	22	43
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	LIPG	49	37
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	SFRP1	73	39
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	SMO	32	40
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccc(C(F)(F)F)c1	ZINC000853654365	GH	On-Demand	Anodyne	MAP3K12	28	42
COC(=O)C1(CONC(=N)c2ccc(OC)c(OC)c2)CC1	ZINC000853654387	DD	On-Demand	Anodyne	ENPP1	50	32
C#CCOCCOc1ccccc1C(=O)NC	ZINC000853654408	BD	On-Demand	Mild	HCN1	56	32
C#CCOCCOc1ccccc1C(=O)NC	ZINC000853654408	BD	On-Demand	Mild	HCN4	40	31
C#CCOCCOc1ccccc1C(=O)NC	ZINC000853654408	BD	On-Demand	Mild	KCNK3	48	37
C#CCOCCOc1ccccc1C(=O)NC	ZINC000853654408	BD	On-Demand	Mild	KCNK9	41	37
Cn1cncc1CCONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853654412	DE	On-Demand	Anodyne	CCR2	71	38
Cn1cncc1CCONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853654412	DE	On-Demand	Anodyne	TEK	20	41
Cn1cncc1CCONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853654412	DE	On-Demand	Anodyne	BRAF	30	46
C[C@H](O)CCc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853654414	FG	On-Demand	Anodyne	GPR119	28	40
C[C@H](O)CCc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853654416	FG	On-Demand	Anodyne	GPR119	28	40
CC1(CONC(=O)c2cccc(C(F)(F)F)c2)CCC1	ZINC000853654420	CH	On-Demand	Anodyne	CCR2	95	46
CC1(CONC(=O)c2cccc(C(F)(F)F)c2)CCC1	ZINC000853654420	CH	On-Demand	Anodyne	KCNK3	15	44
Cc1nonc1CONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853654428	DE	On-Demand	Anodyne	CCR2	69	38
Cc1nonc1CONC(=O)c1cccc(C(F)(F)F)c1	ZINC000853654428	DE	On-Demand	Anodyne	KCNK3	15	45
C#CCOCCOc1cccc(C(=O)N(C)C)c1	ZINC000853654429	BD	On-Demand	Mild	MAOA	15	41
C#CCOCCOc1cccc(C(=O)N(C)C)c1	ZINC000853654429	BD	On-Demand	Mild	PLA2G4B	25	40
CCCn1ncnc1COc1ccc(NC(=O)OC)cc1	ZINC000853654485	CE	On-Demand	Anodyne	FAAH	22	41
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)[C@H]1CCOC1	ZINC000853654490	EE	On-Demand	Anodyne	CCR2	110	41
CO[C@@H](CONC(=O)c1cccc(C(F)(F)F)c1)[C@@H]1CCOC1	ZINC000853654495	EE	On-Demand	Anodyne	CCR2	110	41
CN(CCO[Si](C)(C)C(C)(C)C)S(=O)(=O)c1ccc(C#N)cc1	ZINC000853654517	FG	On-Demand	Reactive	SQLE	15	44
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)Nc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000853654542	GD	On-Demand	Bother	COLA	20	40
CC(C)(C)OC(=O)N1CCO[C@H](CN(Cc2ccccn2)S(C)(=O)=O)C1	ZINC000853654577	GD	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCO[C@@H](CN(Cc2ccccn2)S(C)(=O)=O)C1	ZINC000853654578	GD	On-Demand	Anodyne	GPR119	38	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C(=O)N(C)C)ccc2C)CC1	ZINC000853654583	GD	On-Demand	Anodyne	P2RY12	57	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C(=O)N(C)C)ccc2C)CC1	ZINC000853654584	GD	On-Demand	Anodyne	P2RY12	57	38
COC(=O)C1(CON=C(N)c2ccc(OC)cc2)CC1	ZINC000853654589	CD	On-Demand	Mild	ACR	41	40
Cc1cc(C(F)(F)F)cc(N2CCC[C@@H](OC(=O)N(C)C)C2)n1	ZINC000853654660	EG	On-Demand	Anodyne	LIPG	44	33
Cc1cc(C(F)(F)F)cc(N2CCC[C@H](OC(=O)N(C)C)C2)n1	ZINC000853654661	EG	On-Demand	Anodyne	LIPG	44	33
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc(NC(=O)C3CC3)cc2)C1	ZINC000853654685	GG	On-Demand	Anodyne	EPHX2	30	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc(NC(=O)C3CC3)cc2)C1	ZINC000853654686	GG	On-Demand	Anodyne	EPHX2	30	41
CC(C)(C)OC(=O)N1CCO[C@H](CN(c2ccc(C#N)cc2)S(C)(=O)=O)C1	ZINC000853654712	GD	On-Demand	Mild	GPR119	35	42
CC(C)(C)OC(=O)N1CCO[C@@H](CN(c2ccc(C#N)cc2)S(C)(=O)=O)C1	ZINC000853654713	GD	On-Demand	Mild	GPR119	35	42
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)Nc1ccccc1S(=O)(=O)N(C)C	ZINC000853654750	FF	On-Demand	Anodyne	FPR1	46	37
N=C(NOCCOCc1ccccc1)C1CCCC1	ZINC000853654806	CF	On-Demand	Anodyne	FKBP1A	22	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=C(N)c2ccc(OC)cc2)CC1	ZINC000853654826	GD	On-Demand	Mild	CHRM2	15	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=C(N)c2ccc(OC)cc2)CC1	ZINC000853654826	GD	On-Demand	Mild	P2RY12	65	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=C(N)c2ccc(OC)cc2)CC1	ZINC000853654827	GD	On-Demand	Mild	CHRM2	15	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=C(N)c2ccc(OC)cc2)CC1	ZINC000853654827	GD	On-Demand	Mild	P2RY12	65	42
C#Cc1cccnc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000853654862	CD	On-Demand	Mild	CHRNA4	27	50
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)OC)cc2)CC1	ZINC000853654925	GD	On-Demand	Anodyne	P2RY12	64	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)OC)cc2)CC1	ZINC000853654925	GD	On-Demand	Anodyne	TGM2	24	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)OC)cc2)CC1	ZINC000853654925	GD	On-Demand	Anodyne	F13A1	38	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)OC)cc2)CC1	ZINC000853654926	GD	On-Demand	Anodyne	P2RY12	64	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)OC)cc2)CC1	ZINC000853654926	GD	On-Demand	Anodyne	TGM2	24	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)OC)cc2)CC1	ZINC000853654926	GD	On-Demand	Anodyne	F13A1	38	43
c1cnc(NCc2nc(C3CC3)n[nH]2)nc1	ZINC000853654958	BD	On-Demand	Anodyne	PKNB	21	40
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	CHRM2	25	49
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	CHRM1	23	49
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	ACE	45	37
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	DRD2	36	50
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	FKBP1A	45	37
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	DRD4	61	48
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	ACHE	49	46
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	DRD3	21	50
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	SLC6A3	22	44
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	KCNH2	17	44
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	HTR4	29	46
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	CHRM3	37	49
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	LTA4H	30	42
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	SIGMAR1	60	55
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	SSTR5	58	37
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	CACNA1B	17	43
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	BCHE	16	41
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	CCR3	38	42
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	GHSR	16	44
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	EPHX2	16	45
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	MCHR1	58	49
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	CACNA1G	36	45
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	CCR8	23	43
C[C@@H](ONC(=N)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853654998	FF	On-Demand	Anodyne	BIRC2	44	46
C#Cc1cccnc1N1CCC(n2cc(C(=O)OCC)cn2)CC1	ZINC000853655012	DE	On-Demand	Mild	P2RY12	31	40
C#CCCCOc1cccnc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2	ZINC000853655026	EF	On-Demand	Mild	CHRNA4	26	47
CC(C)(C)OC(=O)N1CCCc2cc(CNc3cc(C#N)cnn3)ccc21	ZINC000853655029	FH	On-Demand	Mild	GPR119	17	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3noc(C)n3)c2)CC1	ZINC000853655031	GE	On-Demand	Anodyne	P2RY12	190	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3noc(C)n3)c2)CC1	ZINC000853655031	GE	On-Demand	Anodyne	HRH3	18	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3noc(C)n3)c2)CC1	ZINC000853655032	GE	On-Demand	Anodyne	P2RY12	190	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3noc(C)n3)c2)CC1	ZINC000853655032	GE	On-Demand	Anodyne	HRH3	18	41
C#CCCN(CCOC)C(=O)N[C@@H](CN1CCN(C)CC1)c1ccccc1	ZINC000853655054	FD	On-Demand	Mild	CASR	31	40
C#CCCN(CCOC)C(=O)N[C@H](CN1CCN(C)CC1)c1ccccc1	ZINC000853655055	FD	On-Demand	Mild	CASR	31	40
Cc1nonc1COc1ccccc1C(=O)NC1CCCC1	ZINC000853655124	DF	On-Demand	Anodyne	CNR1	20	44
Cc1nonc1COc1ccccc1C(=O)NC1CCCC1	ZINC000853655124	DF	On-Demand	Anodyne	CNR2	35	44
Cc1nonc1COc1ccccc1C(=O)NC1CCCC1	ZINC000853655124	DF	On-Demand	Anodyne	CACNA1D	15	47
Cc1nonc1COc1ccccc1C(=O)NC1CCCC1	ZINC000853655124	DF	On-Demand	Anodyne	HCN1	65	37
Cc1nonc1COc1ccccc1C(=O)NC1CCCC1	ZINC000853655124	DF	On-Demand	Anodyne	HCN4	46	37
Fc1cnc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000853655134	CF	On-Demand	Anodyne	CHRNA10	98	53
Fc1cnc(N2CCC[C@H]2COc2ccccc2)cn1	ZINC000853655134	CF	On-Demand	Anodyne	CASP7	33	41
COC(=O)C1(CONC(=N)CN2CCN(c3ccccc3)CC2)CC1	ZINC000853655139	ED	On-Demand	Anodyne	HTR1A	39	40
COC(=O)C1(CONC(=N)CN2CCN(c3ccccc3)CC2)CC1	ZINC000853655139	ED	On-Demand	Anodyne	DRD3	31	40
COC(=O)C1(CONC(=N)CN2CCN(c3ccccc3)CC2)CC1	ZINC000853655139	ED	On-Demand	Anodyne	HTR7	41	40
C=C(Cl)CONC(=N)CN1CCN(c2ccccc2)CC1	ZINC000853655140	DE	On-Demand	Mild	HTR1A	22	40
C=C(Cl)CONC(=N)CN1CCN(c2ccccc2)CC1	ZINC000853655140	DE	On-Demand	Mild	DRD2	15	43
C=C(Cl)CONC(=N)CN1CCN(c2ccccc2)CC1	ZINC000853655140	DE	On-Demand	Mild	DRD4	24	43
O=C(NC1CCCC1)c1ccccc1OCCOC(F)F	ZINC000853655151	CF	On-Demand	Anodyne	CNR1	16	46
O=C(NC1CCCC1)c1ccccc1OCCOC(F)F	ZINC000853655151	CF	On-Demand	Anodyne	CNR2	29	46
O=C(NC1CCCC1)c1ccccc1OCCOC(F)F	ZINC000853655151	CF	On-Demand	Anodyne	HCN1	67	35
O=C(NC1CCCC1)c1ccccc1OCCOC(F)F	ZINC000853655151	CF	On-Demand	Anodyne	HCN4	52	35
COC(=O)C1(CONC(=N)Cc2ccccc2)CC1	ZINC000853655168	CD	On-Demand	Anodyne	SLC12A5	52	39
CCOC(=O)N1CCN(C(=O)[C@H](C)N(Cc2ccccn2)S(C)(=O)=O)CC1	ZINC000853655250	GC	On-Demand	Anodyne	P2RY12	84	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(Cc2ccccn2)S(C)(=O)=O)CC1	ZINC000853655251	GC	On-Demand	Anodyne	P2RY12	84	39
CS(=O)(=O)N1CC[C@@H](CONC(=N)Cc2ccccc2)C1	ZINC000853655291	DD	On-Demand	Anodyne	SIGMAR1	15	40
CS(=O)(=O)N1CC[C@H](CONC(=N)Cc2ccccc2)C1	ZINC000853655292	DD	On-Demand	Anodyne	SIGMAR1	15	40
Fc1ncnc(N2CCC[C@H]2COc2ccccc2)c1Br	ZINC000853655298	FG	On-Demand	Anodyne	CHRNA10	90	50
O=C(NC1CCCC1)c1ccccc1OCc1csc(Cl)n1	ZINC000853655337	EI	On-Demand	Anodyne	CNR1	23	43
O=C(NC1CCCC1)c1ccccc1OCc1csc(Cl)n1	ZINC000853655337	EI	On-Demand	Anodyne	CNR2	31	43
O=C(NC1CCCC1)c1ccccc1OCc1csc(Cl)n1	ZINC000853655337	EI	On-Demand	Anodyne	KCNA3	30	40
N=C(CN1CCN(c2ccccc2)CC1)NOCc1cc(C2CC2)no1	ZINC000853655372	FE	On-Demand	Anodyne	DRD4	18	42
N=C(CN1CCN(c2ccccc2)CC1)NOCc1cc(C2CC2)no1	ZINC000853655372	FE	On-Demand	Anodyne	DRD3	18	42
O=S1(=O)N=C(Cl)c2ccc(N3CCC[C@H]3COc3ccccc3)cc21	ZINC000853655386	GG	On-Demand	Anodyne	CHRNA10	77	44
CC(C)(C[C@@H]1CCCN(c2ncnc(F)c2Br)C1)C(N)=O	ZINC000853655417	FE	On-Demand	Anodyne	SIRT3	66	34
CC(C)(C[C@@H]1CCCN(c2ncnc(F)c2Br)C1)C(N)=O	ZINC000853655417	FE	On-Demand	Anodyne	SIRT2	55	34
CC(C)(C[C@@H]1CCCN(c2ncnc(F)c2Br)C1)C(N)=O	ZINC000853655417	FE	On-Demand	Anodyne	SIRT1	50	33
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	CHRM1	20	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	DRD4	39	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	ACHE	22	44
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	HTR4	17	43
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	CHRM3	15	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	LTA4H	18	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	SIGMAR1	36	58
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	SSTR5	45	38
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	CCR3	28	48
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	MCHR1	35	45
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2ccccc2)CC1	ZINC000853655418	GF	On-Demand	Anodyne	CCR8	32	48
O=C(NC1CCCC1)c1ccccc1OCCC1SCCS1	ZINC000853655433	EH	On-Demand	Anodyne	CNR1	15	45
O=C(NC1CCCC1)c1ccccc1OCCC1SCCS1	ZINC000853655433	EH	On-Demand	Anodyne	CNR2	26	45
O=C(NC1CCCC1)c1ccccc1OCCC1SCCS1	ZINC000853655433	EH	On-Demand	Anodyne	HCN1	54	35
O=C(NC1CCCC1)c1ccccc1OCCC1SCCS1	ZINC000853655433	EH	On-Demand	Anodyne	HCN4	44	35
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655447	FD	On-Demand	Anodyne	GHRHR	66	33
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655447	FD	On-Demand	Anodyne	P2RY12	177	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655447	FD	On-Demand	Anodyne	TRY2_BOVIN	59	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655447	FD	On-Demand	Anodyne	CCR1	16	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655447	FD	On-Demand	Anodyne	ST14	16	41
CN(C)C(=O)O[C@@H]1CCCN(c2cc(-c3ccccc3)nc3ccnn23)C1	ZINC000853655448	FG	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655449	FD	On-Demand	Anodyne	GHRHR	66	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655449	FD	On-Demand	Anodyne	P2RY12	177	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655449	FD	On-Demand	Anodyne	TRY2_BOVIN	59	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655449	FD	On-Demand	Anodyne	CCR1	16	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2)CC1	ZINC000853655449	FD	On-Demand	Anodyne	ST14	16	41
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(C(=O)NC3CC3)c2)C1	ZINC000853655457	GF	On-Demand	Anodyne	DRD4	42	32
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(C(=O)NC3CC3)c2)C1	ZINC000853655459	GF	On-Demand	Anodyne	DRD4	42	32
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncnc(F)c2Br)C1	ZINC000853655497	FE	On-Demand	Anodyne	CHRNA4	27	48
C#Cc1cccnc1N1CCC[C@H]1COc1ccccc1	ZINC000853655521	CG	On-Demand	Mild	CHRNA10	81	50
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2ncccn2)C1	ZINC000853655541	CD	On-Demand	Anodyne	CHRNA4	32	59
CCOC(=O)c1cnn(C2CCN(c3ncnc(F)c3Br)CC2)c1	ZINC000853655547	GF	On-Demand	Anodyne	SIRT3	40	30
CC(C)(C[C@@H]1CCCN(c2cc(F)ncn2)C1)C(N)=O	ZINC000853655548	CD	On-Demand	Anodyne	SIRT3	42	32
C#CCOCCOc1cccc(C(=O)NC2CC2)c1	ZINC000853655568	CD	On-Demand	Mild	PLG	17	43
C#CCOCCOc1cccc(C(=O)NC2CC2)c1	ZINC000853655568	CD	On-Demand	Mild	DRD4	41	32
C#CCOCCOc1cccc(C(=O)NC2CC2)c1	ZINC000853655568	CD	On-Demand	Mild	HRH2	21	42
C#CCOCCOc1cccc(C(=O)NC2CC2)c1	ZINC000853655568	CD	On-Demand	Mild	PLAU	22	40
C#CCOCCOc1cccc(C(=O)NC2CC2)c1	ZINC000853655568	CD	On-Demand	Mild	ST14	18	43
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655570	GD	On-Demand	Anodyne	F2	19	44
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655570	GD	On-Demand	Anodyne	P2RY12	146	41
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655570	GD	On-Demand	Anodyne	TRY2_BOVIN	81	44
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655570	GD	On-Demand	Anodyne	ST14	21	41
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655570	GD	On-Demand	Anodyne	CCR8	22	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655571	GD	On-Demand	Anodyne	F2	19	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655571	GD	On-Demand	Anodyne	P2RY12	146	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655571	GD	On-Demand	Anodyne	TRY2_BOVIN	81	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655571	GD	On-Demand	Anodyne	ST14	21	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)Cc2ccccc2)CC1	ZINC000853655571	GD	On-Demand	Anodyne	CCR8	22	42
COc1cc(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c([N+](=O)[O-])cc1C	ZINC000853655595	FF	On-Demand	Bother	CHRNA4	24	42
O=c1cccc2n1C[C@H]1C[C@@H]2CN(c2cnc(F)cn2)C1	ZINC000853655608	CD	On-Demand	Anodyne	CHRNA4	29	51
CC(C)(C)OC(=O)N1CCCc2cc(CNc3cc(F)ncn3)ccc21	ZINC000853655626	FH	On-Demand	Anodyne	GPR119	26	40
CCNc1nccnc1NC[C@@H](CC)NC(=O)OC(C)(C)C	ZINC000853655686	DF	On-Demand	Anodyne	CTSK	16	42
CCNc1nccnc1NC[C@H](CC)NC(=O)OC(C)(C)C	ZINC000853655687	DF	On-Demand	Anodyne	CTSK	16	42
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	PLG	18	47
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	DRD4	45	34
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	MAPK14	38	41
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	FAAH	20	40
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	EPHX2	16	42
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	PLAU	24	44
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	ST14	19	47
C=C(Cl)COc1cccc(C(=O)NC2CC2)c1	ZINC000853655711	CF	On-Demand	Mild	MCHR1	18	45
O=C(NC1CC1)c1cccc(OCCC2SCCS2)c1	ZINC000853655747	DG	On-Demand	Anodyne	PLG	17	44
O=C(NC1CC1)c1cccc(OCCC2SCCS2)c1	ZINC000853655747	DG	On-Demand	Anodyne	DRD4	41	31
O=C(NC1CC1)c1cccc(OCCC2SCCS2)c1	ZINC000853655747	DG	On-Demand	Anodyne	PLAU	23	41
O=C(NC1CC1)c1cccc(OCCC2SCCS2)c1	ZINC000853655747	DG	On-Demand	Anodyne	ST14	18	44
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccnc1	ZINC000853655751	DE	On-Demand	Anodyne	GRIN2B	28	45
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cccnc1	ZINC000853655751	DE	On-Demand	Anodyne	SMO	39	40
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccnc1	ZINC000853655752	DE	On-Demand	Anodyne	GRIN2B	28	45
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cccnc1	ZINC000853655752	DE	On-Demand	Anodyne	SMO	39	40
O=C(NC1CCCC1)c1ccccc1OCC1=NS(=O)(=O)c2ccccc21	ZINC000853655785	GF	On-Demand	Anodyne	CNR2	17	42
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C(=O)CN(c3ccccc3)C2=O)CC1	ZINC000853655795	GD	On-Demand	Anodyne	P2RY12	144	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2C(=O)CN(c3ccccc3)C2=O)CC1	ZINC000853655796	GD	On-Demand	Anodyne	P2RY12	144	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2nc(C)cs2)CC1	ZINC000853655821	GD	On-Demand	Anodyne	P2RY12	45	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2nc(C)cs2)CC1	ZINC000853655822	GD	On-Demand	Anodyne	P2RY12	45	37
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	CHRM2	23	46
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	CHRM1	24	46
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	DRD2	36	52
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	DRD4	68	50
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	ACHE	49	48
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	DRD3	21	52
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	SLC6A3	17	42
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	KCNH2	19	45
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	HTR4	41	43
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	CHRM3	34	46
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	LTA4H	26	43
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	SIGMAR1	71	63
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	SSTR5	66	40
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	CCR3	40	48
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	CCR5	31	40
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	SLC6A5	19	43
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	MCHR1	63	51
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	CACNA1G	33	42
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	CCR8	21	48
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	BIRC2	40	41
C[C@@H](ONC(=N)Cc1ccccc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655848	GF	On-Demand	Anodyne	NPFFR1	40	34
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	PLG	18	46
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	DRD4	43	33
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	PDE4B	44	35
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	FAAH	19	40
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	SLC6A5	33	40
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	PLAU	23	41
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	ST14	19	46
O=C(NC1CC1)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853655856	DG	On-Demand	Anodyne	MCHR1	18	44
CC[C@@H](CNc1ccc([N+](=O)[O-])c(C(N)=O)c1)NC(=O)OC(C)(C)C	ZINC000853655920	FE	On-Demand	Bother	GSTM2	15	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	PLG	23	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	DRD4	45	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	P2RY12	199	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	MAPK14	37	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	SSTR5	42	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	TRY2_BOVIN	58	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	MAPK13	43	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	PLAU	26	52
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	ST14	61	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	MCHR1	18	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655937	GD	On-Demand	Anodyne	CCR8	23	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	PLG	23	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	DRD4	45	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	P2RY12	199	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	MAPK14	37	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	SSTR5	42	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	TRY2_BOVIN	58	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	MAPK13	43	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	PLAU	26	52
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	ST14	61	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	MCHR1	18	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NC3CC3)c2)CC1	ZINC000853655939	GD	On-Demand	Anodyne	CCR8	23	41
CCC(=N)NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853655993	ED	On-Demand	Anodyne	EPHX2	18	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C)cc(=O)n3nccc23)CC1	ZINC000853655994	FC	On-Demand	Anodyne	P2RY12	84	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C)cc(=O)n3nccc23)CC1	ZINC000853655996	FC	On-Demand	Anodyne	P2RY12	84	38
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	CHRM2	17	45
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	CHRM1	19	50
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	DRD2	24	45
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	DRD4	48	51
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	ACHE	45	52
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	KCNH2	19	42
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	CHRM3	24	50
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	LTA4H	22	41
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	SIGMAR1	46	50
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	SSTR5	75	44
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	CHRNA7	45	39
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	C3AR1	45	42
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	PDK1	46	37
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	MCHR1	57	47
C[C@@H](ONC(=N)c1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853655998	GE	On-Demand	Anodyne	CCR8	28	41
C#CCCN(CCOC)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000853656022	DF	On-Demand	Mild	MME	51	38
C#CCCN(CCOC)C(=O)N[C@@H](CC)Cc1ccccc1	ZINC000853656022	DF	On-Demand	Mild	PTGES	15	45
C#CCCN(CCOC)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000853656023	DF	On-Demand	Mild	MME	51	38
C#CCCN(CCOC)C(=O)N[C@H](CC)Cc1ccccc1	ZINC000853656023	DF	On-Demand	Mild	PTGES	15	45
Fc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000853656052	CF	On-Demand	Anodyne	CHRNA2	30	41
Fc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000853656052	CF	On-Demand	Anodyne	CASP3	38	40
Fc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000853656052	CF	On-Demand	Anodyne	CHRNA3	30	41
Fc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000853656052	CF	On-Demand	Anodyne	CHRNA4	15	41
Fc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000853656052	CF	On-Demand	Anodyne	CHRNA10	103	52
Fc1cc(N2CCC[C@H]2COc2ccccc2)ncn1	ZINC000853656052	CF	On-Demand	Anodyne	CASP7	38	41
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	PLG	17	45
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	DRD4	41	33
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	MAPK14	48	41
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	SSTR5	40	36
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	CACNA1D	16	49
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	PDE4B	53	32
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	MAPK13	70	34
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	ST14	18	45
Cc1nonc1COc1cccc(C(=O)NC2CC2)c1	ZINC000853656060	CD	On-Demand	Anodyne	MCHR1	15	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccc(C)c(F)c2)CC1	ZINC000853656078	GD	On-Demand	Anodyne	P2RY12	65	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccc(C)c(F)c2)CC1	ZINC000853656079	GD	On-Demand	Anodyne	P2RY12	65	40
C=C(Cl)COc1ccccc1C(=O)NC1CCCC1	ZINC000853656110	CG	On-Demand	Mild	DRD2	15	42
C=C(Cl)COc1ccccc1C(=O)NC1CCCC1	ZINC000853656110	CG	On-Demand	Mild	CNR1	20	46
C=C(Cl)COc1ccccc1C(=O)NC1CCCC1	ZINC000853656110	CG	On-Demand	Mild	CNR2	31	46
C=C(Cl)COc1ccccc1C(=O)NC1CCCC1	ZINC000853656110	CG	On-Demand	Mild	KCNA3	40	39
C=C(Cl)COc1ccccc1C(=O)NC1CCCC1	ZINC000853656110	CG	On-Demand	Mild	HCN1	64	36
C=C(Cl)COc1ccccc1C(=O)NC1CCCC1	ZINC000853656110	CG	On-Demand	Mild	HCN4	53	36
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccnc2)CC1	ZINC000853656142	GE	On-Demand	Anodyne	DRD4	17	49
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccnc2)CC1	ZINC000853656142	GE	On-Demand	Anodyne	SIGMAR1	16	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccnc2)CC1	ZINC000853656142	GE	On-Demand	Anodyne	SSTR5	50	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccnc2)CC1	ZINC000853656142	GE	On-Demand	Anodyne	MCHR1	20	41
CO[C@@H](CONC(=N)CN1CCN(c2ccccc2)CC1)C1CCC1	ZINC000853656144	EE	On-Demand	Anodyne	DRD3	15	40
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	CHRM1	20	40
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	DRD4	24	54
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	SIGMAR1	21	48
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	SSTR5	46	39
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	CCR3	15	40
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	CCR2	15	48
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	MCHR1	28	40
CCC(=N)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853656154	ED	On-Demand	Anodyne	CCR8	38	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cccnc2=O)C1	ZINC000853656218	CD	On-Demand	Anodyne	GPR119	51	50
CC(C)(C)OC(=O)N1CC[C@H](CCn2cccnc2=O)C1	ZINC000853656219	CD	On-Demand	Anodyne	GPR119	51	50
CCN1CC[C@H](ONC(=N)Cc2ccccc2)C1=O	ZINC000853656245	CD	On-Demand	Anodyne	SLC12A5	42	33
O=C(NC1CC1)c1cccc(OCCOC(F)F)c1	ZINC000853656246	CE	On-Demand	Anodyne	PLG	17	44
O=C(NC1CC1)c1cccc(OCCOC(F)F)c1	ZINC000853656246	CE	On-Demand	Anodyne	DRD4	41	31
O=C(NC1CC1)c1cccc(OCCOC(F)F)c1	ZINC000853656246	CE	On-Demand	Anodyne	PLAU	23	41
O=C(NC1CC1)c1cccc(OCCOC(F)F)c1	ZINC000853656246	CE	On-Demand	Anodyne	ST14	18	44
O=C(NC1CC1)c1cccc(OCCOC(F)F)c1	ZINC000853656246	CE	On-Demand	Anodyne	MCHR1	15	44
N=C(CN1CCN(c2ccccc2)CC1)NOCc1csc(Cl)n1	ZINC000853656252	FF	On-Demand	Anodyne	DRD4	27	45
C#CCOCCOc1ccccc1C(=O)NC1CCCC1	ZINC000853656293	CE	On-Demand	Mild	CNR2	19	43
C#CCOCCOc1ccccc1C(=O)NC1CCCC1	ZINC000853656293	CE	On-Demand	Mild	HCN1	44	34
C#CCOCCOc1ccccc1C(=O)NC1CCCC1	ZINC000853656293	CE	On-Demand	Mild	HCN4	43	34
N=C(CN1CCN(c2ccccc2)CC1)NOCc1cccnc1N	ZINC000853656302	ED	On-Demand	Anodyne	DRD4	24	43
N=C(Cc1ccccc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656326	EF	On-Demand	Anodyne	GRIN2B	55	40
N=C(Cc1ccccc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656326	EF	On-Demand	Anodyne	SIGMAR1	19	40
N=C(Cc1ccccc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656326	EF	On-Demand	Anodyne	L3MBTL3	42	36
N=C(Cc1ccccc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656327	EF	On-Demand	Anodyne	GRIN2B	55	40
N=C(Cc1ccccc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656327	EF	On-Demand	Anodyne	SIGMAR1	19	40
N=C(Cc1ccccc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656327	EF	On-Demand	Anodyne	L3MBTL3	42	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2csc(C)n2)CC1	ZINC000853656345	GD	On-Demand	Anodyne	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2csc(C)n2)CC1	ZINC000853656346	GD	On-Demand	Anodyne	P2RY12	40	36
N#Cc1ccc(CCONC(=N)CN2CCN(c3ccccc3)CC2)cc1	ZINC000853656356	FE	On-Demand	Mild	DRD4	19	41
CN1C(=O)C(C(=N)NOCCOCc2ccccc2)=C(N)C12CCCC2	ZINC000853656415	FD	On-Demand	Anodyne	SLC12A5	57	34
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2cccnc2=O)CC1	ZINC000853656495	DF	On-Demand	Anodyne	ACACB	15	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccnc2)CC1	ZINC000853656518	EC	On-Demand	Anodyne	P2RY12	98	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccnc2)CC1	ZINC000853656519	EC	On-Demand	Anodyne	P2RY12	98	40
CCC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656529	CE	On-Demand	Anodyne	GRIN2B	40	36
CCC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656529	CE	On-Demand	Anodyne	SLC18A3	17	43
CCC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656529	CE	On-Demand	Anodyne	L3MBTL3	55	35
CCC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656530	CE	On-Demand	Anodyne	GRIN2B	40	36
CCC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656530	CE	On-Demand	Anodyne	SLC18A3	17	43
CCC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853656530	CE	On-Demand	Anodyne	L3MBTL3	55	35
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2cccnc2)C1	ZINC000853656538	ED	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2cccnc2)C1	ZINC000853656539	ED	On-Demand	Anodyne	GPR119	27	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2nccc(C(F)(F)F)n2)CC1	ZINC000853656566	GD	On-Demand	Anodyne	P2RY12	88	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2nccc(C(F)(F)F)n2)CC1	ZINC000853656567	GD	On-Demand	Anodyne	P2RY12	88	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cccnc2=O)CC1	ZINC000853656590	DC	On-Demand	Anodyne	P2RY12	75	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cccnc2=O)CC1	ZINC000853656591	DC	On-Demand	Anodyne	P2RY12	75	38
CC(C)(C)OC(=O)NCCCCCCCn1cccnc1=O	ZINC000853656662	DF	On-Demand	Anodyne	ASAH1	70	34
N=C(NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)c1cccnc1	ZINC000853656701	GD	On-Demand	Anodyne	C3AR1	45	43
CC(C)(C)OC(=O)N1CCC(CCn2cccnc2=O)CC1	ZINC000853656706	DE	On-Demand	Anodyne	GRIN2B	21	41
CC(C)(C)OC(=O)N1CCC(CCn2cccnc2=O)CC1	ZINC000853656706	DE	On-Demand	Anodyne	GPR119	61	56
C#C[C@@H](CO)Nc1nc2ccccc2n(CC)c1=O	ZINC000853656750	CC	On-Demand	Mild	PYGM	21	43
C#C[C@H](CO)Nc1nc2ccccc2n(CC)c1=O	ZINC000853656751	CC	On-Demand	Mild	PYGM	21	43
CC(=O)c1ccc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000853656807	FH	On-Demand	Bother	NPY1R	18	42
CC(=O)c1ccc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000853656807	FH	On-Demand	Bother	TAAR1	22	48
COc1ccc(CC(=N)NO[C@H](C)C(C)C)cc1	ZINC000853656823	CF	On-Demand	Anodyne	PROKR1	42	31
COc1ccc(CC(=N)NO[C@@H](C)C(C)C)cc1	ZINC000853656824	CF	On-Demand	Anodyne	PROKR1	42	31
C#CCOCCN(Cc1ccccc1)S(C)(=O)=O	ZINC000853656842	CD	On-Demand	Mild	PTGER2	15	44
CCN1CC[C@H](ONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656846	FE	On-Demand	Anodyne	PGC	45	30
CCN1CC[C@H](ONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656846	FE	On-Demand	Anodyne	PAPA1_CARPA	28	40
CCN1CC[C@H](ONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656846	FE	On-Demand	Anodyne	CTSK	21	42
CCN1CC[C@H](ONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656846	FE	On-Demand	Anodyne	FPR1	48	38
CCN1CC[C@H](ONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656848	FE	On-Demand	Anodyne	PGC	45	30
CCN1CC[C@H](ONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656848	FE	On-Demand	Anodyne	PAPA1_CARPA	28	40
CCN1CC[C@H](ONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656848	FE	On-Demand	Anodyne	CTSK	21	42
CCN1CC[C@H](ONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C)C1=O	ZINC000853656848	FE	On-Demand	Anodyne	FPR1	48	38
CCC[C@@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853656849	GG	On-Demand	Anodyne	MME	48	36
CCC[C@@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853656849	GG	On-Demand	Anodyne	FPR1	16	40
CCC[C@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853656850	GG	On-Demand	Anodyne	MME	48	36
CCC[C@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853656850	GG	On-Demand	Anodyne	FPR1	16	40
CCn1ncnc1CONC(=N)Cc1ccc(OC)cc1	ZINC000853656873	CD	On-Demand	Anodyne	PROKR1	53	31
COC(=O)c1sc(N2CCC(NCc3ccccc3)CC2)nc1Cl	ZINC000853656892	FG	On-Demand	Anodyne	DRD4	20	44
COC(=O)c1sc(N2CCC(NCc3ccccc3)CC2)nc1Cl	ZINC000853656892	FG	On-Demand	Anodyne	SIGMAR1	19	43
COC(=O)c1sc(N2CCC(NCc3ccccc3)CC2)nc1Cl	ZINC000853656892	FG	On-Demand	Anodyne	SCD1	20	41
COC(=O)c1sc(N2CCC(NCc3ccccc3)CC2)nc1Cl	ZINC000853656892	FG	On-Demand	Anodyne	SCD	22	41
COC(=O)c1sc(N2CCC(NCc3ccccc3)CC2)nc1Cl	ZINC000853656892	FG	On-Demand	Anodyne	PARE	85	34
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	ESR1	93	44
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	KCNH2	17	43
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	ESR2	67	47
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	LTA4H	75	59
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	HRH3	89	61
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	SIGMAR1	19	42
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	PSMB2	61	62
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	PSMB1	66	62
FC(F)OCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656897	DG	On-Demand	Anodyne	MKNK1	20	40
CS(=O)(=O)N1CC[C@H](CN(Cc2ccccc2)S(C)(=O)=O)C1	ZINC000853656912	EC	On-Demand	Anodyne	RORC	34	45
CS(=O)(=O)N1CC[C@@H](CN(Cc2ccccc2)S(C)(=O)=O)C1	ZINC000853656913	EC	On-Demand	Anodyne	RORC	34	45
O=[N+]([O-])c1ccc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000853656921	FG	On-Demand	Bother	F2RL3	47	35
FC(F)(F)c1ccc(N2CCC(NCc3ccccc3)CC2)nc1Cl	ZINC000853656934	FJ	On-Demand	Anodyne	SFRP1	49	33
COC[C@@H](CN(Cc1ccccc1)S(C)(=O)=O)OC	ZINC000853656953	CD	On-Demand	Anodyne	RORC	23	41
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	ESR1	86	41
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	KCNH2	16	42
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	ESR2	62	43
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	LTA4H	72	57
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	HRH3	89	59
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	SIGMAR1	15	41
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	PSMB2	59	61
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	PSMB1	64	61
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	MKNK1	20	40
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	TBK1	16	40
C#CCOCCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656955	DF	On-Demand	Mild	BMP4	16	40
CCC[C@@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1CC	ZINC000853656957	FF	On-Demand	Anodyne	MME	42	34
CCC[C@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1CC	ZINC000853656958	FF	On-Demand	Anodyne	MME	42	34
CCC(CC)CN(Cc1ccccc1)S(C)(=O)=O	ZINC000853656961	CF	On-Demand	Anodyne	PTGER2	17	43
CCC(CC)CN(Cc1ccccc1)S(C)(=O)=O	ZINC000853656961	CF	On-Demand	Anodyne	RORC	35	46
CC[C@@H](CC(F)F)CN(Cc1ccccc1)S(C)(=O)=O	ZINC000853656969	DG	On-Demand	Anodyne	RORC	21	40
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	ESR1	80	45
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	ESR2	58	45
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	LTA4H	71	53
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	HRH3	91	52
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	SIGMAR1	17	40
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	HNMT	42	36
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	CYP2C19	17	43
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	PSMB2	54	53
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	PSMB1	59	53
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	MKNK1	21	43
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	TBK1	18	44
Cn1cncc1CCOc1ccc(OCCN2CCCCC2)cc1	ZINC000853656975	EF	On-Demand	Anodyne	BMP4	17	43
COc1ccc(CC(=N)NOCc2ncnn2CCF)cc1	ZINC000853656988	DD	On-Demand	Anodyne	PROKR1	59	32
CO[C@@H](CN(Cc1ccccc1)S(C)(=O)=O)[C@@H]1CCOC1	ZINC000853657011	DD	On-Demand	Anodyne	RORC	20	40
CO[C@@H](CN(Cc1ccccc1)S(C)(=O)=O)[C@H]1CCOC1	ZINC000853657012	DD	On-Demand	Anodyne	RORC	20	40
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@H]1CCOC1	ZINC000853657019	EF	On-Demand	Anodyne	ESR1	86	38
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@H]1CCOC1	ZINC000853657019	EF	On-Demand	Anodyne	ESR2	61	42
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@H]1CCOC1	ZINC000853657019	EF	On-Demand	Anodyne	LTA4H	61	47
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@H]1CCOC1	ZINC000853657019	EF	On-Demand	Anodyne	HRH3	80	49
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@H]1CCOC1	ZINC000853657019	EF	On-Demand	Anodyne	EBP	17	40
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@H]1CCOC1	ZINC000853657019	EF	On-Demand	Anodyne	PSMB2	48	46
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@H]1CCOC1	ZINC000853657019	EF	On-Demand	Anodyne	PSMB1	53	49
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@@H]1CCOC1	ZINC000853657020	EF	On-Demand	Anodyne	ESR1	86	38
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@@H]1CCOC1	ZINC000853657020	EF	On-Demand	Anodyne	ESR2	61	42
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@@H]1CCOC1	ZINC000853657020	EF	On-Demand	Anodyne	LTA4H	61	47
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@@H]1CCOC1	ZINC000853657020	EF	On-Demand	Anodyne	HRH3	80	49
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@@H]1CCOC1	ZINC000853657020	EF	On-Demand	Anodyne	EBP	17	40
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@@H]1CCOC1	ZINC000853657020	EF	On-Demand	Anodyne	PSMB2	48	46
CO[C@@H](COc1ccc(OCCN2CCCCC2)cc1)[C@@H]1CCOC1	ZINC000853657020	EF	On-Demand	Anodyne	PSMB1	53	49
CCC[C@@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C	ZINC000853657024	EE	On-Demand	Anodyne	MME	47	35
CCC[C@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C	ZINC000853657025	EE	On-Demand	Anodyne	MME	47	35
CCCn1ncnc1CONC(=N)Cc1ccc(OC)cc1	ZINC000853657036	DD	On-Demand	Anodyne	PROKR1	61	34
Nc1nc(Cl)cc(N2CCC(NCc3ccccc3)CC2)n1	ZINC000853657046	DE	On-Demand	Anodyne	HRH4	64	56
CCn1ncnc1CONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657049	FE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CCn1ncnc1CONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657049	FE	On-Demand	Anodyne	FPR1	48	38
CCn1ncnc1CONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657050	FE	On-Demand	Anodyne	PAPA1_CARPA	28	41
CCn1ncnc1CONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657050	FE	On-Demand	Anodyne	FPR1	48	38
CCN1CC[C@H](ONC(=N)Cc2ccc(OC)cc2)C1=O	ZINC000853657064	CD	On-Demand	Anodyne	MMP1	17	40
CCN1CC[C@H](ONC(=N)Cc2ccc(OC)cc2)C1=O	ZINC000853657064	CD	On-Demand	Anodyne	PROKR1	60	32
COC(=O)C1(CN(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657065	CD	On-Demand	Anodyne	PTGER2	18	42
COC(=O)C1(CN(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657065	CD	On-Demand	Anodyne	MMP8	16	44
COC(=O)C1(CN(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657065	CD	On-Demand	Anodyne	MMP9	20	44
COC(=O)C1(CN(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657065	CD	On-Demand	Anodyne	MMP1	17	44
CCCOc1cccc(CN(Cc2ccccc2)S(C)(=O)=O)c1	ZINC000853657073	EG	On-Demand	Anodyne	ACHE	15	42
CCCOc1cccc(CN(Cc2ccccc2)S(C)(=O)=O)c1	ZINC000853657073	EG	On-Demand	Anodyne	PTGER2	23	59
CCCOc1cccc(CN(Cc2ccccc2)S(C)(=O)=O)c1	ZINC000853657073	EG	On-Demand	Anodyne	SQLE	65	37
CCCOc1cccc(CN(Cc2ccccc2)S(C)(=O)=O)c1	ZINC000853657073	EG	On-Demand	Anodyne	DAGLA	27	40
CCCOc1cccc(CN(Cc2ccccc2)S(C)(=O)=O)c1	ZINC000853657073	EG	On-Demand	Anodyne	PDS	46	36
O=[N+]([O-])c1ccc2nc(N3CCC(NCc4ccccc4)CC3)sc2c1	ZINC000853657082	FH	On-Demand	Bother	NMT1	29	40
C=C(Cl)CONC(=N)Cc1ccc(OC)cc1	ZINC000853657092	CE	On-Demand	Mild	PROKR1	47	32
Cc1nonc1COc1ccc(OCCN2CCCCC2)cc1	ZINC000853657093	DF	On-Demand	Anodyne	ESR1	99	47
Cc1nonc1COc1ccc(OCCN2CCCCC2)cc1	ZINC000853657093	DF	On-Demand	Anodyne	KCNH2	17	43
Cc1nonc1COc1ccc(OCCN2CCCCC2)cc1	ZINC000853657093	DF	On-Demand	Anodyne	ESR2	70	49
Cc1nonc1COc1ccc(OCCN2CCCCC2)cc1	ZINC000853657093	DF	On-Demand	Anodyne	LTA4H	66	52
Cc1nonc1COc1ccc(OCCN2CCCCC2)cc1	ZINC000853657093	DF	On-Demand	Anodyne	HRH3	83	51
Cc1nonc1COc1ccc(OCCN2CCCCC2)cc1	ZINC000853657093	DF	On-Demand	Anodyne	PSMB2	54	52
Cc1nonc1COc1ccc(OCCN2CCCCC2)cc1	ZINC000853657093	DF	On-Demand	Anodyne	PSMB1	59	52
CO[C@@H](CN(Cc1ccccc1)S(C)(=O)=O)C1CCC1	ZINC000853657108	CE	On-Demand	Anodyne	RORC	20	41
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	GRIN2B	42	43
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	SIGMAR1	17	44
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	MMP13	37	48
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	CCR3	23	42
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	ADAM17	15	42
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	SLC18A3	20	47
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	MMP3	40	48
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	MMP9	34	48
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	MMP7	27	44
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657124	FF	On-Demand	Anodyne	MMP1	41	48
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	GRIN2B	42	43
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	SIGMAR1	17	44
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	MMP13	37	48
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	CCR3	23	42
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	ADAM17	15	42
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	SLC18A3	20	47
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	MMP3	40	48
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	MMP9	34	48
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	MMP7	27	44
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853657125	FF	On-Demand	Anodyne	MMP1	41	48
CCOC(=O)N1CCN(C(=O)[C@H](C)N(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657139	GD	On-Demand	Anodyne	P2RY12	125	42
CCOC(=O)N1CCN(C(=O)[C@H](C)N(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657139	GD	On-Demand	Anodyne	TRY2_BOVIN	53	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657140	GD	On-Demand	Anodyne	P2RY12	125	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(Cc2ccccc2)S(C)(=O)=O)CC1	ZINC000853657140	GD	On-Demand	Anodyne	TRY2_BOVIN	53	41
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853657148	GG	On-Demand	Anodyne	ACE	55	39
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853657148	GG	On-Demand	Anodyne	MME	40	39
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853657149	GG	On-Demand	Anodyne	ACE	55	39
CCC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853657149	GG	On-Demand	Anodyne	MME	40	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853657150	GG	On-Demand	Anodyne	ACE	55	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853657150	GG	On-Demand	Anodyne	MME	40	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853657151	GG	On-Demand	Anodyne	ACE	55	39
CCC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853657151	GG	On-Demand	Anodyne	MME	40	39
NC(=NOCCOCc1ccccc1)c1ccc(CN2CCOCC2)cc1	ZINC000853657166	FE	On-Demand	Mild	SIGMAR1	30	42
COc1ccc(CC(=N)NOCCc2nnn(C(C)(C)C)n2)cc1	ZINC000853657223	ED	On-Demand	Anodyne	PROKR1	54	32
Cc1nocc1CONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657248	EF	On-Demand	Anodyne	PAPA1_CARPA	36	43
Cc1nocc1CONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657248	EF	On-Demand	Anodyne	FPR1	50	39
Cc1nocc1CONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657250	EF	On-Demand	Anodyne	PAPA1_CARPA	36	43
Cc1nocc1CONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657250	EF	On-Demand	Anodyne	FPR1	50	39
CCCn1ncnc1CON=C(C)CCc1ccc(OC)cc1	ZINC000853657263	DG	On-Demand	Mild	PPO2	32	41
C=C[C@H](CO)NC(=O)N[C@@H](CCCCC)c1ccccc1	ZINC000853657330	CG	On-Demand	Mild	SOAT1	46	45
C=C[C@H](CO)NC(=O)N[C@H](CCCCC)c1ccccc1	ZINC000853657332	CG	On-Demand	Mild	SOAT1	46	45
Cc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cn1	ZINC000853657334	DE	On-Demand	Anodyne	GPR119	47	46
Cc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cn1	ZINC000853657336	DE	On-Demand	Anodyne	GPR119	47	46
c1ccc(CNC2CCN(c3ncnc4c3CCC4)CC2)cc1	ZINC000853657343	DF	On-Demand	Anodyne	ADRB3	15	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C(F)(F)F)n2)CC1	ZINC000853657350	ED	On-Demand	Anodyne	P2RY12	64	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C(F)(F)F)n2)CC1	ZINC000853657352	ED	On-Demand	Anodyne	P2RY12	64	38
N=C(NOCCOC(F)F)c1cccc(CN2CCCCC2)c1	ZINC000853657416	EF	On-Demand	Anodyne	HRH2	31	41
COC(=O)C1(CONC(=N)COc2ccc(Cl)cc2Cl)CC1	ZINC000853657443	EF	On-Demand	Anodyne	PTGDR2	20	41
COC(=O)C1(CONC(=N)c2cccc(CN3CCCCC3)c2)CC1	ZINC000853657452	EE	On-Demand	Anodyne	HRH2	48	44
COC(=O)C1(CONC(=N)c2cccc(CN3CCCCC3)c2)CC1	ZINC000853657452	EE	On-Demand	Anodyne	NPFFR1	41	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnn2)CC1	ZINC000853657464	CC	On-Demand	Anodyne	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnn2)CC1	ZINC000853657466	CC	On-Demand	Anodyne	P2RY12	40	36
CCC1(Nc2ccc3c(c2)S(=O)(=O)N=C3Cl)CCCC1	ZINC000853657473	DH	On-Demand	Anodyne	ABCC8	42	33
COc1ccc(CC(=N)NOCc2cc(C)nc(C)n2)cc1	ZINC000853657479	DE	On-Demand	Anodyne	PROKR1	47	31
COc1ccc(CC(=N)NOCc2ncnn2C(C)C)cc1	ZINC000853657509	DE	On-Demand	Anodyne	PROKR1	44	31
COC(=O)C1(CONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657517	CD	On-Demand	Anodyne	CA9	20	44
COc1cc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853657520	FG	On-Demand	Clean	HTR1A	16	40
COc1cc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853657520	FG	On-Demand	Clean	DRD2	21	43
COc1cc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853657520	FG	On-Demand	Clean	DRD4	21	40
COc1cc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853657520	FG	On-Demand	Clean	DRD3	17	40
COc1cc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853657520	FG	On-Demand	Clean	NPY1R	17	40
CCCC[C@H]1NC(=O)N([C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657536	FC	On-Demand	Anodyne	P2RY12	42	32
CCCC[C@H]1NC(=O)N([C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657536	FC	On-Demand	Anodyne	C5AR1	16	40
CCCC[C@@H]1NC(=O)N([C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657538	FC	On-Demand	Anodyne	P2RY12	42	32
CCCC[C@@H]1NC(=O)N([C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657538	FC	On-Demand	Anodyne	C5AR1	16	40
CCCC[C@H]1NC(=O)N([C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657540	FC	On-Demand	Anodyne	P2RY12	42	32
CCCC[C@H]1NC(=O)N([C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657540	FC	On-Demand	Anodyne	C5AR1	16	40
CCCC[C@@H]1NC(=O)N([C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657542	FC	On-Demand	Anodyne	P2RY12	42	32
CCCC[C@@H]1NC(=O)N([C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)C1=O	ZINC000853657542	FC	On-Demand	Anodyne	C5AR1	16	40
O=[N+]([O-])c1ccc(N2CCC(NCc3ccccc3)CC2)c(F)c1	ZINC000853657563	EG	On-Demand	Bother	F2RL3	46	34
N=C(NOCCC1(O)CCC1)c1cccc(CN2CCCCC2)c1	ZINC000853657584	EF	On-Demand	Anodyne	HRH2	30	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)COC(C)C)CC1	ZINC000853657590	GD	On-Demand	Anodyne	DRD4	17	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)COC(C)C)CC1	ZINC000853657590	GD	On-Demand	Anodyne	SIGMAR1	18	45
COC[C@@H](CON=C(C)CCc1ccc(OC)cc1)OC	ZINC000853657615	CF	On-Demand	Mild	PPO2	33	46
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657632	GD	On-Demand	Anodyne	P2RY12	76	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657632	GD	On-Demand	Anodyne	BMP1	19	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657632	GD	On-Demand	Anodyne	MMP13	16	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657632	GD	On-Demand	Anodyne	MTNR1B	15	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657632	GD	On-Demand	Anodyne	MMP3	17	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657632	GD	On-Demand	Anodyne	DPP7	17	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657632	GD	On-Demand	Anodyne	MMP1	20	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657633	GD	On-Demand	Anodyne	P2RY12	76	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657633	GD	On-Demand	Anodyne	BMP1	19	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657633	GD	On-Demand	Anodyne	MMP13	16	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657633	GD	On-Demand	Anodyne	MTNR1B	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657633	GD	On-Demand	Anodyne	MMP3	17	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657633	GD	On-Demand	Anodyne	DPP7	17	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(OC)cc2)CC1	ZINC000853657633	GD	On-Demand	Anodyne	MMP1	20	41
COC(=O)c1cnc(N2CCC(NCc3ccccc3)CC2)cc1C(F)(F)F	ZINC000853657644	GH	On-Demand	Anodyne	RBP4	53	37
COC(=O)c1cnc(N2CCC(NCc3ccccc3)CC2)cc1C(F)(F)F	ZINC000853657644	GH	On-Demand	Anodyne	SCD1	48	38
COC(=O)c1cnc(N2CCC(NCc3ccccc3)CC2)cc1C(F)(F)F	ZINC000853657644	GH	On-Demand	Anodyne	SFRP1	111	37
COC(=O)c1cnc(N2CCC(NCc3ccccc3)CC2)cc1C(F)(F)F	ZINC000853657644	GH	On-Demand	Anodyne	WNT3	73	35
COC(=O)C1(CON=C(C)CCc2ccc(OC)cc2)CC1	ZINC000853657648	DF	On-Demand	Mild	PPO2	34	45
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	MME	84	39
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	ANPEP	44	33
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	PAPA1_CARPA	49	38
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	CAPNS1	59	36
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	CAPN1	53	39
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	CAPN2	66	36
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	FPR1	26	42
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	CTRB_BOVIN	46	32
CCC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657669	CE	On-Demand	Anodyne	NPR	43	37
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	MME	84	39
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	ANPEP	44	33
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	PAPA1_CARPA	49	38
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	CAPNS1	59	36
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	CAPN1	53	39
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	CAPN2	66	36
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	FPR1	26	42
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	CTRB_BOVIN	46	32
CCC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853657670	CE	On-Demand	Anodyne	NPR	43	37
COC(=O)/C=C\c1ccc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000853657716	GH	On-Demand	Clean	NPY1R	23	43
COC(=O)/C=C\c1ccc(N2CCC(NCc3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000853657716	GH	On-Demand	Clean	NR1H4	44	40
COc1ccc(CC(=N)NOCc2ccc(C#N)cc2C(F)(F)F)cc1OC	ZINC000853657731	GH	On-Demand	Mild	ESRRA	25	40
C#CCCN(CCOC)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000853657748	DG	On-Demand	Mild	CTRB_BOVIN	44	31
C#CCCN(CCOC)C(=O)N[C@H](CCC)Cc1ccccc1	ZINC000853657748	DG	On-Demand	Mild	PTGES	18	41
C#CCCN(CCOC)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000853657750	DG	On-Demand	Mild	CTRB_BOVIN	44	31
C#CCCN(CCOC)C(=O)N[C@@H](CCC)Cc1ccccc1	ZINC000853657750	DG	On-Demand	Mild	PTGES	18	41
Cn1cncc1CCN(Cc1ccccc1)S(C)(=O)=O	ZINC000853657752	CD	On-Demand	Anodyne	PTGER2	15	41
N=C(NOCCOC(F)F)c1cccc(OCc2cccnc2)c1	ZINC000853657761	EF	On-Demand	Anodyne	ACR	18	41
COc1ccc(CC(=N)NOCc2cccnc2N)cc1OC	ZINC000853657771	DD	On-Demand	Anodyne	FOLA	21	42
COc1ccc(CC(=N)NOCc2cccnc2N)cc1OC	ZINC000853657771	DD	On-Demand	Anodyne	DRTS_PLAFK	36	42
CON(C)CCNC(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000853657777	CE	On-Demand	Anodyne	AMY2	60	35
CON(C)CCNC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000853657779	CE	On-Demand	Anodyne	AMY2	60	35
N=C(NOCC1C[C@@H]2C[C@H]2C1)c1cccc(OCc2cccnc2)c1	ZINC000853657796	EH	On-Demand	Anodyne	ACR	15	40
N=C(NOCC1C[C@H]2C[C@@H]2C1)c1cccc(OCc2cccnc2)c1	ZINC000853657799	EH	On-Demand	Anodyne	ACR	15	40
COc1ccc(CC(=N)NOC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657800	ED	On-Demand	Anodyne	MMP13	37	45
COc1ccc(CC(=N)NOC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657800	ED	On-Demand	Anodyne	MMP3	43	45
COc1ccc(CC(=N)NOC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657800	ED	On-Demand	Anodyne	MMP9	31	45
COc1ccc(CC(=N)NOC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657800	ED	On-Demand	Anodyne	MMP7	38	45
COc1ccc(CC(=N)NOC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657800	ED	On-Demand	Anodyne	MMP1	40	45
N=C(NOC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(OCc2cccnc2)c1	ZINC000853657801	EH	On-Demand	Anodyne	ACR	15	40
COc1ccc(CC(=N)NOC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657805	ED	On-Demand	Anodyne	MMP13	37	45
COc1ccc(CC(=N)NOC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657805	ED	On-Demand	Anodyne	MMP3	43	45
COc1ccc(CC(=N)NOC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657805	ED	On-Demand	Anodyne	MMP9	31	45
COc1ccc(CC(=N)NOC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657805	ED	On-Demand	Anodyne	MMP7	38	45
COc1ccc(CC(=N)NOC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853657805	ED	On-Demand	Anodyne	MMP1	40	45
CCC[C@@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853657811	FG	On-Demand	Anodyne	MME	40	35
CCC[C@H](Cc1ccccc1)NC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853657816	FG	On-Demand	Anodyne	MME	40	35
Cc1nonc1CONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657871	EE	On-Demand	Anodyne	PAPA1_CARPA	28	46
Cc1nonc1CONC(=N)[C@@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657871	EE	On-Demand	Anodyne	FPR1	48	37
Cc1nonc1CONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657873	EE	On-Demand	Anodyne	PAPA1_CARPA	28	46
Cc1nonc1CONC(=N)[C@H](CC(C)C)NC(=O)OC(C)(C)C	ZINC000853657873	EE	On-Demand	Anodyne	FPR1	48	37
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(CN3CCCCC3)c2)C1	ZINC000853657874	GD	On-Demand	Anodyne	TRY2_BOVIN	67	37
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(CN3CCCCC3)c2)C1	ZINC000853657874	GD	On-Demand	Anodyne	ST14	70	33
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(CN3CCCCC3)c2)C1	ZINC000853657886	GD	On-Demand	Anodyne	TRY2_BOVIN	67	37
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(CN3CCCCC3)c2)C1	ZINC000853657886	GD	On-Demand	Anodyne	ST14	70	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccc(F)c(F)c2)CC1	ZINC000853657897	GD	On-Demand	Anodyne	P2RY12	69	40
C[C@@H](NC(=O)NC[C@]12OCCC[C@H]1C2(F)F)C(C)(C)c1ccccc1	ZINC000853657898	FG	On-Demand	Anodyne	AMY2	49	36
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccc(F)c(F)c2)CC1	ZINC000853657900	GD	On-Demand	Anodyne	P2RY12	69	40
COCCN(CCF)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000853657901	DF	On-Demand	Anodyne	AMY2	59	36
COCCN(CCF)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000853657903	DF	On-Demand	Anodyne	AMY2	59	36
COC(=O)C1(CONC(=N)c2ccccc2OCc2ccccc2)CC1	ZINC000853657904	FG	On-Demand	Anodyne	PTGER1	28	41
COC(=O)C1(CONC(=N)c2ccccc2OCc2ccccc2)CC1	ZINC000853657904	FG	On-Demand	Anodyne	KCNA3	42	36
COC(=O)C1(CONC(=N)c2ccccc2OCc2ccccc2)CC1	ZINC000853657904	FG	On-Demand	Anodyne	SLC12A5	63	40
COC(=O)C1(CONC(=N)c2ccccc2OCc2ccccc2)CC1	ZINC000853657904	FG	On-Demand	Anodyne	HCN1	60	42
COC(=O)C1(CONC(=N)c2ccccc2OCc2ccccc2)CC1	ZINC000853657904	FG	On-Demand	Anodyne	HCN4	46	30
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3ncccc3c2)CC1	ZINC000853657948	FE	On-Demand	Anodyne	P2RY12	153	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3ncccc3c2)CC1	ZINC000853657948	FE	On-Demand	Anodyne	CCKAR	18	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3ncccc3c2)CC1	ZINC000853657950	FE	On-Demand	Anodyne	P2RY12	153	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3ncccc3c2)CC1	ZINC000853657950	FE	On-Demand	Anodyne	CCKAR	18	41
C[C@@H](NC(=O)NCC1SCCS1)C(C)(C)c1ccccc1	ZINC000853657971	DG	On-Demand	Anodyne	AMY2	54	33
C[C@H](NC(=O)NCC1SCCS1)C(C)(C)c1ccccc1	ZINC000853657974	DG	On-Demand	Anodyne	AMY2	54	33
C=C(Cl)CN(Cc1ccccc1)S(C)(=O)=O	ZINC000853657976	CE	On-Demand	Mild	PTGER2	19	48
C=C(Cl)CN(Cc1ccccc1)S(C)(=O)=O	ZINC000853657976	CE	On-Demand	Mild	RORC	30	42
C#CCOCCOc1ccc(Cl)cc1C(=O)OC	ZINC000853657978	CE	On-Demand	Mild	AGPAT2	42	33
COC(=O)C1(COc2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000853657989	CF	On-Demand	Bother	F10	46	31
COc1ccc(CC(=N)NOCc2cn(C(C)(C)C)nn2)cc1	ZINC000853658038	DE	On-Demand	Anodyne	PROKR1	64	35
CCN1CC[C@H](ONC(=N)c2cccc(OCc3cccnc3)c2)C1=O	ZINC000853658104	FE	On-Demand	Anodyne	SLC6A5	15	40
COC(=O)C1(CON=C(N)c2ccc(CN3CCOCC3)cc2)CC1	ZINC000853658150	ED	On-Demand	Mild	NPFFR1	39	40
CCN1CC[C@H](ONC(=N)c2ccccc2OCc2ccccc2)C1=O	ZINC000853658180	FF	On-Demand	Anodyne	PTGER1	22	41
CCN1CC[C@H](ONC(=N)c2ccccc2OCc2ccccc2)C1=O	ZINC000853658180	FF	On-Demand	Anodyne	HCN1	40	40
N=C(NOCCC1(O)CCC1)c1ccccc1OCc1ccccc1	ZINC000853658186	EG	On-Demand	Anodyne	PPIA	18	40
N=C(NOCc1cc(C2CC2)no1)c1cccc(CN2CCCCC2)c1	ZINC000853658209	FH	On-Demand	Anodyne	BDKRB1	32	41
COc1ccc(CC(=N)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853658335	GF	On-Demand	Anodyne	ACHE	15	41
COc1ccc(CC(=N)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853658337	GF	On-Demand	Anodyne	ACHE	15	41
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(CN3CCOCC3)c2)C1	ZINC000853658360	GC	On-Demand	Anodyne	TRY2_BOVIN	42	34
CS(=O)(=O)N1CC[C@H](CONC(=N)c2cccc(CN3CCOCC3)c2)C1	ZINC000853658360	GC	On-Demand	Anodyne	ST14	45	32
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(CN3CCOCC3)c2)C1	ZINC000853658367	GC	On-Demand	Anodyne	TRY2_BOVIN	42	34
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2cccc(CN3CCOCC3)c2)C1	ZINC000853658367	GC	On-Demand	Anodyne	ST14	45	32
N=C(NOCc1cncs1)c1cccc(CN2CCCCC2)c1	ZINC000853658422	EG	On-Demand	Anodyne	CYP3A4	40	39
CCN1CC[C@H](ONC(=N)c2ccccc2CN2CCCCC2)C1=O	ZINC000853658427	EE	On-Demand	Anodyne	SLC6A1	43	36
CC(C)(C)NC(=O)CCNC(=O)NNc1cc(F)cc(Cl)c1	ZINC000853658446	EE	On-Demand	Reactive	CACNA1H	21	44
CC(C)(C)NC(=O)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853658448	FF	On-Demand	Reactive	LCK	22	41
CC(C)(C)NC(=O)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853658448	FF	On-Demand	Reactive	CSNK1D	45	47
CS(=O)(=O)N1CC[C@H](CONC(=N)c2ccccc2CN2CCCCC2)C1	ZINC000853658460	GD	On-Demand	Anodyne	SLC6A1	40	33
CS(=O)(=O)N1CC[C@@H](CONC(=N)c2ccccc2CN2CCCCC2)C1	ZINC000853658461	GD	On-Demand	Anodyne	SLC6A1	40	33
O[C@@]1(C(F)F)CCN(c2nc(NCc3ccccc3)c3ccccc3n2)C1	ZINC000853658472	FG	On-Demand	Anodyne	HRH4	16	45
O[C@]1(C(F)F)CCN(c2nc(NCc3ccccc3)c3ccccc3n2)C1	ZINC000853658473	FG	On-Demand	Anodyne	HRH4	16	45
COC(=O)C1(CONC(=N)CCc2ccccc2)CC1	ZINC000853658497	CE	On-Demand	Anodyne	SLC12A5	46	38
CCN1CC[C@H](ONC(=N)c2cccc(CN3CCCCC3)c2)C1=O	ZINC000853658552	EE	On-Demand	Anodyne	HRH2	48	42
CCN1CC[C@H](ONC(=N)c2cccc(CN3CCCCC3)c2)C1=O	ZINC000853658552	EE	On-Demand	Anodyne	F10	15	40
Cn1cncc1CCONC(=N)c1cccc(CN2CCCCC2)c1	ZINC000853658598	EE	On-Demand	Anodyne	HRH2	39	40
COc1ccc(CC(=N)NOCCOCc2ccccc2)cc1OC	ZINC000853658640	EF	On-Demand	Anodyne	DRTS_PLAFK	31	42
CCOC(=O)c1nccc(N2C[C@H](F)[C@H](F)C2)n1	ZINC000853658663	CD	On-Demand	Anodyne	SORD	61	48
CCN1CC[C@H](ON=C(N)c2ccc(OCc3cccnc3)cc2)C1=O	ZINC000853658669	FD	On-Demand	Mild	SLC6A5	22	42
N=C(CCc1ccccc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853658677	FG	On-Demand	Anodyne	GRIN2B	53	44
N=C(CCc1ccccc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853658680	FG	On-Demand	Anodyne	GRIN2B	53	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCC(C)C)CC1	ZINC000853658719	ED	On-Demand	Anodyne	P2RY12	41	39
Nc1nc(Cl)cc(N2CCCN(c3ccccc3Cl)CC2)n1	ZINC000853658740	EG	On-Demand	Anodyne	KCNQ2	41	37
Nc1nc(Cl)cc(N2CCCN(c3ccccc3Cl)CC2)n1	ZINC000853658740	EG	On-Demand	Anodyne	HRH4	52	53
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCC(C)C)CC1	ZINC000853658766	ED	On-Demand	Anodyne	P2RY12	41	39
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)CCC(C)C)CC1	ZINC000853658777	FG	On-Demand	Anodyne	DRD4	21	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)CCC(C)C)CC1	ZINC000853658777	FG	On-Demand	Anodyne	SIGMAR1	18	45
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)CCC(C)C)CC1	ZINC000853658777	FG	On-Demand	Anodyne	MCHR1	29	40
C[C@@H](NC(=O)NCCC1SCCS1)C(C)(C)c1ccccc1	ZINC000853658797	EH	On-Demand	Anodyne	AMY2	43	31
C[C@H](NC(=O)NCCC1SCCS1)C(C)(C)c1ccccc1	ZINC000853658802	EH	On-Demand	Anodyne	AMY2	43	31
CO[C@@H](CONC(=N)CCc1ccccc1)C1CCC1	ZINC000853658828	CF	On-Demand	Anodyne	SLC18A2	44	39
COC(=O)C1(CON=C(N)c2ccc(OCc3cccnc3)cc2)CC1	ZINC000853658891	FE	On-Demand	Mild	PTAFR	22	41
COC(=O)C1(CON=C(N)c2ccc(OCc3ccccc3)cc2)CC1	ZINC000853658909	FF	On-Demand	Mild	MAOB	19	43
COC(=O)C1(CON=C(N)c2ccc(OCc3ccccc3)cc2)CC1	ZINC000853658909	FF	On-Demand	Mild	LTA4H	27	44
COC(=O)C1(CON=C(N)c2ccc(OCc3ccccc3)cc2)CC1	ZINC000853658909	FF	On-Demand	Mild	ADAM17	30	48
COC(=O)C1(CON=C(N)c2ccc(OCc3ccccc3)cc2)CC1	ZINC000853658909	FF	On-Demand	Mild	SLC12A5	52	38
N=C(NOCC1CC=CC1)c1cccc(OCc2cccnc2)c1	ZINC000853658939	DG	On-Demand	Anodyne	ACR	15	41
CCn1ncnc1CON=C(C)CCc1ccc(OC)cc1	ZINC000853658943	DF	On-Demand	Mild	PPO2	32	43
CC(C)c1ccc2ncnc(N3C[C@H](F)[C@H](F)C3)c2c1	ZINC000853658954	CG	On-Demand	Anodyne	PDE3A	43	44
CC(C)c1ccc2ncnc(N3C[C@H](F)[C@H](F)C3)c2c1	ZINC000853658954	CG	On-Demand	Anodyne	PDE3B	47	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)nc2)CC1	ZINC000853658967	DD	On-Demand	Anodyne	P2RY12	133	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)nc2)CC1	ZINC000853658969	DD	On-Demand	Anodyne	P2RY12	133	38
Cc1cc(C(F)(F)F)c(NCc2cccnc2N)nn1	ZINC000853659030	CE	On-Demand	Anodyne	PTK2	53	33
Cc1nc(N2CCC=C(c3cccnc3)C2)c2cnn(C)c2n1	ZINC000853659033	DE	On-Demand	Anodyne	ROS1	30	42
COC[C@@H](CON=C(N)c1ccc(OCc2ccccc2)cc1)OC	ZINC000853659040	EF	On-Demand	Mild	MAOB	17	41
COC[C@@H](CON=C(N)c1ccc(OCc2ccccc2)cc1)OC	ZINC000853659040	EF	On-Demand	Mild	ACR	24	40
COC(=O)C1(CONC(=N)c2ccccc2CN2CCCCC2)CC1	ZINC000853659092	EE	On-Demand	Anodyne	NPFFR1	42	37
C#CCOCCON=C(C)CCc1ccc(OC)cc1	ZINC000853659093	CF	On-Demand	Mild	PPO2	32	44
COC[C@@H](CONC(=N)c1cccc(CN2CCCCC2)c1)OC	ZINC000853659135	EE	On-Demand	Anodyne	HRH2	34	43
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(-c3ccccc3)cn2)CC1	ZINC000853659140	FE	On-Demand	Anodyne	P2RY12	209	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(-c3ccccc3)cn2)CC1	ZINC000853659142	FE	On-Demand	Anodyne	P2RY12	209	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659144	GE	On-Demand	Anodyne	P2RY12	135	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659144	GE	On-Demand	Anodyne	MC4R	73	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659144	GE	On-Demand	Anodyne	KCNQ2	46	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659144	GE	On-Demand	Anodyne	DPP7	30	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659146	GE	On-Demand	Anodyne	P2RY12	135	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659146	GE	On-Demand	Anodyne	MC4R	73	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659146	GE	On-Demand	Anodyne	KCNQ2	46	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2Cl)CC1	ZINC000853659146	GE	On-Demand	Anodyne	DPP7	30	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccnc2Br)C1	ZINC000853659159	FF	On-Demand	Anodyne	GPR119	36	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2Br)CC1	ZINC000853659200	GD	On-Demand	Anodyne	P2RY12	76	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2Br)CC1	ZINC000853659200	GD	On-Demand	Anodyne	GPR119	16	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2Br)CC1	ZINC000853659204	GD	On-Demand	Anodyne	P2RY12	76	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2Br)CC1	ZINC000853659204	GD	On-Demand	Anodyne	GPR119	16	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(=O)OC)nn2)CC1	ZINC000853659219	EB	On-Demand	Anodyne	P2RY12	82	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(=O)OC)nn2)CC1	ZINC000853659222	EB	On-Demand	Anodyne	P2RY12	82	38
CC(C)c1ccc2ncnc(N3CC[C@@](O)(C(F)F)C3)c2c1	ZINC000853659245	DF	On-Demand	Anodyne	PDGFRB	25	41
CC(C)c1ccc2ncnc(N3CC[C@@](O)(C(F)F)C3)c2c1	ZINC000853659245	DF	On-Demand	Anodyne	PDE3B	40	38
CC(C)c1ccc2ncnc(N3CC[C@](O)(C(F)F)C3)c2c1	ZINC000853659247	DF	On-Demand	Anodyne	PDGFRB	25	41
CC(C)c1ccc2ncnc(N3CC[C@](O)(C(F)F)C3)c2c1	ZINC000853659247	DF	On-Demand	Anodyne	PDE3B	40	38
O[C@@]1(C(F)F)CCN(c2nc3ccccc3n3cccc23)C1	ZINC000853659251	DF	On-Demand	Anodyne	HTR3A	27	46
O[C@]1(C(F)F)CCN(c2nc3ccccc3n3cccc23)C1	ZINC000853659255	DF	On-Demand	Anodyne	HTR3A	27	46
COC(=O)c1sc(N2CCCN(c3ccccc3Cl)CC2)nc1Cl	ZINC000853659256	GH	On-Demand	Anodyne	DRD3	40	37
COC(=O)c1sc(N2CCCN(c3ccccc3Cl)CC2)nc1Cl	ZINC000853659256	GH	On-Demand	Anodyne	KCNQ2	62	39
CCN1CC[C@H](ONC(=N)Cc2ccccc2Cl)C1=O	ZINC000853659326	CE	On-Demand	Anodyne	P2RX7	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)CC1	ZINC000853659359	GE	On-Demand	Bother	P2RY12	45	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([N+](=O)[O-])c(Cl)c2)CC1	ZINC000853659367	GE	On-Demand	Bother	P2RY12	45	36
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C2CCCCC2)CC1	ZINC000853659450	GG	On-Demand	Anodyne	CHRM1	19	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C2CCCCC2)CC1	ZINC000853659450	GG	On-Demand	Anodyne	DRD4	21	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C2CCCCC2)CC1	ZINC000853659450	GG	On-Demand	Anodyne	SIGMAR1	22	46
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659504	GD	On-Demand	Anodyne	ACE	36	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659504	GD	On-Demand	Anodyne	GHRHR	54	34
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659504	GD	On-Demand	Anodyne	P2RY12	193	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659504	GD	On-Demand	Anodyne	TRY2_BOVIN	48	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659504	GD	On-Demand	Anodyne	ST14	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659505	GD	On-Demand	Anodyne	ACE	36	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659505	GD	On-Demand	Anodyne	GHRHR	54	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659505	GD	On-Demand	Anodyne	P2RY12	193	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659505	GD	On-Demand	Anodyne	TRY2_BOVIN	48	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCc2ccccc2)CC1	ZINC000853659505	GD	On-Demand	Anodyne	ST14	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C=O)cc2Cl)CC1	ZINC000853659544	FE	On-Demand	Anodyne	P2RY12	53	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C=O)cc2Cl)CC1	ZINC000853659546	FE	On-Demand	Anodyne	P2RY12	53	36
COC(=O)c1sc(N2CCC=C(c3cccnc3)C2)nc1Cl	ZINC000853659560	EG	On-Demand	Anodyne	CYP11B2	16	42
COC(=O)c1nccc(N2CC[C@](O)(C(F)F)C2)n1	ZINC000853659599	CC	On-Demand	Anodyne	SORD	40	36
COC(=O)c1nccc(N2CC[C@@](O)(C(F)F)C2)n1	ZINC000853659601	CC	On-Demand	Anodyne	SORD	40	36
CO[C@@H](CON=C(N)c1ccc(OCc2cccnc2)cc1)C1CCCC1	ZINC000853659630	FH	On-Demand	Mild	VCP	48	36
COc1cccc(Nc2nc(N3C[C@H](F)[C@H](F)C3)nc3[nH]cnc23)c1	ZINC000853659634	EF	On-Demand	Anodyne	PDPK1	16	44
COc1cccc(Nc2nc(N3C[C@H](F)[C@H](F)C3)nc3[nH]cnc23)c1	ZINC000853659634	EF	On-Demand	Anodyne	GALR2	23	43
C#CCOCCONC(=N)c1cccc(CN2CCCCC2)c1	ZINC000853659635	DE	On-Demand	Mild	HRH2	31	40
C#CCCN(CCOC)C(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000853659678	DG	On-Demand	Mild	AMY2	57	34
C#CCCN(CCOC)C(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000853659679	DG	On-Demand	Mild	AMY2	57	34
COC(=O)N(C)CCNC(=O)N[C@H](C)C(C)(C)c1ccccc1	ZINC000853659687	DE	On-Demand	Anodyne	AMY2	58	34
COC(=O)N(C)CCNC(=O)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000853659688	DE	On-Demand	Anodyne	AMY2	58	34
C#CCCN(CCOC)C(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853659744	FG	On-Demand	Mild	MCHR1	17	40
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-]	ZINC000853659766	GD	On-Demand	Mild	BCL2L1	48	32
C#C[C@H](CO)Nc1ccc(S(=O)(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-]	ZINC000853659767	GD	On-Demand	Mild	BCL2L1	48	32
C#C[C@H](CO)Nc1c(C#N)cnc2c(OC)cc(OC)cc12	ZINC000853659792	CD	On-Demand	Mild	SRC	71	39
C#C[C@@H](CO)Nc1c(C#N)cnc2c(OC)cc(OC)cc12	ZINC000853659793	CD	On-Demand	Mild	SRC	71	39
NC(=NOCc1cc(C2CC2)no1)c1ccc(OCc2cccnc2)cc1	ZINC000853659859	FG	On-Demand	Mild	VCP	55	37
COC(=O)c1nccc(N2C[C@H](F)[C@H](F)C2)n1	ZINC000853659860	BC	On-Demand	Anodyne	SORD	51	43
COC(=O)c1cc(Cl)ccc1OCc1nonc1C	ZINC000853659861	CE	On-Demand	Anodyne	PTGER1	56	37
COC(=O)c1cc(Cl)ccc1OCc1nonc1C	ZINC000853659861	CE	On-Demand	Anodyne	CACNA1D	15	47
F[C@H]1CN(c2nc3ccccc3n3cccc23)C[C@H]1F	ZINC000853659873	CF	On-Demand	Anodyne	HTR3A	29	47
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCC1	ZINC000853659881	EG	On-Demand	Anodyne	SLC6A1	50	34
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCC1	ZINC000853659881	EG	On-Demand	Anodyne	GRIN2B	42	37
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCC1	ZINC000853659881	EG	On-Demand	Anodyne	L3MBTL3	78	38
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCC1	ZINC000853659882	EG	On-Demand	Anodyne	SLC6A1	50	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCC1	ZINC000853659882	EG	On-Demand	Anodyne	GRIN2B	42	37
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCC1	ZINC000853659882	EG	On-Demand	Anodyne	L3MBTL3	78	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2C(=O)OC)CC1	ZINC000853659907	GE	On-Demand	Anodyne	HTR4	15	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2C(=O)OC)CC1	ZINC000853659907	GE	On-Demand	Anodyne	P2RY12	70	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2C(=O)OC)CC1	ZINC000853659907	GE	On-Demand	Anodyne	MC4R	47	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2C(=O)OC)CC1	ZINC000853659909	GE	On-Demand	Anodyne	HTR4	15	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2C(=O)OC)CC1	ZINC000853659909	GE	On-Demand	Anodyne	P2RY12	70	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2C(=O)OC)CC1	ZINC000853659909	GE	On-Demand	Anodyne	MC4R	47	38
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659948	DC	On-Demand	Mild	COLA	64	33
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659948	DC	On-Demand	Mild	BCL2L1	78	34
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659948	DC	On-Demand	Mild	BCL2	64	32
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659948	DC	On-Demand	Mild	BCL2L2	43	31
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659949	DC	On-Demand	Mild	COLA	64	33
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659949	DC	On-Demand	Mild	BCL2L1	78	34
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659949	DC	On-Demand	Mild	BCL2	64	32
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853659949	DC	On-Demand	Mild	BCL2L2	43	31
C#C[C@H](CO)Nc1ncnc2c(OC)cc(OC)cc12	ZINC000853659972	CD	On-Demand	Mild	PDE6A	40	30
C#C[C@@H](CO)Nc1ncnc2c(OC)cc(OC)cc12	ZINC000853659973	CD	On-Demand	Mild	PDE6A	40	30
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000853659988	FB	On-Demand	Mild	BCL2L1	53	31
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1[N+](=O)[O-]	ZINC000853659989	FB	On-Demand	Mild	BCL2L1	53	31
COc1cccc(Nc2nc(N3CC[C@@](O)(C(F)F)C3)nc3[nH]cnc23)c1	ZINC000853660013	GE	On-Demand	Anodyne	GALR2	22	40
COc1cccc(Nc2nc(N3CC[C@](O)(C(F)F)C3)nc3[nH]cnc23)c1	ZINC000853660014	GE	On-Demand	Anodyne	GALR2	22	40
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000853660068	ED	On-Demand	Mild	COLA	52	33
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-]	ZINC000853660069	ED	On-Demand	Mild	COLA	52	33
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)CC(C)C)CC1	ZINC000853660085	FF	On-Demand	Anodyne	DRD4	18	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)CC(C)C)CC1	ZINC000853660085	FF	On-Demand	Anodyne	SIGMAR1	18	46
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853660093	FC	On-Demand	Mild	BCL2L1	79	34
C#C[C@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853660093	FC	On-Demand	Mild	BCL2	66	37
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853660094	FC	On-Demand	Mild	BCL2L1	79	34
C#C[C@@H](CO)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853660094	FC	On-Demand	Mild	BCL2	66	37
CON(C)CCNC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853660161	EE	On-Demand	Anodyne	DRD4	34	42
CON(C)CCNC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853660161	EE	On-Demand	Anodyne	ACHE	31	42
CON(C)CCNC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853660161	EE	On-Demand	Anodyne	HRH2	28	45
CON(C)CCNC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853660161	EE	On-Demand	Anodyne	CHRM3	24	40
CON(C)CCNC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853660161	EE	On-Demand	Anodyne	SIGMAR1	30	41
CON(C)CCNC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853660161	EE	On-Demand	Anodyne	SSTR5	43	36
CON(C)CCNC(=O)NCc1cccc(CN2CCC(C)CC2)c1	ZINC000853660161	EE	On-Demand	Anodyne	MCHR1	36	48
C#C[C@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660166	BC	On-Demand	Mild	ADORA1	59	46
C#C[C@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660166	BC	On-Demand	Mild	ADCY5	24	40
C#C[C@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660166	BC	On-Demand	Mild	ADORA3	39	41
C#C[C@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660166	BC	On-Demand	Mild	Q4VQ11_PIG	53	41
C#C[C@@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660167	BC	On-Demand	Mild	ADORA1	59	46
C#C[C@@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660167	BC	On-Demand	Mild	ADCY5	24	40
C#C[C@@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660167	BC	On-Demand	Mild	ADORA3	39	41
C#C[C@@H](CO)Nc1ncnc2c1ncn2C1CC1	ZINC000853660167	BC	On-Demand	Mild	Q4VQ11_PIG	53	41
CC1=NO[C@H](CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000853660275	FH	On-Demand	Bother	TAAR1	22	45
CC1=NO[C@@H](CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])C1	ZINC000853660276	FH	On-Demand	Bother	TAAR1	22	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc3c(cc2=O)CCCC3)CC1	ZINC000853660300	FC	On-Demand	Anodyne	P2RY12	58	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc3c(cc2=O)CCCC3)CC1	ZINC000853660301	FC	On-Demand	Anodyne	P2RY12	58	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	ACE	37	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	GHRHR	57	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	P2RY12	193	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	TRY2_BOVIN	43	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	PREP	32	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	FAAH	19	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	DPP7	22	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660308	GE	On-Demand	Anodyne	CCR8	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	ACE	37	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	GHRHR	57	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	P2RY12	193	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	TRY2_BOVIN	43	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	PREP	32	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	FAAH	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	DPP7	22	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)CCCc2ccccc2)CC1	ZINC000853660309	GE	On-Demand	Anodyne	CCR8	15	41
N=C(CCCc1ccccc1)NOCc1cc(C2CC2)no1	ZINC000853660312	CH	On-Demand	Anodyne	PREP	40	44
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	GRIN2B	18	40
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	PRNP	36	40
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	EPHX2	27	41
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	PLAU	16	45
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	TAAR1	44	40
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	DGAT1	19	43
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	KCNK3	115	50
O=C(Nc1ccccc1)c1cccc(OCCC2SCCS2)c1	ZINC000853660362	EJ	On-Demand	Anodyne	KCNK9	65	41
C#CCCN(CCOC)C(=O)NCC(C)(C)c1ccccc1Cl	ZINC000853660370	EG	On-Demand	Mild	ECR	43	34
N=C(CCCc1ccccc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853660385	FH	On-Demand	Anodyne	GRIN2B	45	42
N=C(CCCc1ccccc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853660385	FH	On-Demand	Anodyne	PREP	51	40
N=C(CCCc1ccccc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853660386	FH	On-Demand	Anodyne	GRIN2B	45	42
N=C(CCCc1ccccc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853660386	FH	On-Demand	Anodyne	PREP	51	40
CC1=NO[C@@H](CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1	ZINC000853660460	FD	On-Demand	Bother	TBXA2R	17	42
CC1=NO[C@H](CNc2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1	ZINC000853660461	FD	On-Demand	Bother	TBXA2R	17	42
COC(=O)c1cc(Br)ccc1OCc1oc(C)nc1C	ZINC000853660477	EG	On-Demand	Anodyne	SLC22A12	40	29
CC1=NO[C@@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660478	CG	On-Demand	Anodyne	DYRK1A	18	40
CC1=NO[C@@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660478	CG	On-Demand	Anodyne	CLK1	19	40
CC1=NO[C@@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660478	CG	On-Demand	Anodyne	CLK2	21	40
CC1=NO[C@@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660478	CG	On-Demand	Anodyne	CLK4	64	40
CC1=NO[C@@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660478	CG	On-Demand	Anodyne	DYRK1B	17	40
CC1=NO[C@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660479	CG	On-Demand	Anodyne	DYRK1A	18	40
CC1=NO[C@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660479	CG	On-Demand	Anodyne	CLK1	19	40
CC1=NO[C@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660479	CG	On-Demand	Anodyne	CLK2	21	40
CC1=NO[C@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660479	CG	On-Demand	Anodyne	CLK4	64	40
CC1=NO[C@H](CNc2ncnc3ccc(C(C)C)cc23)C1	ZINC000853660479	CG	On-Demand	Anodyne	DYRK1B	17	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(CC(N)=O)c2)CC1	ZINC000853660509	FC	On-Demand	Anodyne	P2RY12	70	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(CC(N)=O)c2)CC1	ZINC000853660509	FC	On-Demand	Anodyne	TRY2_BOVIN	81	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(CC(N)=O)c2)CC1	ZINC000853660509	FC	On-Demand	Anodyne	ST14	26	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(CC(N)=O)c2)CC1	ZINC000853660510	FC	On-Demand	Anodyne	P2RY12	70	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(CC(N)=O)c2)CC1	ZINC000853660510	FC	On-Demand	Anodyne	TRY2_BOVIN	81	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(CC(N)=O)c2)CC1	ZINC000853660510	FC	On-Demand	Anodyne	ST14	26	42
CC1=NO[C@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000853660550	CD	On-Demand	Anodyne	ADORA1	59	45
CC1=NO[C@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000853660550	CD	On-Demand	Anodyne	ADORA3	61	39
CC1=NO[C@@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000853660551	CD	On-Demand	Anodyne	ADORA1	59	45
CC1=NO[C@@H](CNc2ncnc3c2ncn3C2CC2)C1	ZINC000853660551	CD	On-Demand	Anodyne	ADORA3	61	39
CC1=NO[C@H](CNc2ncnc3ccc(S(C)(=O)=O)cc23)C1	ZINC000853660559	DD	On-Demand	Anodyne	CLK4	61	39
CC1=NO[C@@H](CNc2ncnc3ccc(S(C)(=O)=O)cc23)C1	ZINC000853660560	DD	On-Demand	Anodyne	CLK4	61	39
CC1=NO[C@H](CNc2nccc(OCc3ccccc3)n2)C1	ZINC000853660588	CF	On-Demand	Anodyne	LUCI_PHOPY	43	34
CC1=NO[C@@H](CNc2nccc(OCc3ccccc3)n2)C1	ZINC000853660589	CF	On-Demand	Anodyne	LUCI_PHOPY	43	34
CC1=NO[C@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660597	CE	On-Demand	Anodyne	DYRK1A	22	41
CC1=NO[C@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660597	CE	On-Demand	Anodyne	CLK1	19	41
CC1=NO[C@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660597	CE	On-Demand	Anodyne	CLK2	22	41
CC1=NO[C@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660597	CE	On-Demand	Anodyne	CLK4	67	41
CC1=NO[C@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660597	CE	On-Demand	Anodyne	DYRK1B	20	41
CC1=NO[C@@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660598	CE	On-Demand	Anodyne	DYRK1A	22	41
CC1=NO[C@@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660598	CE	On-Demand	Anodyne	CLK1	19	41
CC1=NO[C@@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660598	CE	On-Demand	Anodyne	CLK2	22	41
CC1=NO[C@@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660598	CE	On-Demand	Anodyne	CLK4	67	41
CC1=NO[C@@H](CNc2ncnc3ccc(F)cc23)C1	ZINC000853660598	CE	On-Demand	Anodyne	DYRK1B	20	41
CC1=NO[C@@H](CNc2nc(-c3ccccc3)ns2)C1	ZINC000853660606	CF	On-Demand	Anodyne	LUCI_PHOPY	42	34
CC1=NO[C@H](CNc2nc(-c3ccccc3)ns2)C1	ZINC000853660607	CF	On-Demand	Anodyne	LUCI_PHOPY	42	34
COc1ccc(-c2nnc(NC[C@@H]3CC(C)=NO3)c3ccccc23)cc1	ZINC000853660625	EH	On-Demand	Anodyne	LUCI_PHOPY	45	42
COc1ccc(-c2nnc(NC[C@H]3CC(C)=NO3)c3ccccc23)cc1	ZINC000853660626	EH	On-Demand	Anodyne	LUCI_PHOPY	45	42
CC1=NO[C@@H](CNc2cc(-c3cccnc3)nc(C)n2)C1	ZINC000853660652	CE	On-Demand	Anodyne	CYP2E1	44	31
CC1=NO[C@@H](CNc2cc(-c3cccnc3)nc(C)n2)C1	ZINC000853660652	CE	On-Demand	Anodyne	ROS1	64	37
CC1=NO[C@H](CNc2cc(-c3cccnc3)nc(C)n2)C1	ZINC000853660653	CE	On-Demand	Anodyne	CYP2E1	44	31
CC1=NO[C@H](CNc2cc(-c3cccnc3)nc(C)n2)C1	ZINC000853660653	CE	On-Demand	Anodyne	ROS1	64	37
CC1=NO[C@H](CNc2cc(SCc3ccccc3)ncn2)C1	ZINC000853660688	DG	On-Demand	Anodyne	LUCI_PHOPY	46	32
CC1=NO[C@@H](CNc2cc(SCc3ccccc3)ncn2)C1	ZINC000853660689	DG	On-Demand	Anodyne	LUCI_PHOPY	46	32
CN(c1ncnc2[nH]ccc12)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660711	EF	On-Demand	Anodyne	JAK3	27	48
CN(c1ncnc2[nH]ccc12)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660711	EF	On-Demand	Anodyne	JAK1	19	47
CN(c1ncnc2[nH]ccc12)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660712	EF	On-Demand	Anodyne	JAK3	27	48
CN(c1ncnc2[nH]ccc12)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660712	EF	On-Demand	Anodyne	JAK1	19	47
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)Cc2ccc(C)cc2)CC1	ZINC000853660747	GD	On-Demand	Anodyne	P2RY12	59	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)Cc2ccc(C)cc2)CC1	ZINC000853660752	GD	On-Demand	Anodyne	P2RY12	59	40
CC1=NO[C@H](CNc2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000853660758	DF	On-Demand	Anodyne	LUCI_PHOPY	50	33
CC1=NO[C@@H](CNc2nc(C)cc(OCc3ccccc3)n2)C1	ZINC000853660760	DF	On-Demand	Anodyne	LUCI_PHOPY	50	33
CC1=NO[C@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660784	DF	On-Demand	Anodyne	EGFR	60	37
CC1=NO[C@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660784	DF	On-Demand	Anodyne	DYRK1A	21	42
CC1=NO[C@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660784	DF	On-Demand	Anodyne	CLK1	19	42
CC1=NO[C@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660784	DF	On-Demand	Anodyne	CLK2	22	42
CC1=NO[C@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660784	DF	On-Demand	Anodyne	CLK4	67	42
CC1=NO[C@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660784	DF	On-Demand	Anodyne	DYRK1B	19	42
CC1=NO[C@@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660785	DF	On-Demand	Anodyne	EGFR	60	37
CC1=NO[C@@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660785	DF	On-Demand	Anodyne	DYRK1A	21	42
CC1=NO[C@@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660785	DF	On-Demand	Anodyne	CLK1	19	42
CC1=NO[C@@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660785	DF	On-Demand	Anodyne	CLK2	22	42
CC1=NO[C@@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660785	DF	On-Demand	Anodyne	CLK4	67	42
CC1=NO[C@@H](CNc2ncnc3ccc(Br)cc23)C1	ZINC000853660785	DF	On-Demand	Anodyne	DYRK1B	19	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(-c3ccc(C)cc3)cn2)CC1	ZINC000853660814	FF	On-Demand	Anodyne	P2RY12	72	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(-c3ccc(C)cc3)cn2)CC1	ZINC000853660817	FF	On-Demand	Anodyne	P2RY12	72	41
CC1=NO[C@@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660830	CF	On-Demand	Anodyne	DYRK1A	19	43
CC1=NO[C@@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660830	CF	On-Demand	Anodyne	CLK1	20	43
CC1=NO[C@@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660830	CF	On-Demand	Anodyne	CLK2	23	43
CC1=NO[C@@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660830	CF	On-Demand	Anodyne	CLK4	68	43
CC1=NO[C@@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660830	CF	On-Demand	Anodyne	DYRK1B	18	43
CC1=NO[C@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660831	CF	On-Demand	Anodyne	DYRK1A	19	43
CC1=NO[C@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660831	CF	On-Demand	Anodyne	CLK1	20	43
CC1=NO[C@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660831	CF	On-Demand	Anodyne	CLK2	23	43
CC1=NO[C@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660831	CF	On-Demand	Anodyne	CLK4	68	43
CC1=NO[C@H](CNc2ncnc3ccc(C)cc23)C1	ZINC000853660831	CF	On-Demand	Anodyne	DYRK1B	18	43
CC1=NO[C@@H](CNc2ncncc2-c2ccccc2)C1	ZINC000853660838	CF	On-Demand	Anodyne	TNK2	44	35
CC1=NO[C@@H](CNc2ncncc2-c2ccccc2)C1	ZINC000853660838	CF	On-Demand	Anodyne	LUCI_PHOPY	44	31
CC1=NO[C@H](CNc2ncncc2-c2ccccc2)C1	ZINC000853660839	CF	On-Demand	Anodyne	TNK2	44	35
CC1=NO[C@H](CNc2ncncc2-c2ccccc2)C1	ZINC000853660839	CF	On-Demand	Anodyne	LUCI_PHOPY	44	31
CCn1c(=O)c(NC[C@H]2CC(C)=NO2)nc2ccccc21	ZINC000853660876	CD	On-Demand	Anodyne	PYGM	17	41
CCn1c(=O)c(NC[C@@H]2CC(C)=NO2)nc2ccccc21	ZINC000853660877	CD	On-Demand	Anodyne	PYGM	17	41
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	PAPA1_CARPA	40	40
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	CTSK	21	41
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	CAPNS1	53	33
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	CAPN1	49	39
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	CAPN2	62	34
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	NPR	57	34
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	NAAA	30	43
CC(=O)NOCCOCc1ccccc1	ZINC000853660886	BD	On-Demand	Anodyne	SLC12A5	56	35
CN(c1ncnc2c1ncn2C1CC1)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660934	FF	On-Demand	Anodyne	OXGR1	66	31
CN(c1ncnc2c1ncn2C1CC1)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660934	FF	On-Demand	Anodyne	DOT1L	41	33
CN(c1ncnc2c1ncn2C1CC1)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660935	FF	On-Demand	Anodyne	OXGR1	66	31
CN(c1ncnc2c1ncn2C1CC1)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853660935	FF	On-Demand	Anodyne	DOT1L	41	33
CC1=NO[C@@H](CNc2c(C#N)cnc3c(Cl)cccc23)C1	ZINC000853660987	DG	On-Demand	Mild	MAP3K8	99	37
CC1=NO[C@H](CNc2c(C#N)cnc3c(Cl)cccc23)C1	ZINC000853660989	DG	On-Demand	Mild	MAP3K8	99	37
CC1=NO[C@@H](CNc2cc(C)nc(-c3cccnc3)n2)C1	ZINC000853661023	CE	On-Demand	Anodyne	ROS1	63	37
CC1=NO[C@H](CNc2cc(C)nc(-c3cccnc3)n2)C1	ZINC000853661024	CE	On-Demand	Anodyne	ROS1	63	37
CON(C)CCNC(=O)NCC(C)(C)c1ccccc1Cl	ZINC000853661030	DE	On-Demand	Anodyne	ECR	42	34
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCOC1	ZINC000853661037	EG	On-Demand	Anodyne	RAF1	15	40
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCOC1	ZINC000853661037	EG	On-Demand	Anodyne	KLK1	18	41
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCOC1	ZINC000853661037	EG	On-Demand	Anodyne	TAAR1	40	38
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCOC1	ZINC000853661037	EG	On-Demand	Anodyne	DGAT1	26	41
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCOC1	ZINC000853661037	EG	On-Demand	Anodyne	KCNK3	106	47
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCOC1	ZINC000853661037	EG	On-Demand	Anodyne	KCNK9	60	37
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@@H]1CCOC1	ZINC000853661037	EG	On-Demand	Anodyne	PDS	45	37
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCOC1	ZINC000853661038	EG	On-Demand	Anodyne	RAF1	15	40
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCOC1	ZINC000853661038	EG	On-Demand	Anodyne	KLK1	18	41
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCOC1	ZINC000853661038	EG	On-Demand	Anodyne	TAAR1	40	38
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCOC1	ZINC000853661038	EG	On-Demand	Anodyne	DGAT1	26	41
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCOC1	ZINC000853661038	EG	On-Demand	Anodyne	KCNK3	106	47
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCOC1	ZINC000853661038	EG	On-Demand	Anodyne	KCNK9	60	37
CO[C@@H](COc1cccc(C(=O)Nc2ccccc2)c1)[C@H]1CCOC1	ZINC000853661038	EG	On-Demand	Anodyne	PDS	45	37
CC1=NO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661086	CE	On-Demand	Bother	DYRK1A	20	40
CC1=NO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661086	CE	On-Demand	Bother	CLK1	19	40
CC1=NO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661086	CE	On-Demand	Bother	CLK2	22	40
CC1=NO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661086	CE	On-Demand	Bother	CLK4	66	40
CC1=NO[C@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661086	CE	On-Demand	Bother	DYRK1B	19	40
CC1=NO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661088	CE	On-Demand	Bother	DYRK1A	20	40
CC1=NO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661088	CE	On-Demand	Bother	CLK1	19	40
CC1=NO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661088	CE	On-Demand	Bother	CLK2	22	40
CC1=NO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661088	CE	On-Demand	Bother	CLK4	66	40
CC1=NO[C@@H](CNc2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853661088	CE	On-Demand	Bother	DYRK1B	19	40
CCCOc1cccc(CON=C(C)c2cnn(C)c2)c1	ZINC000853661092	CG	On-Demand	Mild	UPP1	52	40
CN(c1ncnc2ccccc12)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853661120	EG	On-Demand	Anodyne	ACACB	15	41
CN(c1ncnc2ccccc12)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853661123	EG	On-Demand	Anodyne	ACACB	15	41
N=C(CCCc1ccccc1)NOCc1cncs1	ZINC000853661128	CG	On-Demand	Anodyne	CYP3A4	43	42
CC1=NO[C@@H](CNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000853661157	EG	On-Demand	Anodyne	ROS1	57	37
CC1=NO[C@H](CNc2cc(C(F)(F)F)nc(-c3cccnc3)n2)C1	ZINC000853661159	EG	On-Demand	Anodyne	ROS1	57	37
COC(=O)c1cc(Br)ccc1OCc1nonc1C	ZINC000853661192	EF	On-Demand	Anodyne	CACNA1D	15	47
Cc1nonc1COc1cccc(CC(N)=O)c1	ZINC000853661211	BC	On-Demand	Anodyne	CACNA1D	17	50
CC1=NO[C@@H](CNc2ncnc3[nH]ccc23)C1	ZINC000853661241	BD	On-Demand	Anodyne	JAK1	17	43
CC1=NO[C@H](CNc2ncnc3[nH]ccc23)C1	ZINC000853661242	BD	On-Demand	Anodyne	JAK1	17	43
CC1=NO[C@H](CNc2ncnc3ccccc23)C1	ZINC000853661288	BE	On-Demand	Anodyne	CLK4	51	37
CC1=NO[C@@H](CNc2ncnc3ccccc23)C1	ZINC000853661289	BE	On-Demand	Anodyne	CLK4	51	37
COc1ccc(-c2nc(=NC[C@@H]3CC(C)=NO3)cc[nH]2)cc1	ZINC000853661336	CE	On-Demand	Anodyne	LUCI_PHOPY	48	42
COc1ccc(-c2nc(=NC[C@H]3CC(C)=NO3)cc[nH]2)cc1	ZINC000853661337	CE	On-Demand	Anodyne	LUCI_PHOPY	48	42
CC1=NO[C@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661369	FF	On-Demand	Anodyne	DYRK1A	19	41
CC1=NO[C@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661369	FF	On-Demand	Anodyne	CLK1	19	41
CC1=NO[C@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661369	FF	On-Demand	Anodyne	CLK2	22	41
CC1=NO[C@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661369	FF	On-Demand	Anodyne	CLK4	66	41
CC1=NO[C@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661369	FF	On-Demand	Anodyne	CD38	43	36
CC1=NO[C@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661369	FF	On-Demand	Anodyne	DYRK1B	18	41
CC1=NO[C@@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661370	FF	On-Demand	Anodyne	DYRK1A	19	41
CC1=NO[C@@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661370	FF	On-Demand	Anodyne	CLK1	19	41
CC1=NO[C@@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661370	FF	On-Demand	Anodyne	CLK2	22	41
CC1=NO[C@@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661370	FF	On-Demand	Anodyne	CLK4	66	41
CC1=NO[C@@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661370	FF	On-Demand	Anodyne	CD38	43	36
CC1=NO[C@@H](CNc2ncnc3ccc(I)cc23)C1	ZINC000853661370	FF	On-Demand	Anodyne	DYRK1B	18	41
CC1=NO[C@H](CNc2ccnc(Cc3ccccc3)n2)C1	ZINC000853661379	CF	On-Demand	Anodyne	LUCI_PHOPY	52	33
CC1=NO[C@@H](CNc2ccnc(Cc3ccccc3)n2)C1	ZINC000853661381	CF	On-Demand	Anodyne	LUCI_PHOPY	52	33
CC1=NO[C@H](CNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000853661387	CC	On-Demand	Bother	PRKCQ	28	41
CC1=NO[C@@H](CNc2ncc([N+](=O)[O-])c(N)n2)C1	ZINC000853661389	CC	On-Demand	Bother	PRKCQ	28	41
CC(=O)NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853661413	EC	On-Demand	Anodyne	EPHX2	21	44
CC1=NO[C@@H](CNc2ncnc3c(C)csc23)C1	ZINC000853661416	CF	On-Demand	Anodyne	LPAR2	17	44
CC1=NO[C@H](CNc2ncnc3c(C)csc23)C1	ZINC000853661417	CF	On-Demand	Anodyne	LPAR2	17	44
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@@H]2CC(C)=NO2)c1	ZINC000853661426	CD	On-Demand	Bother	GSTM2	52	38
COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC(C)=NO2)c1	ZINC000853661427	CD	On-Demand	Bother	GSTM2	52	38
CC1=NO[C@@H](CNc2ncnc3c2ncn3C)C1	ZINC000853661431	BC	On-Demand	Anodyne	ADORA1	25	51
CC1=NO[C@H](CNc2ncnc3c2ncn3C)C1	ZINC000853661432	BC	On-Demand	Anodyne	ADORA1	25	51
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CHRM2	29	49
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CHRM1	30	49
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	ACE	54	36
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	DRD2	39	56
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	DRD4	74	56
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	ACHE	55	51
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	SSTR2	17	40
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	OPRM1	19	41
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	DRD3	24	56
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	SLC6A3	25	45
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	KCNH2	21	48
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	HTR4	46	51
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CHRM3	45	49
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	LTA4H	34	48
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	TACR1	15	43
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	HRH3	16	41
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	SIGMAR1	86	62
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	SSTR5	76	41
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CACNA1B	15	44
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CCR1	24	40
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CCR3	50	47
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CCR5	28	42
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	SLC6A5	24	45
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	EPHX2	22	50
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	BACE1	17	43
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	PDK1	47	39
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	MCHR1	69	55
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CACNA1G	41	45
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	CCR8	28	47
CC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661442	DD	On-Demand	Anodyne	BIRC2	46	43
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CHRM2	29	49
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CHRM1	30	49
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	ACE	54	36
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	DRD2	39	56
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	DRD4	74	56
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	ACHE	55	51
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	SSTR2	17	40
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	OPRM1	19	41
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	DRD3	24	56
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	SLC6A3	25	45
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	KCNH2	21	48
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	HTR4	46	51
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CHRM3	45	49
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	LTA4H	34	48
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	TACR1	15	43
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	HRH3	16	41
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	SIGMAR1	86	62
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	SSTR5	76	41
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CACNA1B	15	44
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CCR1	24	40
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CCR3	50	47
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CCR5	28	42
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	SLC6A5	24	45
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	EPHX2	22	50
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	BACE1	17	43
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	PDK1	47	39
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	MCHR1	69	55
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CACNA1G	41	45
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	CCR8	28	47
CC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853661443	DD	On-Demand	Anodyne	BIRC2	46	43
CCn1c(=O)c(N(C)[C@@H](CNC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	ZINC000853661461	GG	On-Demand	Anodyne	PDE6D	56	32
CCn1c(=O)c(N(C)[C@@H](CNC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	ZINC000853661461	GG	On-Demand	Anodyne	ACACB	15	40
CCn1c(=O)c(N(C)[C@H](CNC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	ZINC000853661462	GG	On-Demand	Anodyne	PDE6D	56	32
CCn1c(=O)c(N(C)[C@H](CNC(=O)OC(C)(C)C)C2CC2)nc2ccccc21	ZINC000853661462	GG	On-Demand	Anodyne	ACACB	15	40
CCCOc1cccc(CONC(C)=O)c1	ZINC000853661469	BE	On-Demand	Anodyne	HRH2	26	41
CCCOc1cccc(CONC(C)=O)c1	ZINC000853661469	BE	On-Demand	Anodyne	UPP1	44	39
CCCOc1cccc(CONC(C)=O)c1	ZINC000853661469	BE	On-Demand	Anodyne	MTNR1A	44	45
CCCOc1cccc(CONC(C)=O)c1	ZINC000853661469	BE	On-Demand	Anodyne	MTNR1B	41	45
CCCOc1cccc(CONC(C)=O)c1	ZINC000853661469	BE	On-Demand	Anodyne	PLA2G4B	37	43
CCCOc1cccc(CONC(C)=O)c1	ZINC000853661469	BE	On-Demand	Anodyne	FFAR1	38	42
CCCOc1cccc(CONC(C)=O)c1	ZINC000853661469	BE	On-Demand	Anodyne	PDS	72	37
COc1ccc(-c2csc3ncnc(NC[C@@H]4CC(C)=NO4)c23)cc1	ZINC000853661512	FH	On-Demand	Anodyne	TNK2	44	41
COc1ccc(-c2csc3ncnc(NC[C@H]4CC(C)=NO4)c23)cc1	ZINC000853661513	FH	On-Demand	Anodyne	TNK2	44	41
C#CCOCCOc1cccc(CC(N)=O)c1	ZINC000853661554	BC	On-Demand	Mild	UPP1	54	32
C#CCOCCOc1cccc(CC(N)=O)c1	ZINC000853661554	BC	On-Demand	Mild	PLA2G4B	21	41
NC(=O)Cc1cccc(OCCOC(F)F)c1	ZINC000853661600	BD	On-Demand	Anodyne	PLA2G2A	42	40
NC(=O)Cc1cccc(OCCOC(F)F)c1	ZINC000853661600	BD	On-Demand	Anodyne	UPP1	55	34
NC(=O)Cc1cccc(OCCOC(F)F)c1	ZINC000853661600	BD	On-Demand	Anodyne	PLA2G4B	26	43
NC(=O)Cc1cccc(OCCOC(F)F)c1	ZINC000853661600	BD	On-Demand	Anodyne	PDS	68	39
CC(=O)NOCc1cncs1	ZINC000853661657	AC	On-Demand	Anodyne	CYP3A4	36	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)cc2C(N)=O)CC1	ZINC000853661781	GC	On-Demand	Anodyne	P2RY12	48	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)cc2C(N)=O)CC1	ZINC000853661781	GC	On-Demand	Anodyne	MTNR1B	23	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)cc2C(N)=O)CC1	ZINC000853661782	GC	On-Demand	Anodyne	P2RY12	48	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)cc2C(N)=O)CC1	ZINC000853661782	GC	On-Demand	Anodyne	MTNR1B	23	41
CC(C)c1ccc2ncnc(N3CCN(c4cccc(F)n4)CC3)c2c1	ZINC000853661823	FH	On-Demand	Anodyne	PDE3A	36	41
CC(C)c1ccc2ncnc(N3CCN(c4cccc(F)n4)CC3)c2c1	ZINC000853661823	FH	On-Demand	Anodyne	PDGFRB	43	42
CC(C)c1ccc2ncnc(N3CCN(c4cccc(F)n4)CC3)c2c1	ZINC000853661823	FH	On-Demand	Anodyne	PDE3B	38	41
CC(C)c1ccc2ncnc(N3CCN(c4cccc(F)n4)CC3)c2c1	ZINC000853661823	FH	On-Demand	Anodyne	SORD	25	42
CCCOc1cccc(CN(C)S(=O)(=O)c2ccc(Cl)nc2)c1	ZINC000853661824	FG	On-Demand	Anodyne	SQLE	50	43
COC(=O)c1nccc(N2CCN(c3ccnc(F)c3)CC2)n1	ZINC000853661827	DD	On-Demand	Anodyne	SORD	79	38
Cc1cc(CO)cc(N2CCN(c3cccc(F)n3)CC2)n1	ZINC000853661849	DD	On-Demand	Anodyne	SORD	45	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C(C)(C)C)ccc2=O)CC1	ZINC000853661864	FD	On-Demand	Anodyne	P2RY12	75	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C(C)(C)C)ccc2=O)CC1	ZINC000853661865	FD	On-Demand	Anodyne	P2RY12	75	44
O=C(c1ccccc1)N1CC[C@H](Cn2nc3n(c2=O)CCCC3)C1	ZINC000853661908	ED	On-Demand	Anodyne	L3MBTL3	61	36
O=C(c1ccccc1)N1CC[C@@H](Cn2nc3n(c2=O)CCCC3)C1	ZINC000853661909	ED	On-Demand	Anodyne	L3MBTL3	61	36
CCOc1cc(N2CCN(c3ccnc(F)c3)CC2)nc(C)n1	ZINC000853661914	DE	On-Demand	Anodyne	SORD	21	44
CC(C)c1cccc(CON=C(N)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853661936	EG	On-Demand	Mild	TRY2_BOVIN	41	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000853661977	FD	On-Demand	Bother	P2RY12	62	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000853661980	FD	On-Demand	Bother	P2RY12	62	37
COc1cccc(SCCONC(C)=O)c1	ZINC000853661981	BD	On-Demand	Anodyne	DRD4	40	30
COc1cccc(SCCONC(C)=O)c1	ZINC000853661981	BD	On-Demand	Anodyne	MTNR1A	82	69
COc1cccc(SCCONC(C)=O)c1	ZINC000853661981	BD	On-Demand	Anodyne	MTNR1B	81	69
COc1cccc(SCCONC(C)=O)c1	ZINC000853661981	BD	On-Demand	Anodyne	FAS	21	45
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(CC(N)=O)c2)C1	ZINC000853662015	FD	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(CC(N)=O)c2)C1	ZINC000853662017	FD	On-Demand	Anodyne	GPR119	30	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3ccc(F)cc3)n2)CC1	ZINC000853662029	FF	On-Demand	Anodyne	P2RY12	141	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3ccc(F)cc3)n2)CC1	ZINC000853662029	FF	On-Demand	Anodyne	SCN4A	38	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3ccc(F)cc3)n2)CC1	ZINC000853662031	FF	On-Demand	Anodyne	P2RY12	141	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3ccc(F)cc3)n2)CC1	ZINC000853662031	FF	On-Demand	Anodyne	SCN4A	38	40
C=C(Cl)CN1C(=O)C(=O)N(CCc2ccc(OC)cc2)C1=O	ZINC000853662056	DD	On-Demand	Mild	KCNA5	20	40
CC(=O)NOCC[C@H]1CCc2ccccc21	ZINC000853662074	BE	On-Demand	Anodyne	NQO2	21	45
CC(=O)NOCC[C@H]1CCc2ccccc21	ZINC000853662074	BE	On-Demand	Anodyne	MTNR1A	23	45
CC(=O)NOCC[C@H]1CCc2ccccc21	ZINC000853662074	BE	On-Demand	Anodyne	MTNR1B	23	45
CC(=O)NOCC[C@@H]1CCc2ccccc21	ZINC000853662075	BE	On-Demand	Anodyne	NQO2	21	45
CC(=O)NOCC[C@@H]1CCc2ccccc21	ZINC000853662075	BE	On-Demand	Anodyne	MTNR1A	23	45
CC(=O)NOCC[C@@H]1CCc2ccccc21	ZINC000853662075	BE	On-Demand	Anodyne	MTNR1B	23	45
CN(c1ncnc2ccsc12)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853662081	EG	On-Demand	Anodyne	SIRT3	36	40
CN(c1ncnc2ccsc12)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853662081	EG	On-Demand	Anodyne	SIRT2	36	40
CN(c1ncnc2ccsc12)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853662081	EG	On-Demand	Anodyne	SIRT1	37	40
CN(c1ncnc2ccsc12)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853662082	EG	On-Demand	Anodyne	SIRT3	36	40
CN(c1ncnc2ccsc12)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853662082	EG	On-Demand	Anodyne	SIRT2	36	40
CN(c1ncnc2ccsc12)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000853662082	EG	On-Demand	Anodyne	SIRT1	37	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(F)c2)CC1	ZINC000853662090	FD	On-Demand	Anodyne	P2RY12	105	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(F)c2)CC1	ZINC000853662090	FD	On-Demand	Anodyne	TRY2_BOVIN	72	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(F)c2)CC1	ZINC000853662090	FD	On-Demand	Anodyne	ST14	33	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(F)c2)CC1	ZINC000853662091	FD	On-Demand	Anodyne	P2RY12	105	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(F)c2)CC1	ZINC000853662091	FD	On-Demand	Anodyne	TRY2_BOVIN	72	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(F)c2)CC1	ZINC000853662091	FD	On-Demand	Anodyne	ST14	33	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)cc2C)CC1	ZINC000853662096	ED	On-Demand	Mild	P2RY12	46	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)cc2C)CC1	ZINC000853662097	ED	On-Demand	Mild	P2RY12	46	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nccc2-c2cccnc2)CC1	ZINC000853662105	FD	On-Demand	Anodyne	P2RY12	137	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nccc2-c2cccnc2)CC1	ZINC000853662106	FD	On-Demand	Anodyne	P2RY12	137	39
CCC(CC)CON=C(N)c1ccc(S(C)(=O)=O)cc1	ZINC000853662113	CE	On-Demand	Mild	O49150_SOLTU	44	33
Cc1ccn(CCCC2CCN(C(=O)OC(C)(C)C)CC2)c(=O)n1	ZINC000853662120	EF	On-Demand	Anodyne	GPR119	56	48
Cc1ccn(Cc2cccc(NC(=O)OC(C)(C)C)c2)c(=O)n1	ZINC000853662126	DF	On-Demand	Anodyne	HTR1D	23	42
Cc1ccn(Cc2cccc(NC(=O)OC(C)(C)C)c2)c(=O)n1	ZINC000853662126	DF	On-Demand	Anodyne	HTR1B	19	42
CCCOc1cccc(Cn2nc3n(c2=O)CCCC3)c1	ZINC000853662135	CE	On-Demand	Anodyne	HRH2	32	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cccc(C#N)c2=O)CC1	ZINC000853662147	EC	On-Demand	Mild	P2RY12	55	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cccc(C#N)c2=O)CC1	ZINC000853662149	EC	On-Demand	Mild	P2RY12	55	39
CN(C[C@@H]1CCN(C(=O)c2ccccc2)C1)S(=O)(=O)c1ccc(Cl)nc1	ZINC000853662152	GF	On-Demand	Anodyne	SFRP1	61	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C)nc2=O)CC1	ZINC000853662162	DC	On-Demand	Anodyne	P2RY12	92	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C)nc2=O)CC1	ZINC000853662163	DC	On-Demand	Anodyne	P2RY12	92	39
O=[N+]([O-])c1cc(N2CCN(c3cccc(F)n3)CC2)ccc1C(F)(F)F	ZINC000853662200	FG	On-Demand	Bother	SERPINE1	20	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(-c3cccnc3)noc2=O)CC1	ZINC000853662221	GC	On-Demand	Anodyne	P2RY12	94	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(-c3cccnc3)noc2=O)CC1	ZINC000853662222	GC	On-Demand	Anodyne	P2RY12	94	38
CC(=O)c1ccnc(N2CCN(c3cccc(F)n3)CC2)c1	ZINC000853662229	DE	On-Demand	Anodyne	SORD	77	37
Cc1nonc1COc1cccc(C(=O)N2CCc3ccccc3C2)c1	ZINC000853662293	EG	On-Demand	Anodyne	DRD4	41	32
Cc1nonc1COc1cccc(C(=O)N2CCc3ccccc3C2)c1	ZINC000853662293	EG	On-Demand	Anodyne	CFTR	49	38
Cc1nonc1COc1cccc(C(=O)N2CCc3ccccc3C2)c1	ZINC000853662293	EG	On-Demand	Anodyne	BCL2	28	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000853662302	GF	On-Demand	Bother	DRD4	19	51
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000853662302	GF	On-Demand	Bother	SIGMAR1	18	52
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N)c([N+](=O)[O-])c2)CC1	ZINC000853662302	GF	On-Demand	Bother	MCHR1	25	49
Fc1ccc(-c2ccn(CCOC(F)F)n2)cc1	ZINC000853662316	CF	On-Demand	Anodyne	SCN4A	39	47
COc1ccc(-c2nnc(N3CC(C4CS(=O)(=O)C4)C3)c3ccccc23)cc1	ZINC000853662324	GF	On-Demand	Anodyne	SMO	46	53
Nc1nc(Cl)cc(N2CCC[C@@H](c3ccncc3)C2)n1	ZINC000853662341	CE	On-Demand	Anodyne	HRH4	45	43
Nc1nc(Cl)cc(N2CCC[C@H](c3ccncc3)C2)n1	ZINC000853662342	CE	On-Demand	Anodyne	HRH4	45	43
CC(C)(C)OC(=O)N1CCO[C@H](Cn2nccc2-c2cccnc2)C1	ZINC000853662367	EF	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2nccc2-c2cccnc2)C1	ZINC000853662368	EF	On-Demand	Anodyne	GPR119	22	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000853662375	GE	On-Demand	Mild	DRD4	44	34
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000853662375	GE	On-Demand	Mild	MTNR1A	15	55
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000853662375	GE	On-Demand	Mild	MTNR1B	16	55
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000853662376	GE	On-Demand	Mild	DRD4	44	34
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000853662376	GE	On-Demand	Mild	MTNR1A	15	55
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000853662376	GE	On-Demand	Mild	MTNR1B	16	55
COC(=O)c1nccc(N2CCN(c3cccc(F)n3)CC2)n1	ZINC000853662386	DD	On-Demand	Anodyne	SORD	85	39
Fc1cc(N2CCC(F)(Cc3ccc(Cl)cc3)CC2)ncn1	ZINC000853662404	DH	On-Demand	Anodyne	AKT2	26	41
COc1ccc(-c2nccc(N3CCN(c4ccnc(F)c4)CC3)n2)cc1	ZINC000853662409	FG	On-Demand	Anodyne	SORD	44	34
CCOC(=O)c1nccc(N2CCN(c3cccc(F)n3)CC2)n1	ZINC000853662429	ED	On-Demand	Anodyne	SORD	81	39
NC(=O)c1cc(N2CCN(c3ccnc(F)c3)CC2)ccc1[N+](=O)[O-]	ZINC000853662433	ED	On-Demand	Bother	STAT6	48	32
CC(C)c1ccc2ncnc(N3CCN(c4ccnc(F)c4)CC3)c2c1	ZINC000853662462	FH	On-Demand	Anodyne	PDGFRB	41	42
Cc1ccn(CCC2CCN(C(=O)OC(C)(C)C)CC2)c(=O)n1	ZINC000853662465	DF	On-Demand	Anodyne	GPR119	57	47
CCOC(=O)c1nccc(N2CCN(c3ccnc(F)c3)CC2)n1	ZINC000853662474	ED	On-Demand	Anodyne	SORD	74	40
COc1ccc(-c2nccc(N3CCN(c4cccc(F)n4)CC3)n2)cc1	ZINC000853662478	FG	On-Demand	Anodyne	SORD	63	35
Cc1ccn(CC2CCN(C(=O)OC(C)(C)C)CC2)c(=O)n1	ZINC000853662479	DE	On-Demand	Anodyne	GPR119	54	48
c1cncc(-c2ccnn2CCC2SCCS2)c1	ZINC000853662489	CG	On-Demand	Anodyne	CYP2E1	50	48
c1cncc(-c2ccnn2CCC2SCCS2)c1	ZINC000853662489	CG	On-Demand	Anodyne	CYP2A6	43	35
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc3ccccc23)CC1	ZINC000853662541	GE	On-Demand	Anodyne	P2RY12	194	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc3ccccc23)CC1	ZINC000853662541	GE	On-Demand	Anodyne	TRY2_BOVIN	61	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc3ccccc23)CC1	ZINC000853662541	GE	On-Demand	Anodyne	CCR8	27	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc3ccccc23)CC1	ZINC000853662542	GE	On-Demand	Anodyne	P2RY12	194	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc3ccccc23)CC1	ZINC000853662542	GE	On-Demand	Anodyne	TRY2_BOVIN	61	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc3ccccc23)CC1	ZINC000853662542	GE	On-Demand	Anodyne	CCR8	27	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(-c3ccccc3C)noc2=O)CC1	ZINC000853662553	GD	On-Demand	Anodyne	P2RY12	80	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(-c3ccccc3C)noc2=O)CC1	ZINC000853662554	GD	On-Demand	Anodyne	P2RY12	80	38
COC(=O)Cc1ccnc(N2CCN(c3cccc(F)n3)CC2)c1	ZINC000853662599	ED	On-Demand	Anodyne	SORD	53	34
C=C(Cl)COc1cccc(NC(=O)NCCC)c1	ZINC000853662622	CG	On-Demand	Mild	HRH2	24	43
C=C(Cl)COc1cccc(NC(=O)NCCC)c1	ZINC000853662622	CG	On-Demand	Mild	MTNR1B	20	40
C=C(Cl)COc1cccc(NC(=O)NCCC)c1	ZINC000853662622	CG	On-Demand	Mild	EPHX2	27	44
C=C(Cl)COc1cccc(NC(=O)NCCC)c1	ZINC000853662622	CG	On-Demand	Mild	KCNK3	44	37
C=C(Cl)COc1cccc(NC(=O)NCCC)c1	ZINC000853662622	CG	On-Demand	Mild	KCNK9	41	37
CCOc1ccc(-n2c(C)cc(C(=O)Cn3ccc(C)nc3=O)c2C)cc1	ZINC000853662634	FG	On-Demand	Clean	CACNA2D1	62	39
Nc1ccc2nc(N3CCN(c4ccnc(F)c4)CC3)sc2c1	ZINC000853662672	EF	On-Demand	Anodyne	MLYCD	22	40
Cc1ccn(CC(=O)NC2CCCCCCC2)c(=O)n1	ZINC000853662676	CD	On-Demand	Anodyne	CNR1	22	43
Cc1ccn(CC(=O)NC2CCCCCCC2)c(=O)n1	ZINC000853662676	CD	On-Demand	Anodyne	CNR2	29	43
Fc1ccc(-c2ccn(CCC3SCCS3)n2)cc1	ZINC000853662686	CH	On-Demand	Anodyne	SCN4A	30	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000853662695	GD	On-Demand	Bother	CACNA1D	51	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000853662696	GD	On-Demand	Bother	CACNA1D	51	34
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2cccc(F)c2)C1	ZINC000853662720	FE	On-Demand	Anodyne	GPR119	23	43
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2cccc(F)c2)C1	ZINC000853662721	FE	On-Demand	Anodyne	GPR119	23	43
CCC[C@H](NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)C1CCCCC1	ZINC000853662757	GI	On-Demand	Clean	PROC	44	36
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	CHRM1	16	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	DRD4	29	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	SIGMAR1	19	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	SSTR5	45	37
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	CCR3	44	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	CCR2	23	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	MCHR1	35	43
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cccc(F)c2)CC1	ZINC000853662766	GF	On-Demand	Anodyne	CCR8	24	40
Cc1ccn(CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c(=O)n1	ZINC000853662789	DE	On-Demand	Anodyne	GPR119	48	43
Cc1ccn(CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c(=O)n1	ZINC000853662791	DE	On-Demand	Anodyne	GPR119	48	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)OCCCO3)CC1	ZINC000853662799	GD	On-Demand	Anodyne	P2RY12	54	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)OCCCO3)CC1	ZINC000853662802	GD	On-Demand	Anodyne	P2RY12	54	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2-c2ccnc(Cl)c2)CC1	ZINC000853662822	GE	On-Demand	Anodyne	P2RY12	70	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2-c2ccnc(Cl)c2)CC1	ZINC000853662825	GE	On-Demand	Anodyne	P2RY12	70	37
CO[C@@H](COc1cccc(C(=O)Nc2ccc(C)cc2)c1)[C@H]1CCOC1	ZINC000853662834	FH	On-Demand	Anodyne	KCNK3	72	42
CO[C@@H](COc1cccc(C(=O)Nc2ccc(C)cc2)c1)[C@H]1CCOC1	ZINC000853662834	FH	On-Demand	Anodyne	KCNK9	46	36
CO[C@@H](COc1cccc(C(=O)Nc2ccc(C)cc2)c1)[C@@H]1CCOC1	ZINC000853662835	FH	On-Demand	Anodyne	KCNK3	72	42
CO[C@@H](COc1cccc(C(=O)Nc2ccc(C)cc2)c1)[C@@H]1CCOC1	ZINC000853662835	FH	On-Demand	Anodyne	KCNK9	46	36
OCc1cc(N2CCN(c3cccc(F)n3)CC2)ncc1F	ZINC000853662860	DD	On-Demand	Anodyne	SORD	39	40
CC(=O)c1ccc(N2CC(C3CS(=O)(=O)C3)C2)c([N+](=O)[O-])c1	ZINC000853662894	DD	On-Demand	Bother	TAAR1	15	40
OCc1cc(N2CCN(c3ccnc(F)c3)CC2)ncc1F	ZINC000853662904	DD	On-Demand	Anodyne	SORD	42	39
Cn1cncc1CCOc1cccc(C(=O)N2CCc3ccccc3C2)c1	ZINC000853662911	FG	On-Demand	Anodyne	DRD4	42	33
Cn1cncc1CCOc1cccc(C(=O)N2CCc3ccccc3C2)c1	ZINC000853662911	FG	On-Demand	Anodyne	CFTR	50	37
N#Cc1ccc(CCn2nc3n(c2=O)CCCC3)cc1	ZINC000853662918	CD	On-Demand	Mild	KCNJ1	26	42
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(Oc3ncccn3)c2)C1	ZINC000853662961	GG	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(Oc3ncccn3)c2)C1	ZINC000853662964	GG	On-Demand	Anodyne	GPR119	34	41
Cc1cc(CO)cc(N2CCN(c3ccnc(F)c3)CC2)n1	ZINC000853662972	DD	On-Demand	Anodyne	SORD	62	48
Cc1cc(CO)cc(N2CCN(c3ccnc(F)c3)CC2)n1	ZINC000853662972	DD	On-Demand	Anodyne	EPHB4	40	33
FC(F)OCCn1nccc1-c1cccnc1	ZINC000853662976	BE	On-Demand	Anodyne	CYP2E1	47	35
O=C(c1cccc(OCCOC(F)F)c1)N1CCc2ccccc2C1	ZINC000853662991	EH	On-Demand	Anodyne	DRD4	41	32
O=C(c1cccc(OCCOC(F)F)c1)N1CCc2ccccc2C1	ZINC000853662991	EH	On-Demand	Anodyne	CFTR	50	40
C#CCOCCOc1cccc(NC(=O)NCCC)c1	ZINC000853663027	CE	On-Demand	Mild	ADRB1	24	41
C#CCOCCOc1cccc(NC(=O)NCCC)c1	ZINC000853663027	CE	On-Demand	Mild	HRH2	29	47
C#CCOCCOc1cccc(NC(=O)NCCC)c1	ZINC000853663027	CE	On-Demand	Mild	EPHX2	22	48
CO[C@@H](COc1cccc(C(=O)N2CCc3ccccc3C2)c1)[C@@H]1CCOC1	ZINC000853663078	GG	On-Demand	Anodyne	DRD4	40	31
CO[C@@H](COc1cccc(C(=O)N2CCc3ccccc3C2)c1)[C@@H]1CCOC1	ZINC000853663078	GG	On-Demand	Anodyne	CFTR	47	38
CO[C@@H](COc1cccc(C(=O)N2CCc3ccccc3C2)c1)[C@H]1CCOC1	ZINC000853663080	GG	On-Demand	Anodyne	DRD4	40	31
CO[C@@H](COc1cccc(C(=O)N2CCc3ccccc3C2)c1)[C@H]1CCOC1	ZINC000853663080	GG	On-Demand	Anodyne	CFTR	47	38
C#CCOCCOc1cccc(C(=O)N2CCc3ccccc3C2)c1	ZINC000853663093	EF	On-Demand	Mild	DRD4	41	33
C#CCOCCOc1cccc(C(=O)N2CCc3ccccc3C2)c1	ZINC000853663093	EF	On-Demand	Mild	CFTR	42	37
COC(=O)c1sc(N2CCC[C@@H](c3ccncc3)C2)nc1Cl	ZINC000853663176	EG	On-Demand	Anodyne	PARE	80	36
COC(=O)c1sc(N2CCC[C@H](c3ccncc3)C2)nc1Cl	ZINC000853663177	EG	On-Demand	Anodyne	PARE	80	36
Cc1cc(C#N)ccc1OC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853663190	EF	On-Demand	Mild	GPR119	31	44
Cc1cc(C#N)ccc1OC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853663191	EF	On-Demand	Mild	GPR119	31	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(N)=O)c(-c3ccccc3)n2)CC1	ZINC000853663204	GD	On-Demand	Anodyne	P2RY12	203	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(N)=O)c(-c3ccccc3)n2)CC1	ZINC000853663205	GD	On-Demand	Anodyne	P2RY12	203	42
CCC[C@H](NC(=O)N1CCC(NC(=O)OC)CC1)C1CCCCC1	ZINC000853663259	EG	On-Demand	Anodyne	EPHX2	22	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(F)cc(F)c2)CC1	ZINC000853663283	EE	On-Demand	Anodyne	P2RY12	80	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(F)cc(F)c2)CC1	ZINC000853663284	EE	On-Demand	Anodyne	P2RY12	80	39
COC(=O)C1(CON=C(N)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853663311	EC	On-Demand	Mild	LOX1.1	46	33
COC(=O)C1(CON=C(N)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853663311	EC	On-Demand	Mild	O49150_SOLTU	50	36
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000853663313	ED	On-Demand	Mild	DRD4	43	32
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000853663313	ED	On-Demand	Mild	MTNR1A	20	57
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2cccc(OC)c2)C1	ZINC000853663313	ED	On-Demand	Mild	MTNR1B	22	57
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000853663314	ED	On-Demand	Mild	DRD4	43	32
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000853663314	ED	On-Demand	Mild	MTNR1A	20	57
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2cccc(OC)c2)C1	ZINC000853663314	ED	On-Demand	Mild	MTNR1B	22	57
COc1cccc(C2(NC(=O)NCCCN3CCOC3=O)CCC2)c1	ZINC000853663358	EE	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(NC(=O)NCCCN3CCOC3=O)CCC2)c1	ZINC000853663358	EE	On-Demand	Anodyne	SOAT1	15	40
CCN1CC[C@H](ONC(=O)CCCc2ccccc2)C1=O	ZINC000853663360	CD	On-Demand	Anodyne	FKBP1A	51	40
CCN1CC[C@H](ONC(=O)CCCc2ccccc2)C1=O	ZINC000853663360	CD	On-Demand	Anodyne	CHRM5	26	40
CCN1CC[C@H](ONC(=O)CCCc2ccccc2)C1=O	ZINC000853663360	CD	On-Demand	Anodyne	PREP	61	42
CCN1CC[C@H](ONC(=O)CCCc2ccccc2)C1=O	ZINC000853663360	CD	On-Demand	Anodyne	FAAH	39	44
CCN1CC[C@H](ONC(=O)CCCc2ccccc2)C1=O	ZINC000853663360	CD	On-Demand	Anodyne	NAAA	43	38
CCN1CC[C@H](ONC(=O)CCCc2ccccc2)C1=O	ZINC000853663360	CD	On-Demand	Anodyne	SLC12A5	45	33
Cc1nocc1CONC(=O)CCCc1ccccc1	ZINC000853663405	CF	On-Demand	Anodyne	FAAH	62	38
Cc1nocc1CONC(=O)CCCc1ccccc1	ZINC000853663405	CF	On-Demand	Anodyne	CES1	61	38
Cc1nocc1CONC(=O)CCCc1ccccc1	ZINC000853663405	CF	On-Demand	Anodyne	CES1D	53	34
CO[C@H]1CCN(c2cc(F)ncn2)C[C@H]1C	ZINC000853663406	BD	On-Demand	Anodyne	PDE3B	42	33
CO[C@@H]1CCN(c2cc(F)ncn2)C[C@@H]1C	ZINC000853663407	BD	On-Demand	Anodyne	PDE3B	42	33
CO[C@H]1CCN(c2cc(F)ncn2)C[C@@H]1C	ZINC000853663408	BD	On-Demand	Anodyne	PDE3B	42	33
CO[C@@H]1CCN(c2cc(F)ncn2)C[C@H]1C	ZINC000853663409	BD	On-Demand	Anodyne	PDE3B	42	33
O=C1OCCN1CCCNC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853663410	GE	On-Demand	Anodyne	TYRO3	17	41
O=C1OCCN1CCCNC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853663411	GE	On-Demand	Anodyne	TYRO3	17	41
CS(=O)(=O)N1CC[C@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663428	ED	On-Demand	Anodyne	FKBP1A	42	39
CS(=O)(=O)N1CC[C@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663428	ED	On-Demand	Anodyne	SIGMAR1	21	40
CS(=O)(=O)N1CC[C@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663428	ED	On-Demand	Anodyne	PREP	47	40
CS(=O)(=O)N1CC[C@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663428	ED	On-Demand	Anodyne	MMP2	49	30
CS(=O)(=O)N1CC[C@@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663429	ED	On-Demand	Anodyne	FKBP1A	42	39
CS(=O)(=O)N1CC[C@@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663429	ED	On-Demand	Anodyne	SIGMAR1	21	40
CS(=O)(=O)N1CC[C@@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663429	ED	On-Demand	Anodyne	PREP	47	40
CS(=O)(=O)N1CC[C@@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663429	ED	On-Demand	Anodyne	MMP2	49	30
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663452	GF	On-Demand	Anodyne	GHRHR	43	33
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=O)CCCc2ccccc2)C1	ZINC000853663453	GF	On-Demand	Anodyne	GHRHR	43	33
O=C(N1C[C@@H]2CN(c3cc(Nc4ccccc4)ncn3)CC[C@H]2C1)C(F)(F)F	ZINC000853663461	GG	On-Demand	Anodyne	RBP4	54	35
O=C(N1C[C@H]2CCN(c3cc(Nc4ccccc4)ncn3)C[C@H]2C1)C(F)(F)F	ZINC000853663462	GG	On-Demand	Anodyne	RBP4	54	35
O=C(N1C[C@@H]2CCN(c3cc(Nc4ccccc4)ncn3)C[C@@H]2C1)C(F)(F)F	ZINC000853663463	GG	On-Demand	Anodyne	RBP4	54	35
O=C(N1C[C@H]2CCN(c3cc(Nc4ccccc4)ncn3)C[C@@H]2C1)C(F)(F)F	ZINC000853663464	GG	On-Demand	Anodyne	RBP4	54	35
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCCC1	ZINC000853663474	DG	On-Demand	Anodyne	FKBP1A	48	36
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCCC1	ZINC000853663474	DG	On-Demand	Anodyne	SLC6A3	15	44
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCCC1	ZINC000853663474	DG	On-Demand	Anodyne	PREP	44	42
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCCC1	ZINC000853663474	DG	On-Demand	Anodyne	AMY2	44	30
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCCC1	ZINC000853663474	DG	On-Demand	Anodyne	FAAH	20	42
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCCC1	ZINC000853663474	DG	On-Demand	Anodyne	ABCB1	17	40
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663533	GH	On-Demand	Anodyne	PDE3A	44	42
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663533	GH	On-Demand	Anodyne	PDGFRB	48	44
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663533	GH	On-Demand	Anodyne	PDE3B	48	42
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663533	GH	On-Demand	Anodyne	SIRT3	56	32
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663533	GH	On-Demand	Anodyne	SIRT2	50	30
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663533	GH	On-Demand	Anodyne	SIRT1	49	30
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663534	GH	On-Demand	Anodyne	PDE3A	44	42
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663534	GH	On-Demand	Anodyne	PDGFRB	48	44
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663534	GH	On-Demand	Anodyne	PDE3B	48	42
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663534	GH	On-Demand	Anodyne	SIRT3	56	32
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663534	GH	On-Demand	Anodyne	SIRT2	50	30
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)c2c1	ZINC000853663534	GH	On-Demand	Anodyne	SIRT1	49	30
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663535	GH	On-Demand	Anodyne	PDE3A	44	42
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663535	GH	On-Demand	Anodyne	PDGFRB	48	44
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663535	GH	On-Demand	Anodyne	PDE3B	48	42
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663535	GH	On-Demand	Anodyne	SIRT3	56	32
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663535	GH	On-Demand	Anodyne	SIRT2	50	30
CC(C)c1ccc2ncnc(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663535	GH	On-Demand	Anodyne	SIRT1	49	30
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663536	GH	On-Demand	Anodyne	PDE3A	44	42
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663536	GH	On-Demand	Anodyne	PDGFRB	48	44
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663536	GH	On-Demand	Anodyne	PDE3B	48	42
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663536	GH	On-Demand	Anodyne	SIRT3	56	32
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663536	GH	On-Demand	Anodyne	SIRT2	50	30
CC(C)c1ccc2ncnc(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)c2c1	ZINC000853663536	GH	On-Demand	Anodyne	SIRT1	49	30
O=C(CCCc1ccccc1)NOCCC1CCC1	ZINC000853663541	CG	On-Demand	Anodyne	FKBP1A	42	40
O=C(CCCc1ccccc1)NOCCC1CCC1	ZINC000853663541	CG	On-Demand	Anodyne	SLC18A2	43	41
O=C(CCCc1ccccc1)NOCCC1CCC1	ZINC000853663541	CG	On-Demand	Anodyne	PREP	56	41
O=C(CCCc1ccccc1)NOCCC1CCC1	ZINC000853663541	CG	On-Demand	Anodyne	AMY2	44	31
O=C(CCCc1ccccc1)NOCCC1CCC1	ZINC000853663541	CG	On-Demand	Anodyne	FAAH	28	40
O=C(CCCc1ccccc1)NOCCC1CCC1	ZINC000853663541	CG	On-Demand	Anodyne	NAAA	40	37
COC[C@@H](CONC(=O)CCCc1ccccc1)OC	ZINC000853663560	CD	On-Demand	Anodyne	CES1	45	36
N#Cc1ccc(CCONC(=O)CCCc2ccccc2)cc1	ZINC000853663597	DG	On-Demand	Mild	FAAH	55	41
N#Cc1ccc(CCONC(=O)CCCc2ccccc2)cc1	ZINC000853663597	DG	On-Demand	Mild	CES1	68	39
N#Cc1ccc(CCONC(=O)CCCc2ccccc2)cc1	ZINC000853663597	DG	On-Demand	Mild	CTRB_BOVIN	52	39
N#Cc1ccc(CCONC(=O)CCCc2ccccc2)cc1	ZINC000853663597	DG	On-Demand	Mild	FFAR1	42	46
O=C1OCCN1CCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853663639	DC	On-Demand	Anodyne	CPT1A	42	33
O=C1OCCN1CCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853663639	DC	On-Demand	Anodyne	TYRO3	16	42
O=C1OCCN1CCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853663640	DC	On-Demand	Anodyne	CPT1A	42	33
O=C1OCCN1CCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853663640	DC	On-Demand	Anodyne	TYRO3	16	42
Cc1c(NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c2ccccc2C#N)cccc1[N+](=O)[O-]	ZINC000853663641	ID	On-Demand	Mild	COLA	110	39
Cc1c(NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2ccccc2C#N)cccc1[N+](=O)[O-]	ZINC000853663642	ID	On-Demand	Mild	COLA	110	39
CC(C)n1ncnc1CONC(=O)CCCc1ccccc1	ZINC000853663655	DE	On-Demand	Anodyne	FAAH	43	39
CC(C)n1ncnc1CONC(=O)CCCc1ccccc1	ZINC000853663655	DE	On-Demand	Anodyne	CES1	40	34
CC(C)n1ncnc1CONC(=O)CCCc1ccccc1	ZINC000853663655	DE	On-Demand	Anodyne	CES1D	52	31
C=C(Cl)CONC(=O)CCCc1ccccc1	ZINC000853663667	CF	On-Demand	Mild	FAAH	54	39
C=C(Cl)CONC(=O)CCCc1ccccc1	ZINC000853663667	CF	On-Demand	Mild	CES1	60	37
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCC1	ZINC000853663678	CF	On-Demand	Anodyne	SLC18A2	28	40
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCC1	ZINC000853663678	CF	On-Demand	Anodyne	PREP	42	42
CO[C@@H](CONC(=O)CCCc1ccccc1)C1CCC1	ZINC000853663678	CF	On-Demand	Anodyne	FAAH	20	42
O=C(CCCc1ccccc1)NOCc1cncs1	ZINC000853663693	CF	On-Demand	Anodyne	FAAH	75	38
O=C(CCCc1ccccc1)NOCc1cncs1	ZINC000853663693	CF	On-Demand	Anodyne	CES1	71	38
O=C(CCCc1ccccc1)NOCc1cncs1	ZINC000853663693	CF	On-Demand	Anodyne	CYP3A4	48	45
O=C(CCCc1ccccc1)NOCc1cncs1	ZINC000853663693	CF	On-Demand	Anodyne	AKR1B10	17	40
O=C(CCCc1ccccc1)NOCc1cncs1	ZINC000853663693	CF	On-Demand	Anodyne	CES1D	54	33
CCCn1ncnc1CONC(=O)CCCc1ccccc1	ZINC000853663710	DE	On-Demand	Anodyne	FAAH	43	36
CCCn1ncnc1CONC(=O)CCCc1ccccc1	ZINC000853663710	DE	On-Demand	Anodyne	CES1D	44	31
Cc1ccc(CC2CN(C(=O)NCCCN3CCOC3=O)C2)cc1	ZINC000853663716	EE	On-Demand	Anodyne	CCR3	31	41
CC1(C)C[C@@H](ONC(=O)CCCc2ccccc2)CO1	ZINC000853663724	CF	On-Demand	Anodyne	GHRHR	40	30
CC1(C)C[C@@H](ONC(=O)CCCc2ccccc2)CO1	ZINC000853663724	CF	On-Demand	Anodyne	FAAH	56	37
CC1(C)C[C@@H](ONC(=O)CCCc2ccccc2)CO1	ZINC000853663724	CF	On-Demand	Anodyne	CES1	63	35
CC1(C)C[C@@H](ONC(=O)CCCc2ccccc2)CO1	ZINC000853663724	CF	On-Demand	Anodyne	NAAA	40	41
CC1(C)C[C@@H](ONC(=O)CCCc2ccccc2)CO1	ZINC000853663724	CF	On-Demand	Anodyne	CES1D	43	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(N(C)C(N)=O)cc2)CC1	ZINC000853663728	GD	On-Demand	Anodyne	P2RY12	49	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(N(C)C(N)=O)cc2)CC1	ZINC000853663729	GD	On-Demand	Anodyne	P2RY12	49	36
CC(C)(C)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663733	DE	On-Demand	Anodyne	GRIN2B	42	38
CC(C)(C)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663733	DE	On-Demand	Anodyne	NPY2R	28	40
CC(C)(C)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663733	DE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663733	DE	On-Demand	Anodyne	SMO	45	41
CC(C)(C)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663733	DE	On-Demand	Anodyne	L3MBTL3	50	35
CC(C)(C)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663734	DE	On-Demand	Anodyne	GRIN2B	42	38
CC(C)(C)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663734	DE	On-Demand	Anodyne	NPY2R	28	40
CC(C)(C)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663734	DE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663734	DE	On-Demand	Anodyne	SMO	45	41
CC(C)(C)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853663734	DE	On-Demand	Anodyne	L3MBTL3	50	35
C#Cc1cccnc1N[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F	ZINC000853663743	EG	On-Demand	Mild	GPR119	34	40
C#Cc1cccnc1N[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F	ZINC000853663744	EG	On-Demand	Mild	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@@H](CNc2cnc(F)cn2)C(F)(F)C1	ZINC000853663750	EF	On-Demand	Anodyne	GPR119	54	39
CC(C)(C)OC(=O)N1CC[C@H](CNc2cnc(F)cn2)C(F)(F)C1	ZINC000853663751	EF	On-Demand	Anodyne	GPR119	54	39
CC(C)(C(=O)NOCc1cncs1)c1ccccc1	ZINC000853663753	CF	On-Demand	Anodyne	CYP3A4	45	43
CCCOc1cccc(CONC(=O)C(C)(C)C)c1	ZINC000853663760	CG	On-Demand	Anodyne	UPP1	58	40
CCCOc1cccc(CONC(=O)C(C)(C)C)c1	ZINC000853663760	CG	On-Demand	Anodyne	PLA2G4B	46	41
CCCOc1cccc(CONC(=O)C(C)(C)C)c1	ZINC000853663760	CG	On-Demand	Anodyne	FFAR1	30	40
CCCOc1cccc(CONC(=O)C(C)(C)C)c1	ZINC000853663760	CG	On-Demand	Anodyne	PDS	64	37
COC(=O)C1(CONC(=O)C(C)(C)c2ccccc2)CC1	ZINC000853663766	CD	On-Demand	Anodyne	AMY2	52	31
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](Nc2cc(F)ncn2)C1	ZINC000853663771	EF	On-Demand	Anodyne	GPR119	45	37
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](Nc2cc(F)ncn2)C1	ZINC000853663772	EF	On-Demand	Anodyne	GPR119	45	37
CC(C)(C(=O)NOCc1cc(C2CC2)no1)c1ccccc1	ZINC000853663790	DG	On-Demand	Anodyne	AMY2	47	32
CC(C)(C(=O)NOC[C@@H]1CCN(S(C)(=O)=O)C1)c1ccccc1	ZINC000853663805	ED	On-Demand	Anodyne	AMY2	43	29
CC(C)(C(=O)NOC[C@H]1CCN(S(C)(=O)=O)C1)c1ccccc1	ZINC000853663807	ED	On-Demand	Anodyne	AMY2	43	29
O=C(CCCc1ccccc1)NOCc1ncc(Br)cc1Cl	ZINC000853663830	GI	On-Demand	Anodyne	FAAH	47	36
O=C(CCCc1ccccc1)NOCc1ncc(Br)cc1Cl	ZINC000853663830	GI	On-Demand	Anodyne	CES1	45	36
O=C(CCCc1ccccc1)NOCc1ncc(Br)cc1Cl	ZINC000853663830	GI	On-Demand	Anodyne	CES1D	52	30
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(C)=O)cc2C)CC1	ZINC000853663831	FE	On-Demand	Anodyne	P2RY12	52	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2C)CC1	ZINC000853663832	FE	On-Demand	Anodyne	P2RY12	52	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](Nc2cc(C#N)cnn2)C1	ZINC000853663844	EE	On-Demand	Mild	GPR119	30	42
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](Nc2cc(C#N)cnn2)C1	ZINC000853663845	EE	On-Demand	Mild	GPR119	30	42
N#Cc1ccc(CCONC(=N)c2ccccc2CN2CCC(O)CC2)cc1	ZINC000853663854	GF	On-Demand	Mild	SIGMAR1	21	44
O=C(c1ccc(OCCOC(F)F)cc1)N1CCCC1	ZINC000853663863	CF	On-Demand	Anodyne	HRH3	42	54
O=C(c1ccc(OCCOC(F)F)cc1)N1CCCC1	ZINC000853663863	CF	On-Demand	Anodyne	PLA2G4B	41	35
O=C(c1ccc(OCCOC(F)F)cc1)N1CCCC1	ZINC000853663863	CF	On-Demand	Anodyne	PSMB2	40	40
O=C(c1ccc(OCCOC(F)F)cc1)N1CCCC1	ZINC000853663863	CF	On-Demand	Anodyne	PSMB1	43	40
O=C(c1ccc(OCCOC(F)F)cc1)N1CCCC1	ZINC000853663863	CF	On-Demand	Anodyne	MLYCD	19	43
O=C(c1ccc(OCCOC(F)F)cc1)N1CCCC1	ZINC000853663863	CF	On-Demand	Anodyne	L3MBTL3	71	40
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000853663876	GF	On-Demand	Anodyne	HRH3	18	40
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000853663876	GF	On-Demand	Anodyne	L3MBTL3	43	34
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000853663878	GF	On-Demand	Anodyne	HRH3	18	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc(C(=O)N3CCCC3)cc2)C1	ZINC000853663878	GF	On-Demand	Anodyne	L3MBTL3	43	34
O=C(CCCc1ccccc1)NOCC1C[C@H]2C[C@@H]2C1	ZINC000853663897	CG	On-Demand	Anodyne	PREP	41	40
O=C(CCCc1ccccc1)NOCC1C[C@@H]2C[C@H]2C1	ZINC000853663898	CG	On-Demand	Anodyne	PREP	41	40
O=C(CCCc1ccccc1)NOC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853663899	CG	On-Demand	Anodyne	PREP	41	40
CC(C)(C(=O)NOCCC1SCCS1)c1ccccc1	ZINC000853663934	DG	On-Demand	Anodyne	AMY2	58	33
C#CCOCCN(CC(=O)OC)S(=O)(=O)c1ccc(Br)cc1	ZINC000853663945	GD	On-Demand	Mild	MMP13	15	42
C#CCOCCN(CC(=O)OC)S(=O)(=O)c1ccc(Br)cc1	ZINC000853663945	GD	On-Demand	Mild	MMP8	16	42
C#CCOCCN(CC(=O)OC)S(=O)(=O)c1ccc(Br)cc1	ZINC000853663945	GD	On-Demand	Mild	MMP9	16	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	CHRM1	19	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	DRD4	27	54
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	SSTR5	43	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	CCR3	15	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	CCR2	15	48
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	MCHR1	32	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C(C)(C)C)CC1	ZINC000853663956	FE	On-Demand	Anodyne	CCR8	45	41
Cc1nonc1COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663965	CE	On-Demand	Anodyne	HRH3	20	46
Cc1nonc1COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663965	CE	On-Demand	Anodyne	L3MBTL3	62	37
C=C(Cl)COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663978	CG	On-Demand	Mild	HRH3	30	50
C=C(Cl)COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663978	CG	On-Demand	Mild	PLA2G4B	40	34
C=C(Cl)COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663978	CG	On-Demand	Mild	PSMB2	32	41
C=C(Cl)COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663978	CG	On-Demand	Mild	PSMB1	33	41
C=C(Cl)COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663978	CG	On-Demand	Mild	MLYCD	19	42
C=C(Cl)COc1ccc(C(=O)N2CCCC2)cc1	ZINC000853663978	CG	On-Demand	Mild	L3MBTL3	79	42
CCN1CC[C@H](ONC(=O)C(C)(C)c2ccccc2)C1=O	ZINC000853663991	CD	On-Demand	Anodyne	CHRM3	47	36
CCN1CC[C@H](ONC(=O)C(C)(C)c2ccccc2)C1=O	ZINC000853663991	CD	On-Demand	Anodyne	AMY2	60	35
CC(C)(C(=O)NOCCO[C@@H]1CC1(F)F)c1ccccc1	ZINC000853664007	CE	On-Demand	Anodyne	AMY2	60	35
CC(C)(C(=O)NOCCO[C@H]1CC1(F)F)c1ccccc1	ZINC000853664008	CE	On-Demand	Anodyne	AMY2	60	35
CC(C)(C(=O)NOCC1CC=CC1)c1ccccc1	ZINC000853664013	CF	On-Demand	Anodyne	AMY2	57	33
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3ccc(C#N)cc3)n2)CC1	ZINC000853664040	GE	On-Demand	Mild	P2RY12	120	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3ccc(C#N)cc3)n2)CC1	ZINC000853664041	GE	On-Demand	Mild	P2RY12	120	39
O=C(CCCc1ccccc1)NOCc1ncsc1Br	ZINC000853664126	FG	On-Demand	Anodyne	FAAH	61	39
O=C(CCCc1ccccc1)NOCc1ncsc1Br	ZINC000853664126	FG	On-Demand	Anodyne	CES1	65	39
O=C(CCCc1ccccc1)NOCc1ncsc1Br	ZINC000853664126	FG	On-Demand	Anodyne	CES1D	53	31
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	ACE	39	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	GHRHR	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	P2RY12	200	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	TRY2_BOVIN	51	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	PREP	40	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	FAAH	23	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	TGM2	42	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	DPP7	23	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCCc2ccccc2)CC1	ZINC000853664127	GD	On-Demand	Anodyne	CCR8	19	42
CC(C)(C)OC(=O)N1CC[C@H](CNc2cc(C#N)cnn2)C(F)(F)C1	ZINC000853664136	FF	On-Demand	Mild	GPR119	44	40
CC(C)(C)OC(=O)N1CC[C@@H](CNc2cc(C#N)cnn2)C(F)(F)C1	ZINC000853664137	FF	On-Demand	Mild	GPR119	44	40
CC(C)(C)OC(=O)N1CC[C@@H](CNc2cc(F)ncn2)C(F)(F)C1	ZINC000853664154	EF	On-Demand	Anodyne	GPR119	55	39
CC(C)(C)OC(=O)N1CC[C@H](CNc2cc(F)ncn2)C(F)(F)C1	ZINC000853664155	EF	On-Demand	Anodyne	GPR119	55	39
CC(C)(C)OC(=O)N1CC[C@@H](CNc2ccnc(O)c2[N+](=O)[O-])C(F)(F)C1	ZINC000853664184	GF	On-Demand	Bother	GPR119	47	41
CC(C)(C)OC(=O)N1CC[C@H](CNc2ccnc(O)c2[N+](=O)[O-])C(F)(F)C1	ZINC000853664185	GF	On-Demand	Bother	GPR119	47	41
O=C(c1ccc(OCc2csc(Cl)n2)cc1)N1CCCC1	ZINC000853664186	DH	On-Demand	Anodyne	HRH3	23	49
O=C(c1ccc(OCc2csc(Cl)n2)cc1)N1CCCC1	ZINC000853664186	DH	On-Demand	Anodyne	L3MBTL3	53	37
Cn1ncc(C#N)c1N[C@@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F	ZINC000853664221	EE	On-Demand	Mild	GPR119	29	42
Cn1ncc(C#N)c1N[C@H]1CN(C(=O)OC(C)(C)C)CCC1(F)F	ZINC000853664222	EE	On-Demand	Mild	GPR119	29	42
CC(C)(C)OC(=O)N1CC[C@H](CNc2cnccn2)C(F)(F)C1	ZINC000853664227	EF	On-Demand	Anodyne	GRIN2B	16	48
CC(C)(C)OC(=O)N1CC[C@H](CNc2cnccn2)C(F)(F)C1	ZINC000853664227	EF	On-Demand	Anodyne	GPR119	49	50
O=C(N1C[C@@H]2CN(c3nc4ccccc4n4cccc34)CC[C@H]2C1)C(F)(F)F	ZINC000853664242	GG	On-Demand	Anodyne	HTR3A	25	41
O=C(N1C[C@H]2CCN(c3nc4ccccc4n4cccc34)C[C@H]2C1)C(F)(F)F	ZINC000853664243	GG	On-Demand	Anodyne	HTR3A	25	41
O=C(N1C[C@@H]2CCN(c3nc4ccccc4n4cccc34)C[C@@H]2C1)C(F)(F)F	ZINC000853664244	GG	On-Demand	Anodyne	HTR3A	25	41
O=C(N1C[C@H]2CCN(c3nc4ccccc4n4cccc34)C[C@@H]2C1)C(F)(F)F	ZINC000853664245	GG	On-Demand	Anodyne	HTR3A	25	41
CO[C@@H]1CCN(c2ncnc(F)c2Br)C[C@H]1C	ZINC000853664259	DE	On-Demand	Anodyne	PDE3B	43	34
CO[C@@H]1CCN(c2ncnc(F)c2Br)C[C@@H]1C	ZINC000853664260	DE	On-Demand	Anodyne	PDE3B	43	34
CO[C@H]1CCN(c2ncnc(F)c2Br)C[C@H]1C	ZINC000853664261	DE	On-Demand	Anodyne	PDE3B	43	34
CO[C@H]1CCN(c2ncnc(F)c2Br)C[C@@H]1C	ZINC000853664262	DE	On-Demand	Anodyne	PDE3B	43	34
O=C(CCCc1ccccc1)NOCC1CC=CC1	ZINC000853664273	CG	On-Demand	Anodyne	PREP	45	40
O=C(NCCCN1CCOC1=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853664285	GC	On-Demand	Anodyne	CCR3	30	46
O=C(NCCCN1CCOC1=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853664286	GC	On-Demand	Anodyne	CCR3	30	46
CC(C)(C)OC(=O)N1CC[C@@H](CNc2cnccn2)C(F)(F)C1	ZINC000853664328	EF	On-Demand	Anodyne	GRIN2B	16	48
CC(C)(C)OC(=O)N1CC[C@@H](CNc2cnccn2)C(F)(F)C1	ZINC000853664328	EF	On-Demand	Anodyne	GPR119	49	50
CC(C)(C)C(=O)NOCC[C@H]1CCc2ccccc21	ZINC000853664335	CG	On-Demand	Anodyne	NQO2	20	40
CC(C)(C)C(=O)NOCC[C@@H]1CCc2ccccc21	ZINC000853664336	CG	On-Demand	Anodyne	NQO2	20	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853664341	JF	On-Demand	Mild	IMDH_CRYPV	47	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cccc(C)c2=O)CC1	ZINC000853664346	DD	On-Demand	Anodyne	P2RY12	68	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cccc(C)c2=O)CC1	ZINC000853664347	DD	On-Demand	Anodyne	P2RY12	68	40
CO[C@@H](CONC(=O)C(C)(C)c1ccccc1)C1CCC1	ZINC000853664359	CF	On-Demand	Anodyne	AMY2	61	35
CC(C)(C(=O)NOCCc1ccc(C#N)cc1)c1ccccc1	ZINC000853664371	DG	On-Demand	Mild	CTSG	20	43
CC(C)(C(=O)NOCCc1ccc(C#N)cc1)c1ccccc1	ZINC000853664371	DG	On-Demand	Mild	CTRB1	17	43
CC(C)(C(=O)NOCCc1ccc(C#N)cc1)c1ccccc1	ZINC000853664371	DG	On-Demand	Mild	CELA2A	18	43
CC(C)(C(=O)NOCCc1ccc(C#N)cc1)c1ccccc1	ZINC000853664371	DG	On-Demand	Mild	CTRB_BOVIN	57	43
CC(C)(C(=O)NOC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccccc1	ZINC000853664379	CG	On-Demand	Anodyne	AMY2	56	32
CC(C)(C(=O)NOCC1C[C@H]2C[C@@H]2C1)c1ccccc1	ZINC000853664380	CG	On-Demand	Anodyne	AMY2	56	32
CC(C)(C(=O)NOCC1C[C@@H]2C[C@H]2C1)c1ccccc1	ZINC000853664381	CG	On-Demand	Anodyne	AMY2	56	32
CC(C)(C(=O)NOCCC1(O)CCC1)c1ccccc1	ZINC000853664407	CE	On-Demand	Anodyne	AMY2	58	33
CC(C)(C)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853664410	BE	On-Demand	Mild	CTSG	16	40
CC(C)(C)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853664410	BE	On-Demand	Mild	CTRB_BOVIN	53	40
CC(C)(C(=O)NOC[C@H]1COCCO1)c1ccccc1	ZINC000853664417	CD	On-Demand	Anodyne	AMY2	52	29
CC(C)(C(=O)NOC[C@@H]1COCCO1)c1ccccc1	ZINC000853664418	CD	On-Demand	Anodyne	AMY2	52	29
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NC2CC(c3ccccc3)C2)C1	ZINC000853664427	FF	On-Demand	Anodyne	EPHX2	20	42
O=C(CCCc1ccccc1)NOCc1cc(C2CC2)no1	ZINC000853664473	DG	On-Demand	Anodyne	PREP	56	46
O=C(CCCc1ccccc1)NOCc1cc(C2CC2)no1	ZINC000853664473	DG	On-Demand	Anodyne	FAAH	57	37
O=C(CCCc1ccccc1)NOCc1cc(C2CC2)no1	ZINC000853664473	DG	On-Demand	Anodyne	CES1	56	35
O=C(CCCc1ccccc1)NOCc1cc(C2CC2)no1	ZINC000853664473	DG	On-Demand	Anodyne	CES1D	51	29
O=C(CCCc1ccccc1)NOCCOCc1ccccc1	ZINC000853664507	DG	On-Demand	Anodyne	LTA4H	18	41
O=C(CCCc1ccccc1)NOCCOCc1ccccc1	ZINC000853664507	DG	On-Demand	Anodyne	FAAH	46	35
O=C(CCCc1ccccc1)NOCCOCc1ccccc1	ZINC000853664507	DG	On-Demand	Anodyne	CES1	55	40
O=C(CCCc1ccccc1)NOCCOCc1ccccc1	ZINC000853664507	DG	On-Demand	Anodyne	AKR1B10	21	42
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NC2CC(c3ccccc3)C2)C1	ZINC000853664527	FF	On-Demand	Anodyne	EPHX2	20	42
Cc1nonc1CONC(=O)CCCc1ccccc1	ZINC000853664529	CD	On-Demand	Anodyne	GSTM2	21	42
Cc1nonc1CONC(=O)CCCc1ccccc1	ZINC000853664529	CD	On-Demand	Anodyne	FAAH	62	38
Cc1nonc1CONC(=O)CCCc1ccccc1	ZINC000853664529	CD	On-Demand	Anodyne	GSTP1	18	42
Cc1nonc1CONC(=O)CCCc1ccccc1	ZINC000853664529	CD	On-Demand	Anodyne	CES1	61	38
Cc1nonc1CONC(=O)CCCc1ccccc1	ZINC000853664529	CD	On-Demand	Anodyne	CES1D	44	31
CC1(CONC(=O)C(C)(C)c2ccccc2)CCC1	ZINC000853664571	CG	On-Demand	Anodyne	AMY2	56	32
C#CCOCCONC(=O)C(C)(C)c1ccccc1	ZINC000853664576	CD	On-Demand	Mild	AMY2	57	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)C(C)(C)c2ccccc2)CC1	ZINC000853664582	GD	On-Demand	Anodyne	GHRHR	61	33
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)C(C)(C)c2ccccc2)CC1	ZINC000853664582	GD	On-Demand	Anodyne	P2RY12	178	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)C(C)(C)c2ccccc2)CC1	ZINC000853664582	GD	On-Demand	Anodyne	AMY2	52	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)C(C)(C)c2ccccc2)CC1	ZINC000853664583	GD	On-Demand	Anodyne	GHRHR	61	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)C(C)(C)c2ccccc2)CC1	ZINC000853664583	GD	On-Demand	Anodyne	P2RY12	178	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)C(C)(C)c2ccccc2)CC1	ZINC000853664583	GD	On-Demand	Anodyne	AMY2	52	31
COc1cccc(SCCONC(=O)C(C)(C)C)c1	ZINC000853664584	CF	On-Demand	Anodyne	MTNR1A	36	57
COc1cccc(SCCONC(=O)C(C)(C)C)c1	ZINC000853664584	CF	On-Demand	Anodyne	MTNR1B	39	57
CC(C)(C(=O)NOCc1ccc(C#N)cc1C(F)(F)F)c1ccccc1	ZINC000853664611	FI	On-Demand	Mild	CTRB_BOVIN	44	31
O=C(CCCc1ccccc1)NOCc1csc(Cl)n1	ZINC000853664632	DG	On-Demand	Anodyne	SCNN1A	41	36
O=C(CCCc1ccccc1)NOCc1csc(Cl)n1	ZINC000853664632	DG	On-Demand	Anodyne	FAAH	59	39
O=C(CCCc1ccccc1)NOCc1csc(Cl)n1	ZINC000853664632	DG	On-Demand	Anodyne	CES1	62	37
Cn1cncc1CCONC(=O)C(C)(C)c1ccccc1	ZINC000853664644	CD	On-Demand	Anodyne	AMY2	53	33
C#Cc1cccnc1N1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1	ZINC000853664650	DD	On-Demand	Mild	TRPV1	16	42
C#Cc1cccnc1N1CC[C@@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1	ZINC000853664652	DD	On-Demand	Mild	TRPV1	16	42
C#Cc1cccnc1N1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@H]2C1	ZINC000853664654	DD	On-Demand	Mild	TRPV1	16	42
C#Cc1cccnc1N1CC[C@H]2CN(C(=O)C(F)(F)F)C[C@@H]2C1	ZINC000853664659	DD	On-Demand	Mild	TRPV1	16	42
CC[C@H](NC(=O)COC(=O)CNS(=O)(=O)c1ccccc1C#N)c1ccc(Cl)cc1	ZINC000853664665	IE	On-Demand	Mild	UTS2	41	31
CC[C@@H](NC(=O)COC(=O)CNS(=O)(=O)c1ccccc1C#N)c1ccc(Cl)cc1	ZINC000853664667	IE	On-Demand	Mild	UTS2	41	31
O=C(N1C[C@H]2CCN(c3nccnc3-c3ccccc3)C[C@H]2C1)C(F)(F)F	ZINC000853664718	GF	On-Demand	Anodyne	RBP4	41	32
O=C(N1C[C@@H]2CN(c3nccnc3-c3ccccc3)CC[C@H]2C1)C(F)(F)F	ZINC000853664720	GF	On-Demand	Anodyne	RBP4	41	32
COC[C@@H](CONC(=O)C(C)(C)c1ccccc1)OC	ZINC000853664722	CD	On-Demand	Anodyne	AMY2	57	35
COC[C@@H](CONC(=O)C(C)(C)c1ccccc1)OC	ZINC000853664722	CD	On-Demand	Anodyne	KIF11	15	41
O=C(N1C[C@H]2CCN(c3nccnc3-c3ccccc3)C[C@@H]2C1)C(F)(F)F	ZINC000853664723	GF	On-Demand	Anodyne	RBP4	41	32
O=C(N1C[C@@H]2CCN(c3nccnc3-c3ccccc3)C[C@@H]2C1)C(F)(F)F	ZINC000853664725	GF	On-Demand	Anodyne	RBP4	41	32
COC(=O)C1(CONC(=O)CCCc2ccccc2)CC1	ZINC000853664741	CE	On-Demand	Anodyne	FAAH	37	40
COC(=O)C1(CONC(=O)CCCc2ccccc2)CC1	ZINC000853664741	CE	On-Demand	Anodyne	CES1	41	40
COC(=O)C1(CONC(=O)CCCc2ccccc2)CC1	ZINC000853664741	CE	On-Demand	Anodyne	SLC12A5	45	38
C#CCOCCOc1ccc(C(=O)N2CCCC2)cc1	ZINC000853664784	CD	On-Demand	Mild	HRH3	37	56
C#CCOCCOc1ccc(C(=O)N2CCCC2)cc1	ZINC000853664784	CD	On-Demand	Mild	PLA2G4B	41	35
C#CCOCCOc1ccc(C(=O)N2CCCC2)cc1	ZINC000853664784	CD	On-Demand	Mild	PSMB1	42	39
C#CCOCCOc1ccc(C(=O)N2CCCC2)cc1	ZINC000853664784	CD	On-Demand	Mild	MLYCD	17	40
C#CCOCCOc1ccc(C(=O)N2CCCC2)cc1	ZINC000853664784	CD	On-Demand	Mild	L3MBTL3	64	40
CC(C)(C(=O)NOCCOC(F)F)c1ccccc1	ZINC000853664785	CE	On-Demand	Anodyne	AMY2	61	35
O=C(c1ccc(OCCC2SCCS2)cc1)N1CCCC1	ZINC000853664802	DG	On-Demand	Anodyne	HRH3	49	53
O=C(c1ccc(OCCC2SCCS2)cc1)N1CCCC1	ZINC000853664802	DG	On-Demand	Anodyne	PSMB1	43	39
O=C(c1ccc(OCCC2SCCS2)cc1)N1CCCC1	ZINC000853664802	DG	On-Demand	Anodyne	MLYCD	17	40
O=C(c1ccc(OCCC2SCCS2)cc1)N1CCCC1	ZINC000853664802	DG	On-Demand	Anodyne	L3MBTL3	88	43
N=C(NOCCOCc1ccccc1)c1ccccc1CN1CCC(O)CC1	ZINC000853664805	GF	On-Demand	Anodyne	SIGMAR1	34	43
CC(C)(C(=O)NOCCOCc1ccccc1)c1ccccc1	ZINC000853664811	DG	On-Demand	Anodyne	AMY2	54	35
CC(C)(C(=O)NOCCOCc1ccccc1)c1ccccc1	ZINC000853664811	DG	On-Demand	Anodyne	CAPN2	45	33
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nccc2-c2ccncc2)CC1	ZINC000853664812	FD	On-Demand	Anodyne	P2RY12	76	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nccc2-c2ccncc2)CC1	ZINC000853664813	FD	On-Demand	Anodyne	P2RY12	76	43
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	CHRM2	26	51
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	CHRM1	24	51
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	DRD2	31	52
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	DRD4	61	52
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	ACHE	54	48
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	DRD3	20	52
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	SLC6A3	18	42
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	GHRHR	46	30
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	KCNH2	18	45
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	HTR4	29	41
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	CHRM3	41	51
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	LTA4H	29	44
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	SIGMAR1	63	57
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	SSTR5	65	39
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	CCR3	35	44
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	GHSR	27	43
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	SLC6A5	24	45
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	EPHX2	15	47
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	PDK1	41	41
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	MCHR1	64	51
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	CACNA1G	38	44
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	CCR8	24	44
C[C@@H](ONC(=O)C(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664819	FE	On-Demand	Anodyne	BIRC2	63	43
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664850	JD	On-Demand	Mild	DRD4	30	43
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664850	JD	On-Demand	Mild	ACHE	30	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664850	JD	On-Demand	Mild	SIGMAR1	35	46
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664850	JD	On-Demand	Mild	SSTR5	40	35
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853664850	JD	On-Demand	Mild	MCHR1	28	46
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	DRD4	20	43
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	KCNH2	15	48
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	LTA4H	26	43
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	SIGMAR1	27	44
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	SSTR5	78	45
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	CCR3	43	39
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	MLNR	62	45
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	CXCR3	44	41
CC(=O)Nc1ccc(CN2CCC(Nc3cnc(F)cn3)CC2)cc1	ZINC000853664852	EF	On-Demand	Anodyne	MCHR1	62	42
O=C(NOCCC1SCCS1)c1c(F)cccc1Cl	ZINC000853664868	DG	On-Demand	Anodyne	PPIA	24	42
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	EDNRB	19	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	CCKAR	55	43
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	CTSL	25	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	BRS3	26	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	NMBR	30	45
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	GRPR	59	32
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	MMP11	40	34
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	CCKBR	36	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	ALOX15	15	42
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853664877	JD	On-Demand	Mild	KISS1R	54	32
O=S(=O)(CCNc1ccnc2c(F)cc(Cl)cc12)C1CCOCC1	ZINC000853664880	FG	On-Demand	Anodyne	HRP1_PLAFA	100	36
CC1(CONC(=O)CCCc2ccccc2)CCC1	ZINC000853664893	CG	On-Demand	Anodyne	FKBP1A	26	41
CC1(CONC(=O)CCCc2ccccc2)CCC1	ZINC000853664893	CG	On-Demand	Anodyne	PREP	39	40
CC1(CONC(=O)CCCc2ccccc2)CCC1	ZINC000853664893	CG	On-Demand	Anodyne	SLC12A5	40	36
O=C(CCCc1ccccc1)NOCCOC(F)F	ZINC000853665009	CE	On-Demand	Anodyne	LTA4H	16	40
O=C(CCCc1ccccc1)NOCCOC(F)F	ZINC000853665009	CE	On-Demand	Anodyne	CES1	40	38
Nc1ncccc1CONC(=O)CCCc1ccccc1	ZINC000853665037	CE	On-Demand	Anodyne	FAAH	68	40
Nc1ncccc1CONC(=O)CCCc1ccccc1	ZINC000853665037	CE	On-Demand	Anodyne	CES1	70	38
O=C(c1ccc(OCC2=NS(=O)(=O)c3ccccc32)cc1)N1CCCC1	ZINC000853665040	FE	On-Demand	Anodyne	L3MBTL3	44	34
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](Nc2nc3ncccc3cc2C#N)C1	ZINC000853665048	GH	On-Demand	Mild	GPR119	32	41
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](Nc2nc3ncccc3cc2C#N)C1	ZINC000853665049	GH	On-Demand	Mild	GPR119	32	41
CO[C@@H](CONC(=O)C(C)(C)c1ccccc1)[C@@H]1CCOC1	ZINC000853665070	DE	On-Demand	Anodyne	AMY2	45	31
CO[C@@H](CONC(=O)C(C)(C)c1ccccc1)[C@H]1CCOC1	ZINC000853665072	DE	On-Demand	Anodyne	AMY2	45	31
CCCOc1cccc(CONC(=N)c2ccccc2CN2CCC(O)CC2)c1	ZINC000853665101	GG	On-Demand	Anodyne	HRH2	41	39
CCCOc1cccc(CONC(=N)c2ccccc2CN2CCC(O)CC2)c1	ZINC000853665101	GG	On-Demand	Anodyne	SIGMAR1	27	42
CC(C)(C)OC(=O)N1CCC(F)(F)[C@H](Nc2cnc(F)cn2)C1	ZINC000853665107	EF	On-Demand	Anodyne	GPR119	39	40
CC(C)(C)OC(=O)N1CCC(F)(F)[C@@H](Nc2cnc(F)cn2)C1	ZINC000853665108	EF	On-Demand	Anodyne	GPR119	39	40
CO[C@@H](CONC(=O)C(C)(C)c1ccccc1)C1CCCC1	ZINC000853665115	DG	On-Demand	Anodyne	AMY2	64	38
CC(C)(C)OC(=O)N1CCO[C@H](Cn2nccc2-c2ccncc2)C1	ZINC000853665136	EF	On-Demand	Anodyne	GPR119	25	41
C#Cc1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000853665137	EG	On-Demand	Mild	DRD4	23	45
C#Cc1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000853665137	EG	On-Demand	Mild	SIGMAR1	23	42
C#Cc1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000853665137	EG	On-Demand	Mild	SSTR5	74	43
C#Cc1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000853665137	EG	On-Demand	Mild	MLNR	45	42
C#Cc1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000853665137	EG	On-Demand	Mild	MCHR1	41	41
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2nccc2-c2ccncc2)C1	ZINC000853665138	EF	On-Demand	Anodyne	GPR119	25	41
Cc1nonc1CONC(=O)CCC1CCCCC1	ZINC000853665194	CE	On-Demand	Anodyne	BMP1	50	37
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(C)(=O)=O)CC1	ZINC000853665197	DB	On-Demand	Anodyne	CHRNA3	17	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(C)(=O)=O)CC1	ZINC000853665198	DB	On-Demand	Anodyne	CHRNA3	17	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCC2CCCCC2)CC1	ZINC000853665212	GE	On-Demand	Anodyne	P2RY12	49	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)CCC2CCCCC2)CC1	ZINC000853665213	GE	On-Demand	Anodyne	P2RY12	49	35
COC(=O)c1nccc(N2CC[C@@H]3CN(C(=O)C(F)(F)F)C[C@H]3C2)n1	ZINC000853665216	FD	On-Demand	Anodyne	SORD	23	41
COC(=O)c1nccc(N2CC[C@H]3CN(C(=O)C(F)(F)F)C[C@@H]3C2)n1	ZINC000853665217	FD	On-Demand	Anodyne	SORD	23	41
COC(=O)c1nccc(N2CC[C@H]3CN(C(=O)C(F)(F)F)C[C@H]3C2)n1	ZINC000853665219	FD	On-Demand	Anodyne	SORD	23	41
COC(=O)c1nccc(N2CC[C@@H]3CN(C(=O)C(F)(F)F)C[C@@H]3C2)n1	ZINC000853665221	FD	On-Demand	Anodyne	SORD	23	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(F)ccc2F)CC1	ZINC000853665225	EE	On-Demand	Anodyne	P2RY12	54	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(F)ccc2F)CC1	ZINC000853665227	EE	On-Demand	Anodyne	P2RY12	54	38
CC(C)(C(=O)NOCCC1CCC1)c1ccccc1	ZINC000853665257	CG	On-Demand	Anodyne	CHRM1	25	43
CC(C)(C(=O)NOCCC1CCC1)c1ccccc1	ZINC000853665257	CG	On-Demand	Anodyne	CHRM4	18	43
CC(C)(C(=O)NOCCC1CCC1)c1ccccc1	ZINC000853665257	CG	On-Demand	Anodyne	CHRM5	16	43
CC(C)(C(=O)NOCCC1CCC1)c1ccccc1	ZINC000853665257	CG	On-Demand	Anodyne	CHRM3	52	43
CC(C)(C(=O)NOCCC1CCC1)c1ccccc1	ZINC000853665257	CG	On-Demand	Anodyne	AMY2	68	39
Cn1nnc2c(NC[C@@H]3CCN(C(=O)OC(C)(C)C)CC3(F)F)ncnc21	ZINC000853665264	GE	On-Demand	Anodyne	GPR119	38	46
Cn1nnc2c(NC[C@H]3CCN(C(=O)OC(C)(C)C)CC3(F)F)ncnc21	ZINC000853665266	GE	On-Demand	Anodyne	GPR119	38	46
Cn1nnc2c(N[C@@H]3CN(C(=O)OC(C)(C)C)CCC3(F)F)ncnc21	ZINC000853665275	FD	On-Demand	Anodyne	GPR119	38	41
Cn1nnc2c(N[C@H]3CN(C(=O)OC(C)(C)C)CCC3(F)F)ncnc21	ZINC000853665276	FD	On-Demand	Anodyne	GPR119	38	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2F)CC1	ZINC000853665277	FE	On-Demand	Anodyne	P2RY12	41	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(C)=O)cc2F)CC1	ZINC000853665279	FE	On-Demand	Anodyne	P2RY12	41	39
COC[C@H](NC(=O)NCCCN1CCOC1=O)c1cccc(OC)c1	ZINC000853665319	FD	On-Demand	Anodyne	DRD4	43	32
COC[C@@H](NC(=O)NCCCN1CCOC1=O)c1cccc(OC)c1	ZINC000853665320	FD	On-Demand	Anodyne	DRD4	43	32
Cn1nnc2c(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)ncnc21	ZINC000853665322	FC	On-Demand	Anodyne	SIRT3	42	33
Cn1nnc2c(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)ncnc21	ZINC000853665323	FC	On-Demand	Anodyne	SIRT3	42	33
Cn1nnc2c(N3CC[C@H]4CN(C(=O)C(F)(F)F)C[C@@H]4C3)ncnc21	ZINC000853665324	FC	On-Demand	Anodyne	SIRT3	42	33
Cn1nnc2c(N3CC[C@@H]4CN(C(=O)C(F)(F)F)C[C@H]4C3)ncnc21	ZINC000853665325	FC	On-Demand	Anodyne	SIRT3	42	33
Cn1cncc1CCOc1ccc(OC2CCCCC2)cc1	ZINC000853665354	DH	On-Demand	Anodyne	HRH3	32	46
C#CCOCCONC(=O)c1c(F)cccc1Cl	ZINC000853665366	CD	On-Demand	Mild	PPIA	25	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)cc2C(=O)OC)CC1	ZINC000853665367	GD	On-Demand	Anodyne	P2RY12	77	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)cc2C(=O)OC)CC1	ZINC000853665368	GD	On-Demand	Anodyne	P2RY12	77	39
O=C(NOCCC1(O)CCC1)c1c(F)cccc1Cl	ZINC000853665416	CE	On-Demand	Anodyne	PPIA	24	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	DRD4	23	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	KCNH2	18	49
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	LTA4H	22	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	SIGMAR1	27	42
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	SSTR5	82	49
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	CCR3	66	41
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	MLNR	60	45
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	CCR2	17	43
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	CXCR3	39	40
CC(=O)Nc1ccc(CN2CCC(Nc3cc(F)ncn3)CC2)cc1	ZINC000853665417	EF	On-Demand	Anodyne	MCHR1	71	45
O=C(CCC1CCCCC1)NOCc1cncs1	ZINC000853665422	CG	On-Demand	Anodyne	CYP3A4	15	45
COC[C@@H](CONC(=O)c1c(F)cccc1Cl)OC	ZINC000853665431	CD	On-Demand	Anodyne	PPIA	23	40
CON(C)CCNC(=O)N[C@@H]1CCCC[C@H]1Cc1ccccc1	ZINC000853665450	DF	On-Demand	Anodyne	CCR3	26	44
CON(C)CCNC(=O)N[C@@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000853665451	DF	On-Demand	Anodyne	CCR3	26	44
CON(C)CCNC(=O)N[C@H]1CCCC[C@H]1Cc1ccccc1	ZINC000853665452	DF	On-Demand	Anodyne	CCR3	26	44
CON(C)CCNC(=O)N[C@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000853665453	DF	On-Demand	Anodyne	CCR3	26	44
O=C(NOC[C@H]1C[C@@H]2C[C@@H]2C1)c1c(F)cccc1Cl	ZINC000853665470	CG	On-Demand	Anodyne	PPIA	24	41
O=C(NOC[C@H]1C[C@@H]2C[C@@H]2C1)c1c(F)cccc1Cl	ZINC000853665470	CG	On-Demand	Anodyne	TYK2	18	43
O=C(NOCC1C[C@@H]2C[C@H]2C1)c1c(F)cccc1Cl	ZINC000853665471	CG	On-Demand	Anodyne	PPIA	24	41
O=C(NOCC1C[C@@H]2C[C@H]2C1)c1c(F)cccc1Cl	ZINC000853665471	CG	On-Demand	Anodyne	TYK2	18	43
O=C(NOCC1C[C@H]2C[C@@H]2C1)c1c(F)cccc1Cl	ZINC000853665472	CG	On-Demand	Anodyne	PPIA	24	41
O=C(NOCC1C[C@H]2C[C@@H]2C1)c1c(F)cccc1Cl	ZINC000853665472	CG	On-Demand	Anodyne	TYK2	18	43
COc1ccc2c(c1)CN(c1nccc3cc(OC)c(OC)cc13)CCO2	ZINC000853665494	FH	On-Demand	Anodyne	PDE3A	41	39
COc1ccc2c(c1)CN(c1nccc3cc(OC)c(OC)cc13)CCO2	ZINC000853665494	FH	On-Demand	Anodyne	PDE3B	46	39
COc1ccc2c(c1)CN(c1nccc3cc(OC)c(OC)cc13)CCO2	ZINC000853665494	FH	On-Demand	Anodyne	PDE10A	16	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)ccc2NC(C)=O)CC1	ZINC000853665531	GE	On-Demand	Anodyne	P2RY12	63	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)ccc2NC(C)=O)CC1	ZINC000853665532	GE	On-Demand	Anodyne	P2RY12	63	39
O=C(CCC1CCCCC1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853665547	FH	On-Demand	Anodyne	L3MBTL3	48	34
O=C(CCC1CCCCC1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853665548	FH	On-Demand	Anodyne	L3MBTL3	48	34
O=C(NOCC1CC=CC1)c1c(F)cccc1Cl	ZINC000853665554	CG	On-Demand	Anodyne	PPIA	24	43
O=C(NOCC1CC=CC1)c1c(F)cccc1Cl	ZINC000853665554	CG	On-Demand	Anodyne	TYK2	29	45
CC(C)c1ccc2ncnc(NCCS(=O)(=O)C3CCOCC3)c2c1	ZINC000853665557	FF	On-Demand	Anodyne	CLK4	56	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3cccs3)n2)CC1	ZINC000853665559	FE	On-Demand	Anodyne	P2RY12	81	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3cccs3)n2)CC1	ZINC000853665560	FE	On-Demand	Anodyne	P2RY12	81	38
CC[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@@H](C)O	ZINC000853665579	DD	On-Demand	Anodyne	ABCC8	48	37
CC[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@H](C)O	ZINC000853665580	DD	On-Demand	Anodyne	ABCC8	48	37
CC[C@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@@H](C)O	ZINC000853665581	DD	On-Demand	Anodyne	ABCC8	48	37
CC[C@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@H](C)O	ZINC000853665582	DD	On-Demand	Anodyne	ABCC8	48	37
CO[C@@H](CONC(=O)c1c(F)cccc1Cl)C1CCC1	ZINC000853665590	DF	On-Demand	Anodyne	TYK2	17	41
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1c(F)cccc1Cl	ZINC000853665616	GG	On-Demand	Anodyne	L3MBTL3	50	34
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1c(F)cccc1Cl	ZINC000853665617	GG	On-Demand	Anodyne	L3MBTL3	50	34
O=C(NOCCO[C@@H]1CC1(F)F)c1c(F)cccc1Cl	ZINC000853665623	DF	On-Demand	Anodyne	PPIA	24	41
O=C(NOCCO[C@H]1CC1(F)F)c1c(F)cccc1Cl	ZINC000853665624	DF	On-Demand	Anodyne	PPIA	24	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C(N)=O)ccc2C)CC1	ZINC000853665635	FD	On-Demand	Anodyne	P2RY12	66	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C(N)=O)ccc2C)CC1	ZINC000853665636	FD	On-Demand	Anodyne	P2RY12	66	40
CO[C@@H](COc1cccc(CNC(=O)OC(C)(C)C)c1)[C@H]1CCOC1	ZINC000853665648	FG	On-Demand	Anodyne	PDS	83	40
CO[C@@H](COc1cccc(CNC(=O)OC(C)(C)C)c1)[C@@H]1CCOC1	ZINC000853665649	FG	On-Demand	Anodyne	PDS	83	40
N#Cc1ccc(CCONC(=N)CN2CCCCCC2)cc1	ZINC000853665660	DE	On-Demand	Mild	HRH3	17	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2OC(F)F)CC1	ZINC000853665672	FE	On-Demand	Anodyne	P2RY12	102	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2OC(F)F)CC1	ZINC000853665673	FE	On-Demand	Anodyne	P2RY12	102	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(C)=O)c(F)c2)CC1	ZINC000853665704	FE	On-Demand	Anodyne	P2RY12	52	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(C)=O)c(F)c2)CC1	ZINC000853665705	FE	On-Demand	Anodyne	P2RY12	52	37
CS(=O)(=O)N1CC[C@@H](CONC(=N)Cc2ccc(Cl)cc2)C1	ZINC000853665707	ED	On-Demand	Anodyne	NR1D1	17	43
CS(=O)(=O)N1CC[C@H](CONC(=N)Cc2ccc(Cl)cc2)C1	ZINC000853665708	ED	On-Demand	Anodyne	NR1D1	17	43
C#CCOc1cccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853665711	DD	On-Demand	Mild	CHRNA10	51	39
C#CCOc1cccc(OC[C@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853665712	DD	On-Demand	Mild	CHRNA10	51	39
COC(=O)C1(COc2cccc(CNC(=O)OC(C)(C)C)c2)CC1	ZINC000853665717	EG	On-Demand	Anodyne	HRH2	22	46
COC(=O)C1(COc2cccc(CNC(=O)OC(C)(C)C)c2)CC1	ZINC000853665717	EG	On-Demand	Anodyne	PDS	71	39
C#CCOCCOc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853665722	DF	On-Demand	Mild	HRH2	30	48
C#CCOCCOc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853665722	DF	On-Demand	Mild	PDS	78	45
COC(=O)c1ccc(C(F)(F)F)nc1N1CCOc2ccc(OC)cc2C1	ZINC000853665795	GG	On-Demand	Anodyne	BMP1	42	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C)cc2=O)CC1	ZINC000853665802	DD	On-Demand	Anodyne	P2RY12	98	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C)cc2=O)CC1	ZINC000853665803	DD	On-Demand	Anodyne	P2RY12	98	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)c(C)nn2)CC1	ZINC000853665814	ED	On-Demand	Anodyne	P2RY12	52	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)c(C)nn2)CC1	ZINC000853665816	ED	On-Demand	Anodyne	P2RY12	52	37
O=C(CCC1CCCCC1)NOCc1cc(C2CC2)no1	ZINC000853665839	CG	On-Demand	Anodyne	BMP1	55	34
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853665855	JD	On-Demand	Mild	VIPR1	29	46
CC(C)(C)OC(=O)NCc1cccc(OCc2ncsc2Br)c1	ZINC000853665857	GJ	On-Demand	Anodyne	PDS	66	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3ccsc3)n2)CC1	ZINC000853665879	FE	On-Demand	Anodyne	P2RY12	78	49
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3ccsc3)n2)CC1	ZINC000853665880	FE	On-Demand	Anodyne	P2RY12	78	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665884	GE	On-Demand	Anodyne	P2RY12	41	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665884	GE	On-Demand	Anodyne	MC4R	105	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665884	GE	On-Demand	Anodyne	CCR1	43	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665884	GE	On-Demand	Anodyne	DPP7	40	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665885	GE	On-Demand	Anodyne	P2RY12	41	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665885	GE	On-Demand	Anodyne	MC4R	105	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665885	GE	On-Demand	Anodyne	CCR1	43	44
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccc(Cl)cc2)CC1	ZINC000853665885	GE	On-Demand	Anodyne	DPP7	40	43
C[C@H]1CCCCN1CC(=N)NOCCc1ccc(C#N)cc1	ZINC000853665919	DE	On-Demand	Mild	HRH3	33	48
C[C@@H]1CCCCN1CC(=N)NOCCc1ccc(C#N)cc1	ZINC000853665920	DE	On-Demand	Mild	HRH3	33	48
CO[C@@H](CONC(=O)c1c(F)cccc1Cl)[C@H]1CCOC1	ZINC000853665947	DE	On-Demand	Anodyne	TYK2	15	40
CO[C@@H](CONC(=O)c1c(F)cccc1Cl)[C@@H]1CCOC1	ZINC000853665949	DE	On-Demand	Anodyne	TYK2	15	40
O=C(NOCCC1CCC1)c1c(F)cccc1Cl	ZINC000853665964	CG	On-Demand	Anodyne	PPIA	25	43
O=S(=O)(CCNc1ncnc2c1ncn2-c1ccccc1)C1CCOCC1	ZINC000853665975	GD	On-Demand	Anodyne	ADORA3	42	37
C[C@@H](c1ccc(S(C)(=O)=O)cc1)N1CCC(Nc2cc(F)ncn2)CC1	ZINC000853665986	GF	On-Demand	Anodyne	GPR119	50	40
COc1ccc2c(c1)CN(c1ccccc1S(=O)(=O)N(C)C)CCO2	ZINC000853665987	FE	On-Demand	Anodyne	PKM	28	44
CO[C@@H](CONC(=O)c1c(F)cccc1Cl)C1CCCC1	ZINC000853665992	DG	On-Demand	Anodyne	TYK2	17	41
CS(=O)(=O)N1CC[C@@H](CONC(=O)c2c(F)cccc2Cl)C1	ZINC000853665998	FD	On-Demand	Anodyne	EPHX2	19	40
CS(=O)(=O)N1CC[C@H](CONC(=O)c2c(F)cccc2Cl)C1	ZINC000853665999	FD	On-Demand	Anodyne	EPHX2	19	40
O=C(NOCCOC(F)F)c1c(F)cccc1Cl	ZINC000853666029	CE	On-Demand	Anodyne	PPIA	24	43
COc1ccc2c(c1)CN(c1cc(=O)n(C)c(=O)n1C)CCO2	ZINC000853666032	DC	On-Demand	Anodyne	DRD5	15	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853666039	JD	On-Demand	Mild	DRD4	28	44
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853666039	JD	On-Demand	Mild	SIGMAR1	25	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853666039	JD	On-Demand	Mild	MCHR1	16	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853666039	JD	On-Demand	Mild	BIRC2	34	42
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853666040	JD	On-Demand	Mild	DRD4	28	44
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853666040	JD	On-Demand	Mild	SIGMAR1	25	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853666040	JD	On-Demand	Mild	MCHR1	16	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccccc1C#N)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853666040	JD	On-Demand	Mild	BIRC2	34	42
Cn1cncc1CCOc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666090	EG	On-Demand	Anodyne	HRH2	27	44
Cn1cncc1CCOc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666090	EG	On-Demand	Anodyne	PDS	62	41
N=C(CN1CCCCCC1)NOCCOCc1ccccc1	ZINC000853666129	DF	On-Demand	Anodyne	LTA4H	24	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(=O)NC)ccc2=O)CC1	ZINC000853666130	FC	On-Demand	Anodyne	P2RY12	120	43
COCC(COC)Nc1cc(Cl)nc2cc(C)nn12	ZINC000853666132	CD	On-Demand	Anodyne	CRHR1	17	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(=O)NC)ccc2=O)CC1	ZINC000853666133	FC	On-Demand	Anodyne	P2RY12	120	43
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCCOC(F)F	ZINC000853666135	FD	On-Demand	Anodyne	SLC6A4	17	40
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCCOC(F)F	ZINC000853666135	FD	On-Demand	Anodyne	SLC6A3	46	40
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCCOC(F)F	ZINC000853666135	FD	On-Demand	Anodyne	SIGMAR1	47	42
CCC(CC)CONC(=O)CCOc1ccccc1	ZINC000853666137	CF	On-Demand	Anodyne	LTA4H	45	43
CCC(CC)CONC(=O)CCOc1ccccc1	ZINC000853666137	CF	On-Demand	Anodyne	PLA2G4B	64	33
CCC(CC)CONC(=O)CCOc1ccccc1	ZINC000853666137	CF	On-Demand	Anodyne	PDS	75	41
CCn1ncnc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666141	EF	On-Demand	Anodyne	HRH2	18	41
CCn1ncnc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666141	EF	On-Demand	Anodyne	PDS	72	37
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCCC1SCCS1	ZINC000853666148	GF	On-Demand	Anodyne	SIGMAR1	52	40
COc1cccc(SCCONC(=N)CN2CCOCC2)c1	ZINC000853666153	ED	On-Demand	Anodyne	DRD4	40	31
Cc1nonc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666190	DF	On-Demand	Anodyne	CACNA1D	16	49
Cc1nonc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666190	DF	On-Demand	Anodyne	PDS	66	38
C#CCOCCOc1ccc(NC(=O)c2cnn(C)c2)cc1	ZINC000853666191	CD	On-Demand	Mild	PRNP	44	32
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	ADRB1	19	41
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	ALOX5	17	42
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	TSHR	42	33
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	PPIA	32	42
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	LTA4H	70	53
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	CA1	36	47
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	CTSB	26	43
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	CTSK	21	40
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	CTSL	16	40
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	SCN2A	23	44
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	ADAM17	16	42
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	S1PR4	24	41
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	PLA2G4B	62	38
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	FAAH	31	51
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	S1PR1	15	41
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	CAPN2	57	43
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	PLAU	19	40
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	CA12	17	47
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	CA9	19	47
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	FFAR1	38	40
CCOC(=O)Nc1ccc(OCCOCc2ccccc2)cc1	ZINC000853666193	DH	On-Demand	Anodyne	PDS	40	36
CCOC(=O)Nc1ccc(O[C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853666231	GE	On-Demand	Anodyne	P2RY12	66	38
CCOC(=O)Nc1ccc(O[C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853666231	GE	On-Demand	Anodyne	TGM2	25	44
CCOC(=O)Nc1ccc(O[C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853666231	GE	On-Demand	Anodyne	F13A1	40	44
CCOC(=O)Nc1ccc(O[C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853666232	GE	On-Demand	Anodyne	P2RY12	66	38
CCOC(=O)Nc1ccc(O[C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853666232	GE	On-Demand	Anodyne	TGM2	25	44
CCOC(=O)Nc1ccc(O[C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853666232	GE	On-Demand	Anodyne	F13A1	40	44
CCOC(=O)Nc1ccc(OC[C@H](OC)C2CCCC2)cc1	ZINC000853666247	DH	On-Demand	Anodyne	FAAH	23	41
CCOC(=O)Nc1ccc(OC[C@H](OC)C2CCCC2)cc1	ZINC000853666247	DH	On-Demand	Anodyne	EPHX2	17	43
CCOC(=O)Nc1ccc(OC[C@@H](OC)C2CCCC2)cc1	ZINC000853666248	DH	On-Demand	Anodyne	FAAH	23	41
CCOC(=O)Nc1ccc(OC[C@@H](OC)C2CCCC2)cc1	ZINC000853666248	DH	On-Demand	Anodyne	EPHX2	17	43
COC(=O)C1(CONC(=O)CCOc2ccccc2)CC1	ZINC000853666254	CD	On-Demand	Anodyne	LTA4H	39	41
N=C(CCN1CCN(Cc2ccccc2)CC1)NOC[C@H]1COCCO1	ZINC000853666256	FD	On-Demand	Anodyne	SIGMAR1	42	38
N=C(CCN1CCN(Cc2ccccc2)CC1)NOC[C@@H]1COCCO1	ZINC000853666257	FD	On-Demand	Anodyne	SIGMAR1	42	38
COc1cccc(SCCONC(=O)C2CCCC2)c1	ZINC000853666260	CG	On-Demand	Anodyne	NQO2	19	44
COc1cccc(SCCONC(=O)C2CCCC2)c1	ZINC000853666260	CG	On-Demand	Anodyne	MTNR1A	50	55
COc1cccc(SCCONC(=O)C2CCCC2)c1	ZINC000853666260	CG	On-Demand	Anodyne	MTNR1B	51	55
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCc1cncs1	ZINC000853666264	FE	On-Demand	Anodyne	SIGMAR1	42	38
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCc1cncs1	ZINC000853666264	FE	On-Demand	Anodyne	CYP3A4	40	38
CS(=O)(=O)N1CC[C@H](COc2ccc(NC3CCCCC3)cc2)C1	ZINC000853666266	FG	On-Demand	Anodyne	EPHX2	21	41
CS(=O)(=O)N1CC[C@@H](COc2ccc(NC3CCCCC3)cc2)C1	ZINC000853666267	FG	On-Demand	Anodyne	EPHX2	21	41
C#CCOc1cccc(OC[C@H](COC)OC)c1	ZINC000853666306	CD	On-Demand	Mild	PDS	47	35
C#CCOc1cccc(OC[C@@H](COC)OC)c1	ZINC000853666307	CD	On-Demand	Mild	PDS	47	35
C#CCOc1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666321	EG	On-Demand	Mild	GRIN2B	39	44
C#CCOc1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666321	EG	On-Demand	Mild	CHEK2	20	46
C#CCOc1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666321	EG	On-Demand	Mild	CHRNA10	43	35
C#CCOc1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666321	EG	On-Demand	Mild	L3MBTL3	53	38
C#CCOc1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666322	EG	On-Demand	Mild	GRIN2B	39	44
C#CCOc1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666322	EG	On-Demand	Mild	CHEK2	20	46
C#CCOc1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666322	EG	On-Demand	Mild	CHRNA10	43	35
C#CCOc1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853666322	EG	On-Demand	Mild	L3MBTL3	53	38
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(-c3ccsc3)n2)CC1	ZINC000853666323	GH	On-Demand	Anodyne	DRD4	18	47
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(-c3ccsc3)n2)CC1	ZINC000853666323	GH	On-Demand	Anodyne	SIGMAR1	17	52
CCCn1ncnc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666328	EG	On-Demand	Anodyne	HRH2	15	40
CCCn1ncnc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666328	EG	On-Demand	Anodyne	PDS	65	36
CO[C@@H](COc1cccc(CNC(=O)OC(C)(C)C)c1)C1CCC1	ZINC000853666339	EH	On-Demand	Anodyne	HRH2	23	43
CO[C@@H](COc1cccc(CNC(=O)OC(C)(C)C)c1)C1CCC1	ZINC000853666339	EH	On-Demand	Anodyne	PDS	98	43
COC[C@@H](CONC(=O)CCOc1ccccc1)OC	ZINC000853666359	CD	On-Demand	Anodyne	LTA4H	43	42
COC[C@@H](CONC(=O)CCOc1ccccc1)OC	ZINC000853666359	CD	On-Demand	Anodyne	PDS	54	38
C#CCOc1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853666364	GF	On-Demand	Mild	HRH2	17	40
C#CCOc1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853666364	GF	On-Demand	Mild	CPT1A	55	37
C#CCOc1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853666364	GF	On-Demand	Mild	CPT2	42	36
CC(C)(C)OC(=O)NCc1cccc(OCCc2nnn(C(C)(C)C)n2)c1	ZINC000853666366	GG	On-Demand	Anodyne	HRH2	26	44
CC(C)(C)OC(=O)NCc1cccc(OCCc2nnn(C(C)(C)C)n2)c1	ZINC000853666366	GG	On-Demand	Anodyne	PDS	62	41
CC(C)(C)OC(=O)NCc1cccc(OCCOC(F)F)c1	ZINC000853666370	DG	On-Demand	Anodyne	HRH2	28	47
CC(C)(C)OC(=O)NCc1cccc(OCCOC(F)F)c1	ZINC000853666370	DG	On-Demand	Anodyne	PDS	104	48
CC1(CONC(=O)CCOc2ccccc2)CCC1	ZINC000853666377	CF	On-Demand	Anodyne	LTA4H	41	41
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCCO[C@H]1CC1(F)F	ZINC000853666383	GE	On-Demand	Anodyne	SIGMAR1	49	38
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCCO[C@@H]1CC1(F)F	ZINC000853666384	GE	On-Demand	Anodyne	SIGMAR1	49	38
C#CCOCCONC(=N)CCN1CCN(Cc2ccccc2)CC1	ZINC000853666410	ED	On-Demand	Mild	SIGMAR1	34	40
COc1cccc(SCCONC(=O)CCOc2ccccc2)c1	ZINC000853666456	EG	On-Demand	Anodyne	MTNR1A	44	53
COc1cccc(SCCONC(=O)CCOc2ccccc2)c1	ZINC000853666456	EG	On-Demand	Anodyne	MTNR1B	47	53
COc1cccc(SCCONC(=O)CCOc2ccccc2)c1	ZINC000853666456	EG	On-Demand	Anodyne	FAS	28	43
COC(=O)C1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666460	FD	On-Demand	Anodyne	HTR1A	24	40
COC(=O)C1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666460	FD	On-Demand	Anodyne	DRD2	29	40
COC(=O)C1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666460	FD	On-Demand	Anodyne	SIGMAR1	78	40
COC(=O)C1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666460	FD	On-Demand	Anodyne	NPFFR2	36	41
COC(=O)C1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666460	FD	On-Demand	Anodyne	NPFFR1	48	41
COC(=O)C1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666460	FD	On-Demand	Anodyne	SLC12A5	48	38
C#CCOCCOc1ccc(NC(=O)OCC)cc1	ZINC000853666465	CE	On-Demand	Mild	FAAH	24	43
C#CCOCCOc1ccc(NC(=O)OCC)cc1	ZINC000853666465	CE	On-Demand	Mild	ACR	26	40
C[C@H]1CCCCN1CC(=N)NOCCOCc1ccccc1	ZINC000853666473	DF	On-Demand	Anodyne	HRH3	16	42
C[C@@H]1CCCCN1CC(=N)NOCCOCc1ccccc1	ZINC000853666474	DF	On-Demand	Anodyne	HRH3	16	42
C[C@H]1CCCCN1CC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666489	FF	On-Demand	Anodyne	HRH3	19	42
C[C@H]1CCCCN1CC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666489	FF	On-Demand	Anodyne	L3MBTL3	49	34
C[C@@H]1CCCCN1CC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666490	FF	On-Demand	Anodyne	HRH3	19	42
C[C@@H]1CCCCN1CC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666490	FF	On-Demand	Anodyne	L3MBTL3	49	34
C[C@H]1CCCCN1CC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666491	FF	On-Demand	Anodyne	HRH3	19	42
C[C@H]1CCCCN1CC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666491	FF	On-Demand	Anodyne	L3MBTL3	49	34
C[C@@H]1CCCCN1CC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666492	FF	On-Demand	Anodyne	HRH3	19	42
C[C@@H]1CCCCN1CC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666492	FF	On-Demand	Anodyne	L3MBTL3	49	34
CC(C)(C)OC(=O)NCc1cccc(OCCC2SCCS2)c1	ZINC000853666528	FI	On-Demand	Anodyne	HRH2	29	48
CC(C)(C)OC(=O)NCc1cccc(OCCC2SCCS2)c1	ZINC000853666528	FI	On-Demand	Anodyne	PDS	71	42
CC(C)(C)OC(=O)NCc1cccc(OCc2cncs2)c1	ZINC000853666529	DH	On-Demand	Anodyne	ROCK1	17	40
CC(C)(C)OC(=O)NCc1cccc(OCc2cncs2)c1	ZINC000853666529	DH	On-Demand	Anodyne	ROCK2	21	41
CC(C)(C)OC(=O)NCc1cccc(OCc2cncs2)c1	ZINC000853666529	DH	On-Demand	Anodyne	CYP3A4	41	42
CC(C)(C)OC(=O)NCc1cccc(OCc2cncs2)c1	ZINC000853666529	DH	On-Demand	Anodyne	PDS	66	36
N=C(CN1CCCCCC1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666534	FF	On-Demand	Anodyne	SLC6A1	76	35
N=C(CN1CCCCCC1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666534	FF	On-Demand	Anodyne	L3MBTL3	70	37
N=C(CN1CCCCCC1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666535	FF	On-Demand	Anodyne	SLC6A1	76	35
N=C(CN1CCCCCC1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666535	FF	On-Demand	Anodyne	L3MBTL3	70	37
CC(C)(C)OC(=O)NCc1cccc(OCc2ncnn2CCF)c1	ZINC000853666544	FF	On-Demand	Anodyne	PDS	63	38
N=C(Cc1ccc(Cl)cc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666546	FH	On-Demand	Anodyne	SIGMAR1	15	51
N=C(Cc1ccc(Cl)cc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666546	FH	On-Demand	Anodyne	SMO	32	40
N=C(Cc1ccc(Cl)cc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666547	FH	On-Demand	Anodyne	SIGMAR1	15	51
N=C(Cc1ccc(Cl)cc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853666547	FH	On-Demand	Anodyne	SMO	32	40
CC(C)(C)OC(=O)NCc1cccc(OCc2csc(Cl)n2)c1	ZINC000853666557	FI	On-Demand	Anodyne	PPARA	15	45
CC(C)(C)OC(=O)NCc1cccc(OCc2csc(Cl)n2)c1	ZINC000853666557	FI	On-Demand	Anodyne	CYSLTR1	38	41
CC(C)(C)OC(=O)NCc1cccc(OCc2csc(Cl)n2)c1	ZINC000853666557	FI	On-Demand	Anodyne	ROCK2	20	40
CC(C)(C)OC(=O)NCc1cccc(OCc2csc(Cl)n2)c1	ZINC000853666557	FI	On-Demand	Anodyne	PDS	80	39
CCCOc1cccc(CONC(=O)C2CCCC2)c1	ZINC000853666572	CG	On-Demand	Anodyne	HRH2	33	44
CCCOc1cccc(CONC(=O)C2CCCC2)c1	ZINC000853666572	CG	On-Demand	Anodyne	FAAH	22	44
C#CCOc1ccccc1O[C@@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853666582	FD	On-Demand	Mild	P2RY12	117	41
C#CCOc1ccccc1O[C@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853666583	FD	On-Demand	Mild	P2RY12	117	41
CCOC(=O)Nc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666584	FH	On-Demand	Anodyne	AVPR1A	19	42
CCOC(=O)Nc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666584	FH	On-Demand	Anodyne	LTA4H	41	37
CCOC(=O)Nc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666584	FH	On-Demand	Anodyne	NPY2R	33	41
CCOC(=O)Nc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666584	FH	On-Demand	Anodyne	CHEK2	17	44
CCOC(=O)Nc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666584	FH	On-Demand	Anodyne	EPHX2	32	40
CCOC(=O)Nc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666584	FH	On-Demand	Anodyne	DGAT1	18	40
CCOC(=O)Nc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666585	FH	On-Demand	Anodyne	AVPR1A	19	42
CCOC(=O)Nc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666585	FH	On-Demand	Anodyne	LTA4H	41	37
CCOC(=O)Nc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666585	FH	On-Demand	Anodyne	NPY2R	33	41
CCOC(=O)Nc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666585	FH	On-Demand	Anodyne	CHEK2	17	44
CCOC(=O)Nc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666585	FH	On-Demand	Anodyne	EPHX2	32	40
CCOC(=O)Nc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853666585	FH	On-Demand	Anodyne	DGAT1	18	40
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCc1cc(C2CC2)no1	ZINC000853666589	GF	On-Demand	Anodyne	DRD2	15	40
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCc1cc(C2CC2)no1	ZINC000853666589	GF	On-Demand	Anodyne	DRD4	31	40
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCc1cc(C2CC2)no1	ZINC000853666589	GF	On-Demand	Anodyne	SIGMAR1	45	37
CCn1ncnc1CONC(=O)CCOc1ccccc1	ZINC000853666591	CD	On-Demand	Anodyne	PLA2G4B	46	31
C=C(Cl)CONC(=O)CCOc1ccccc1	ZINC000853666593	CE	On-Demand	Mild	LTA4H	33	41
C=C(Cl)CONC(=O)CCOc1ccccc1	ZINC000853666593	CE	On-Demand	Mild	PLA2G4B	43	31
CS(=O)(=O)N1CC[C@@H](CONC(=O)CCOc2ccccc2)C1	ZINC000853666602	EC	On-Demand	Anodyne	LTA4H	22	40
CS(=O)(=O)N1CC[C@H](CONC(=O)CCOc2ccccc2)C1	ZINC000853666603	EC	On-Demand	Anodyne	LTA4H	22	40
CCOC(=O)Nc1ccc(OCCc2nnn(C(C)(C)C)n2)cc1	ZINC000853666611	EF	On-Demand	Anodyne	FAAH	23	42
CCOC(=O)Nc1ccc(OC[C@H](CC)CC(F)F)cc1	ZINC000853666617	DI	On-Demand	Anodyne	PDS	43	37
CCOC(=O)Nc1ccc(OC[C@@H](CC)CC(F)F)cc1	ZINC000853666618	DI	On-Demand	Anodyne	PDS	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnnc2CCc2ccccc2)CC1	ZINC000853666630	GD	On-Demand	Anodyne	P2RY12	118	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnnc2CCc2ccccc2)CC1	ZINC000853666630	GD	On-Demand	Anodyne	DAGLA	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnnc2CCc2ccccc2)CC1	ZINC000853666631	GD	On-Demand	Anodyne	P2RY12	118	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnnc2CCc2ccccc2)CC1	ZINC000853666631	GD	On-Demand	Anodyne	DAGLA	19	40
C#CCOCCOc1ccc(NC(=O)C2CCCCC2)cc1	ZINC000853666636	DG	On-Demand	Mild	EPHX2	17	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)CCOc2ccccc2)CC1	ZINC000853666637	GD	On-Demand	Anodyne	P2RY12	208	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)CCOc2ccccc2)CC1	ZINC000853666638	GD	On-Demand	Anodyne	P2RY12	208	46
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCc1csc(Cl)n1	ZINC000853666641	GG	On-Demand	Anodyne	DRD4	26	46
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCc1csc(Cl)n1	ZINC000853666641	GG	On-Demand	Anodyne	SIGMAR1	47	38
CCOC(=O)Nc1ccc(OC[C@@H](COC)OC)cc1	ZINC000853666662	CE	On-Demand	Anodyne	ADRB1	21	43
CCOC(=O)Nc1ccc(OC[C@@H](COC)OC)cc1	ZINC000853666662	CE	On-Demand	Anodyne	CA1	15	40
CCOC(=O)Nc1ccc(OC[C@@H](COC)OC)cc1	ZINC000853666662	CE	On-Demand	Anodyne	FAAH	23	42
CCOC(=O)Nc1ccc(OC[C@@H](COC)OC)cc1	ZINC000853666662	CE	On-Demand	Anodyne	PDS	46	38
CCOC(=O)Nc1ccc(OC[C@H](COC)OC)cc1	ZINC000853666663	CE	On-Demand	Anodyne	ADRB1	21	43
CCOC(=O)Nc1ccc(OC[C@H](COC)OC)cc1	ZINC000853666663	CE	On-Demand	Anodyne	CA1	15	40
CCOC(=O)Nc1ccc(OC[C@H](COC)OC)cc1	ZINC000853666663	CE	On-Demand	Anodyne	FAAH	23	42
CCOC(=O)Nc1ccc(OC[C@H](COC)OC)cc1	ZINC000853666663	CE	On-Demand	Anodyne	PDS	46	38
CC(C)(C)OC(=O)NCc1cccc(OCc2ncnn2-c2ccccc2)c1	ZINC000853666686	GH	On-Demand	Anodyne	HRH2	16	40
CC(C)(C)OC(=O)NCc1cccc(OCc2ncnn2-c2ccccc2)c1	ZINC000853666686	GH	On-Demand	Anodyne	PDS	80	39
Cc1nocc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853666699	DH	On-Demand	Anodyne	PDS	65	37
CC(C)(C)OC(=O)NCc1cccc(OCc2cccnc2N)c1	ZINC000853666752	EG	On-Demand	Anodyne	HRH2	15	40
CC(C)(C)OC(=O)NCc1cccc(OCc2cccnc2N)c1	ZINC000853666752	EG	On-Demand	Anodyne	PDS	67	38
CC(C)(C)OC(=O)NCc1cccc(OCc2cn(C(C)(C)C)nn2)c1	ZINC000853666754	FH	On-Demand	Anodyne	HRH2	17	41
CC(C)(C)OC(=O)NCc1cccc(OCc2cn(C(C)(C)C)nn2)c1	ZINC000853666754	FH	On-Demand	Anodyne	PDS	66	37
CCCOc1cccc(CONC(=O)c2cc(OC)c(OC)cc2OC)c1	ZINC000853666798	GG	On-Demand	Anodyne	MTNR1B	19	42
COC(=O)C1(Cn2ccc3ccn(Cc4ccccc4)c3c2=O)CC1	ZINC000853666807	EF	On-Demand	Anodyne	SLC12A5	59	38
C=C(Cl)COc1ccc(NC(=O)OCC)cc1	ZINC000853666812	CG	On-Demand	Mild	FAAH	22	41
C=C(Cl)COc1ccc(NC(=O)OCC)cc1	ZINC000853666812	CG	On-Demand	Mild	ACR	42	38
O=C(CCOc1ccccc1)NOCCCC1CCC1	ZINC000853666828	CG	On-Demand	Anodyne	GRIN2B	20	43
O=C(CCOc1ccccc1)NOCCCC1CCC1	ZINC000853666828	CG	On-Demand	Anodyne	LTA4H	44	40
O=C(CCOc1ccccc1)NOCCCC1CCC1	ZINC000853666828	CG	On-Demand	Anodyne	AMY2	45	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)C2CCCC2)CC1	ZINC000853666832	EC	On-Demand	Anodyne	P2RY12	44	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)C2CCCC2)CC1	ZINC000853666833	EC	On-Demand	Anodyne	P2RY12	44	41
O=C(CCOc1ccccc1)NOCCOCc1ccccc1	ZINC000853666851	DF	On-Demand	Anodyne	LTA4H	59	45
O=C(CCOc1ccccc1)NOCCOCc1ccccc1	ZINC000853666851	DF	On-Demand	Anodyne	FFAR1	20	41
O=C(CCOc1ccccc1)NOCc1cc(C2CC2)no1	ZINC000853666855	DF	On-Demand	Anodyne	CPT1A	84	36
CCOC(=O)Nc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853666857	DH	On-Demand	Anodyne	S1PR4	26	40
CCOC(=O)Nc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853666857	DH	On-Demand	Anodyne	S1PR3	17	40
CCOC(=O)Nc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853666857	DH	On-Demand	Anodyne	PLA2G4B	40	31
CCOC(=O)Nc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853666857	DH	On-Demand	Anodyne	FAAH	25	47
CCOC(=O)Nc1ccc(OCc2cc(C)nc(C)n2)cc1	ZINC000853666858	DG	On-Demand	Anodyne	ADAM17	41	36
CCOC(=O)Nc1ccc(OCc2cc(C)nc(C)n2)cc1	ZINC000853666858	DG	On-Demand	Anodyne	FAAH	21	40
N#CCC1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666860	FE	On-Demand	Mild	SIGMAR1	49	41
N#CCC1(CONC(=N)CCN2CCN(Cc3ccccc3)CC2)CC1	ZINC000853666860	FE	On-Demand	Mild	NPFFR1	42	39
CC(C)(C)OC(=O)NCc1cccc(OCCO[C@H]2CC2(F)F)c1	ZINC000853666872	EH	On-Demand	Anodyne	HRH2	27	46
CC(C)(C)OC(=O)NCc1cccc(OCCO[C@H]2CC2(F)F)c1	ZINC000853666872	EH	On-Demand	Anodyne	PDS	70	44
CC(C)(C)OC(=O)NCc1cccc(OCCO[C@@H]2CC2(F)F)c1	ZINC000853666873	EH	On-Demand	Anodyne	HRH2	27	46
CC(C)(C)OC(=O)NCc1cccc(OCCO[C@@H]2CC2(F)F)c1	ZINC000853666873	EH	On-Demand	Anodyne	PDS	70	44
CC(C)(C)OC(=O)NCc1cccc(OCCC2(O)CCC2)c1	ZINC000853666874	DG	On-Demand	Anodyne	HRH2	31	50
CC(C)(C)OC(=O)NCc1cccc(OCCC2(O)CCC2)c1	ZINC000853666874	DG	On-Demand	Anodyne	PDS	76	42
CC(C)(C)OC(=O)NCc1cccc(OC[C@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853666876	GE	On-Demand	Anodyne	HRH2	25	43
CC(C)(C)OC(=O)NCc1cccc(OC[C@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853666876	GE	On-Demand	Anodyne	GPR119	26	46
CC(C)(C)OC(=O)NCc1cccc(OC[C@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853666876	GE	On-Demand	Anodyne	PDS	61	35
CC(C)(C)OC(=O)NCc1cccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853666877	GE	On-Demand	Anodyne	HRH2	25	43
CC(C)(C)OC(=O)NCc1cccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853666877	GE	On-Demand	Anodyne	GPR119	26	46
CC(C)(C)OC(=O)NCc1cccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)c1	ZINC000853666877	GE	On-Demand	Anodyne	PDS	61	35
CC(C)(C)OC(=O)NCc1cccc(OC[C@@H]2COCCO2)c1	ZINC000853666911	DF	On-Demand	Anodyne	HRH2	16	41
CC(C)(C)OC(=O)NCc1cccc(OC[C@@H]2COCCO2)c1	ZINC000853666911	DF	On-Demand	Anodyne	PDS	62	36
CC(C)(C)OC(=O)NCc1cccc(OC[C@H]2COCCO2)c1	ZINC000853666912	DF	On-Demand	Anodyne	HRH2	16	41
CC(C)(C)OC(=O)NCc1cccc(OC[C@H]2COCCO2)c1	ZINC000853666912	DF	On-Demand	Anodyne	PDS	62	36
COC[C@@H](COc1cccc(CNC(=O)OC(C)(C)C)c1)OC	ZINC000853666950	EF	On-Demand	Anodyne	HRH2	23	46
COC[C@@H](COc1cccc(CNC(=O)OC(C)(C)C)c1)OC	ZINC000853666950	EF	On-Demand	Anodyne	PDS	116	52
N=C(CCN1CCN(Cc2ccccc2)CC1)NOCCC1(O)CCC1	ZINC000853666990	FD	On-Demand	Anodyne	SIGMAR1	55	40
CC(C)(C)OC(=O)NCc1cccc(OCc2cc(C3CC3)no2)c1	ZINC000853667000	EI	On-Demand	Anodyne	HRH2	21	42
CC(C)(C)OC(=O)NCc1cccc(OCc2cc(C3CC3)no2)c1	ZINC000853667000	EI	On-Demand	Anodyne	PDS	60	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3ccccc3)n2)CC1	ZINC000853667001	FE	On-Demand	Anodyne	P2RY12	229	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3ccccc3)n2)CC1	ZINC000853667002	FE	On-Demand	Anodyne	P2RY12	229	49
C#CCOc1ccccc1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853667011	EG	On-Demand	Mild	L3MBTL3	59	39
C#CCOc1ccccc1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853667012	EG	On-Demand	Mild	L3MBTL3	59	39
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc(CC(=O)NCCO)cc2)C1	ZINC000853667017	GD	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc(CC(=O)NCCO)cc2)C1	ZINC000853667018	GD	On-Demand	Anodyne	GPR119	30	41
CCOC(=O)Nc1ccc(OCCO[C@@H]2CC2(F)F)cc1	ZINC000853667020	DG	On-Demand	Anodyne	FAAH	24	41
CCOC(=O)Nc1ccc(OCCO[C@@H]2CC2(F)F)cc1	ZINC000853667020	DG	On-Demand	Anodyne	EPHX2	19	46
CCOC(=O)Nc1ccc(OCCO[C@H]2CC2(F)F)cc1	ZINC000853667021	DG	On-Demand	Anodyne	FAAH	24	41
CCOC(=O)Nc1ccc(OCCO[C@H]2CC2(F)F)cc1	ZINC000853667021	DG	On-Demand	Anodyne	EPHX2	19	46
CCOC(=O)Nc1ccc(OCCCc2cc(CC)no2)cc1	ZINC000853667035	DH	On-Demand	Anodyne	HRH3	18	43
CCOC(=O)Nc1ccc(OCCCc2cc(CC)no2)cc1	ZINC000853667035	DH	On-Demand	Anodyne	FAAH	23	41
CCOC(=O)Nc1ccc(OCCCc2cc(CC)no2)cc1	ZINC000853667035	DH	On-Demand	Anodyne	TPSAB1	43	37
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667041	DE	On-Demand	Anodyne	SLC6A1	66	35
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667041	DE	On-Demand	Anodyne	CCR5	17	41
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667041	DE	On-Demand	Anodyne	SLC18A3	15	41
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667041	DE	On-Demand	Anodyne	L3MBTL3	81	40
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667042	DE	On-Demand	Anodyne	SLC6A1	66	35
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667042	DE	On-Demand	Anodyne	CCR5	17	41
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667042	DE	On-Demand	Anodyne	SLC18A3	15	41
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCC1	ZINC000853667042	DE	On-Demand	Anodyne	L3MBTL3	81	40
CCOC(=O)Nc1ccc(OCC2CC=CC2)cc1	ZINC000853667043	CH	On-Demand	Anodyne	FAAH	20	40
CCOC(=O)Nc1ccc(OCc2cn(C(C)(C)C)nn2)cc1	ZINC000853667048	DG	On-Demand	Anodyne	ACR	45	36
C#CCOc1cccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)c1	ZINC000853667060	GG	On-Demand	Mild	DRD4	23	53
C#CCOc1cccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)c1	ZINC000853667060	GG	On-Demand	Mild	SIGMAR1	19	49
C#CCOc1cccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)c1	ZINC000853667060	GG	On-Demand	Mild	SSTR5	44	36
C#CCOc1cccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)c1	ZINC000853667060	GG	On-Demand	Mild	CCR3	24	41
C#CCOc1cccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)c1	ZINC000853667060	GG	On-Demand	Mild	MCHR1	29	53
CC(=O)c1ccc(OCCCCC2(C)OCCO2)cc1F	ZINC000853667062	CG	On-Demand	Anodyne	SHC	18	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)c(F)c2)CC1	ZINC000853667066	ED	On-Demand	Mild	P2RY12	65	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)c(F)c2)CC1	ZINC000853667069	ED	On-Demand	Mild	P2RY12	65	38
CO[C@@H](CONC(=O)CCOc1ccccc1)C1CCCC1	ZINC000853667084	DF	On-Demand	Anodyne	AMY2	46	32
O=C(NOCCOCc1ccccc1)C1CCCC1	ZINC000853667088	CE	On-Demand	Anodyne	FKBP1A	37	40
O=C(NOCCOCc1ccccc1)C1CCCC1	ZINC000853667088	CE	On-Demand	Anodyne	PREP	35	42
O=C(NOCCOCc1ccccc1)C1CCCC1	ZINC000853667088	CE	On-Demand	Anodyne	AMY2	46	32
O=C(NOCCOCc1ccccc1)C1CCCC1	ZINC000853667088	CE	On-Demand	Anodyne	NAAA	25	41
O=C(NOCCOCc1ccccc1)C1CCCC1	ZINC000853667088	CE	On-Demand	Anodyne	SLC12A5	54	39
CC(C)n1ncnc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853667127	EG	On-Demand	Anodyne	HRH2	17	41
CC(C)n1ncnc1COc1cccc(CNC(=O)OC(C)(C)C)c1	ZINC000853667127	EG	On-Demand	Anodyne	PDS	80	41
C#CCOc1cccc(O[C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)c1	ZINC000853667160	FD	On-Demand	Mild	P2RY12	68	38
C#CCOc1cccc(O[C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)c1	ZINC000853667161	FD	On-Demand	Mild	P2RY12	68	38
CC(C)(C)OC(=O)NCc1cccc(OCC2(CC#N)CC2)c1	ZINC000853667167	DH	On-Demand	Mild	HRH2	21	44
CC(C)(C)OC(=O)NCc1cccc(OCC2(CC#N)CC2)c1	ZINC000853667167	DH	On-Demand	Mild	PDS	66	39
C#CCOc1ccccc1OCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853667200	GF	On-Demand	Mild	EPHX2	31	40
C#CCOCCONC(=O)CCOc1ccccc1	ZINC000853667203	CD	On-Demand	Mild	LTA4H	35	41
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	CA1	19	46
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	SCN2A	18	47
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	PLA2G4B	47	32
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	FAAH	27	48
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	ACR	35	44
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	CA12	15	49
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	CA9	15	49
CCOC(=O)Nc1ccc(OCCOC(F)F)cc1	ZINC000853667204	CF	On-Demand	Anodyne	P96878_MYCTU	18	49
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCCC2)CC1	ZINC000853667214	FE	On-Demand	Anodyne	DRD4	22	53
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCCC2)CC1	ZINC000853667214	FE	On-Demand	Anodyne	SLC6A1	48	34
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCCC2)CC1	ZINC000853667214	FE	On-Demand	Anodyne	SIGMAR1	23	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCCC2)CC1	ZINC000853667214	FE	On-Demand	Anodyne	CCR2	16	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCCC2)CC1	ZINC000853667214	FE	On-Demand	Anodyne	EPHX2	23	44
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCCC2)CC1	ZINC000853667214	FE	On-Demand	Anodyne	MCHR1	24	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCCC2)CC1	ZINC000853667214	FE	On-Demand	Anodyne	CCR8	33	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CHRM2	27	50
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CHRM1	25	50
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	ACE	46	38
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	DRD2	32	51
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	FKBP1A	48	36
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	DRD4	56	51
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	ACHE	48	47
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	HRH2	20	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	SLC6A1	49	37
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	SSTR2	31	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	OPRM1	22	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	DRD3	21	51
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	OPRD1	15	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	SLC6A3	19	44
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	KCNH2	17	45
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	HTR4	33	41
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CHRM3	37	50
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	LTA4H	26	44
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	TACR1	16	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	SIGMAR1	62	62
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	SSTR5	60	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CACNA1B	20	44
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CCR1	21	40
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CCR3	37	43
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CCR5	40	43
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	C3AR1	40	36
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	GHSR	15	43
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	EPHX2	28	46
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	MCHR1	54	50
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	XIAP	44	36
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CACNA1G	43	44
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	CCR8	23	43
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	BIRC2	54	46
C[C@@H](ONC(=O)C1CCCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667228	FE	On-Demand	Anodyne	SLC12A5	49	34
O=C(CCOc1ccccc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853667230	FF	On-Demand	Anodyne	GRIN2B	39	40
O=C(CCOc1ccccc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853667231	FF	On-Demand	Anodyne	GRIN2B	39	40
N#CCC1(CONC(=N)Cc2cccs2)CC1	ZINC000853667233	BE	On-Demand	Mild	CTSC	35	40
C=C(Cl)CONC(=O)c1cc(OC)c(OC)cc1OC	ZINC000853667234	DE	On-Demand	Mild	HTR4	55	40
O=C(Cc1ccc(OCCOC(F)F)cc1)NCCO	ZINC000853667252	CC	On-Demand	Anodyne	CA9	15	40
O=C(CCOc1ccccc1)NOCCC1CCC1	ZINC000853667253	CF	On-Demand	Anodyne	GRIN2B	26	47
O=C(CCOc1ccccc1)NOCCC1CCC1	ZINC000853667253	CF	On-Demand	Anodyne	LTA4H	50	38
O=C(CCOc1ccccc1)NOCCC1CCC1	ZINC000853667253	CF	On-Demand	Anodyne	AMY2	44	31
C#CCOc1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853667258	GG	On-Demand	Mild	DRD4	24	52
C#CCOc1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853667258	GG	On-Demand	Mild	SIGMAR1	20	50
C#CCOc1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853667258	GG	On-Demand	Mild	SSTR5	44	37
C#CCOc1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853667258	GG	On-Demand	Mild	CCR3	16	40
C#CCOc1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853667258	GG	On-Demand	Mild	MCHR1	22	42
C#CCOc1ccccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853667258	GG	On-Demand	Mild	CCR8	27	43
O=C(NOCc1cncs1)C1CCCC1	ZINC000853667260	BD	On-Demand	Anodyne	CYP3A4	30	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccs2)CC1	ZINC000853667265	FD	On-Demand	Anodyne	P2RY12	52	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccs2)CC1	ZINC000853667265	FD	On-Demand	Anodyne	DPP7	34	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccs2)CC1	ZINC000853667266	FD	On-Demand	Anodyne	P2RY12	52	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccs2)CC1	ZINC000853667266	FD	On-Demand	Anodyne	DPP7	34	43
CCOC(=O)Nc1ccc(OCCC2SCCS2)cc1	ZINC000853667280	DH	On-Demand	Anodyne	FAAH	24	43
CCOC(=O)Nc1ccc(OCCC2SCCS2)cc1	ZINC000853667280	DH	On-Demand	Anodyne	ACR	26	40
CCCn1ncnc1CONC(=O)CCOc1ccccc1	ZINC000853667283	DD	On-Demand	Anodyne	PLA2G4B	63	32
COC(=O)C1(CONC(=N)Cc2cccs2)CC1	ZINC000853667290	CD	On-Demand	Anodyne	CA5B	33	40
COC(=O)C1(CONC(=N)Cc2cccs2)CC1	ZINC000853667290	CD	On-Demand	Anodyne	CA5A	33	40
CCOC(=O)Nc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853667293	GG	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)Nc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853667294	GG	On-Demand	Anodyne	EPHX2	15	40
CCOC(=O)Nc1ccc(OC[C@H](OC)C2CCC2)cc1	ZINC000853667327	CG	On-Demand	Anodyne	FAAH	19	41
CCOC(=O)Nc1ccc(OC[C@H](OC)C2CCC2)cc1	ZINC000853667327	CG	On-Demand	Anodyne	EPHX2	17	40
CCOC(=O)Nc1ccc(OC[C@@H](OC)C2CCC2)cc1	ZINC000853667328	CG	On-Demand	Anodyne	FAAH	19	41
CCOC(=O)Nc1ccc(OC[C@@H](OC)C2CCC2)cc1	ZINC000853667328	CG	On-Demand	Anodyne	EPHX2	17	40
O=C(Nc1ccc(OCCOC(F)F)cc1)C1CCCCC1	ZINC000853667330	DH	On-Demand	Anodyne	ADRB1	17	40
O=C(Nc1ccc(OCCOC(F)F)cc1)C1CCCCC1	ZINC000853667330	DH	On-Demand	Anodyne	EPHX2	24	44
N#Cc1ccc(CCONC(=O)C2CCCC2)cc1	ZINC000853667344	CE	On-Demand	Mild	CTSC	20	40
O=C(CCOc1ccccc1)NOCCOC(F)F	ZINC000853667350	CD	On-Demand	Anodyne	LTA4H	42	40
CC[C@H](O)c1ccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)cc1	ZINC000853667400	GH	On-Demand	Anodyne	DRD4	16	52
CC[C@H](O)c1ccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)cc1	ZINC000853667400	GH	On-Demand	Anodyne	LTA4H	21	42
CC[C@H](O)c1ccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)cc1	ZINC000853667400	GH	On-Demand	Anodyne	SIGMAR1	21	47
CC[C@H](O)c1ccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)cc1	ZINC000853667400	GH	On-Demand	Anodyne	SSTR5	43	36
CC[C@H](O)c1ccc(OCC(=O)NC2CCN(Cc3ccccc3C)CC2)cc1	ZINC000853667400	GH	On-Demand	Anodyne	MCHR1	28	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([C@@H](O)CC)cc2)CC1	ZINC000853667428	FE	On-Demand	Anodyne	P2RY12	65	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([C@H](O)CC)cc2)CC1	ZINC000853667429	FE	On-Demand	Anodyne	P2RY12	65	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([C@H](O)CC)cc2)CC1	ZINC000853667430	FE	On-Demand	Anodyne	P2RY12	65	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([C@@H](O)CC)cc2)CC1	ZINC000853667431	FE	On-Demand	Anodyne	P2RY12	65	39
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCOCC1	ZINC000853667467	EE	On-Demand	Anodyne	L3MBTL3	51	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCOCC1	ZINC000853667468	EE	On-Demand	Anodyne	L3MBTL3	51	34
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	CHRM2	20	42
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	CHRM1	18	42
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	DRD2	28	47
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	DRD4	54	47
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	ACHE	44	46
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	DRD3	16	47
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	KCNH2	17	44
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	HTR4	28	44
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	CHRM3	27	42
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	LTA4H	22	40
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	SIGMAR1	53	53
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	SSTR5	60	37
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	CCR3	29	40
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	MCHR1	53	47
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	CACNA1G	33	41
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	CCR8	16	41
C[C@@H](ONC(=N)C1CCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667559	GE	On-Demand	Anodyne	BIRC2	25	40
CCOC(=O)c1nccc(N2CCN(S(=O)(=O)N=S(C)(C)=O)CC2)n1	ZINC000853667621	GB	On-Demand	Anodyne	SORD	61	42
COc1cccc(SCCONC(=N)C(C)(C)NC(C)=O)c1	ZINC000853667641	EE	On-Demand	Anodyne	MTNR1A	43	57
COc1cccc(SCCONC(=N)C(C)(C)NC(C)=O)c1	ZINC000853667641	EE	On-Demand	Anodyne	MTNR1B	46	57
CC[C@H](O)c1ccc(OCCOC(F)F)cc1	ZINC000853667644	BF	On-Demand	Anodyne	PLA2G4B	52	32
C=C(Cl)COc1cccc(C(=O)NC[C@H](C)O)c1	ZINC000853667715	CD	On-Demand	Mild	DRD4	46	35
C=C(Cl)COc1cccc(C(=O)NC[C@@H](C)O)c1	ZINC000853667717	CD	On-Demand	Mild	DRD4	46	35
Cc1nonc1COc1cccc(C(=O)NCCO)c1	ZINC000853667728	CC	On-Demand	Anodyne	DRD4	47	37
Cc1nonc1COc1cccc(C(=O)NCCO)c1	ZINC000853667728	CC	On-Demand	Anodyne	CACNA1D	16	47
CC[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853667732	EH	On-Demand	Anodyne	GRIN2B	26	40
CC[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853667732	EH	On-Demand	Anodyne	CHEK2	16	44
CC[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853667732	EH	On-Demand	Anodyne	SLC18A3	18	42
CC[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853667736	EH	On-Demand	Anodyne	GRIN2B	26	40
CC[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853667736	EH	On-Demand	Anodyne	CHEK2	16	44
CC[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853667736	EH	On-Demand	Anodyne	SLC18A3	18	42
CON(C)CCNC(=O)NCCc1c[nH]c2cccc(C)c12	ZINC000853667757	DD	On-Demand	Anodyne	NQO2	25	41
CON(C)CCNC(=O)NCCc1c[nH]c2cccc(C)c12	ZINC000853667757	DD	On-Demand	Anodyne	MTNR1A	27	46
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	CHRM2	16	41
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	CHRM1	18	41
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	DRD2	23	51
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	DRD4	54	44
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	ACHE	40	43
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	KCNH2	15	41
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	HTR4	16	43
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	CHRM3	20	41
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	LTA4H	20	40
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	SIGMAR1	41	52
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	SSTR5	71	41
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	CCR3	25	41
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	MCHR1	46	45
C[C@@H](ONC(=N)Cn1cccn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853667765	GD	On-Demand	Anodyne	CCR8	23	42
CCN(C)C(=O)c1cccc(OCCOC(F)F)c1	ZINC000853667773	CE	On-Demand	Anodyne	PLA2G4B	39	42
CCN(C)C(=O)c1cccc(OCCOC(F)F)c1	ZINC000853667773	CE	On-Demand	Anodyne	PDS	75	36
COC(=O)c1nccc(N2CCN(S(=O)(=O)N=S(C)(C)=O)CC2)n1	ZINC000853667800	GB	On-Demand	Anodyne	SORD	67	42
NC(=O)CNC(=O)c1cccc(OCCC2SCCS2)c1	ZINC000853667820	ED	On-Demand	Anodyne	DRD4	42	32
CCCC[C@H](NC(=O)NCCN(C)OC)c1ccc(OC)cc1	ZINC000853667826	DF	On-Demand	Anodyne	UTS2	71	45
CCCC[C@@H](NC(=O)NCCN(C)OC)c1ccc(OC)cc1	ZINC000853667828	DF	On-Demand	Anodyne	UTS2	71	45
O=C(NCCO)c1cccc(OCCOC(F)F)c1	ZINC000853667870	CD	On-Demand	Anodyne	DRD4	48	37
O=C(NCCO)c1cccc(OCCOC(F)F)c1	ZINC000853667870	CD	On-Demand	Anodyne	PDS	50	35
NC(=O)CNC(=O)c1cccc(OCCOC(F)F)c1	ZINC000853667929	CC	On-Demand	Anodyne	DRD4	41	31
Cc1nonc1COc1cccc(NC(=O)C2CC2)c1	ZINC000853667964	CE	On-Demand	Anodyne	CACNA1D	15	49
Cc1nonc1COc1cccc(NC(=O)C2CC2)c1	ZINC000853667964	CE	On-Demand	Anodyne	EPHX2	25	46
Cc1nonc1COc1cccc(NC(=O)C2CC2)c1	ZINC000853667964	CE	On-Demand	Anodyne	TYK2	49	37
Cc1nonc1COc1cccc(NC(=O)C2CC2)c1	ZINC000853667964	CE	On-Demand	Anodyne	LIMK2	29	44
CCCC[C@H](NC(=O)N(C)CCN(C)C(=O)OC)c1ccc(OC)cc1	ZINC000853667966	FG	On-Demand	Anodyne	UTS2	72	46
CCCC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)c1ccc(OC)cc1	ZINC000853667968	FG	On-Demand	Anodyne	UTS2	72	46
O=C(Nc1cccc(OCCC2SCCS2)c1)C1CC1	ZINC000853667989	DH	On-Demand	Anodyne	MTNR1A	15	50
O=C(Nc1cccc(OCCC2SCCS2)c1)C1CC1	ZINC000853667989	DH	On-Demand	Anodyne	EPHX2	26	53
O=C(Nc1cccc(OCCC2SCCS2)c1)C1CC1	ZINC000853667989	DH	On-Demand	Anodyne	TYK2	46	38
CSc1ccc(S(=O)(=O)NCC(=O)O[C@H](C)C(=O)N2CCN(C(C)=O)CC2)cc1[N+](=O)[O-]	ZINC000853668001	JC	On-Demand	Bother	COLA	77	33
CSc1ccc(S(=O)(=O)NCC(=O)O[C@@H](C)C(=O)N2CCN(C(C)=O)CC2)cc1[N+](=O)[O-]	ZINC000853668004	JC	On-Demand	Bother	COLA	77	33
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	ALOX5	28	45
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	MAOA	26	54
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	DRD4	42	32
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	MAOB	60	41
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	LTB4R	22	44
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	MTNR1A	57	38
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	MTNR1B	52	39
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	GYS1	25	45
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	FAAH	17	40
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	ACR	27	46
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	HSD17B2	27	44
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	CYP26A1	30	40
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	TAAR1	16	43
CCN(C)C(=O)c1cccc(OCc2ccc(OC)cc2)c1	ZINC000853668007	CG	On-Demand	Anodyne	FFAR1	57	44
CNC(=O)COc1ccc(OCCOC(F)F)cc1	ZINC000853668037	CD	On-Demand	Anodyne	PLA2G4B	86	38
CCCOc1cccc(CONC(=N)C(C)(C)NC(C)=O)c1	ZINC000853668051	DE	On-Demand	Anodyne	PDS	44	34
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C1CCN(c2cc(C#N)cnn2)CC1	ZINC000853668071	FG	On-Demand	Mild	GPR119	18	44
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C1CCN(c2cc(C#N)cnn2)CC1	ZINC000853668072	FG	On-Demand	Mild	GPR119	18	44
CC[C@H](O)c1ccc(OC[C@H]2CCCCN2C(C)C)cc1	ZINC000853668111	CH	On-Demand	Anodyne	CHRNA10	64	40
CC[C@H](O)c1ccc(OC[C@@H]2CCCCN2C(C)C)cc1	ZINC000853668114	CH	On-Demand	Anodyne	CHRNA10	64	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2NC(=O)C2CC2)CC1	ZINC000853668152	GE	On-Demand	Anodyne	P2RY12	150	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2NC(=O)C2CC2)CC1	ZINC000853668152	GE	On-Demand	Anodyne	CCR8	26	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C2CCOCC2)CC1	ZINC000853668154	GE	On-Demand	Anodyne	DRD4	18	50
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C2CCOCC2)CC1	ZINC000853668154	GE	On-Demand	Anodyne	SIGMAR1	19	44
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C2CCOCC2)CC1	ZINC000853668154	GE	On-Demand	Anodyne	MCHR1	27	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2NC(=O)C2CC2)CC1	ZINC000853668155	GE	On-Demand	Anodyne	P2RY12	150	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2NC(=O)C2CC2)CC1	ZINC000853668155	GE	On-Demand	Anodyne	CCR8	26	40
C#CCOCCOc1cccc(C(=O)NC[C@@H](C)O)c1	ZINC000853668219	CC	On-Demand	Mild	DRD4	43	33
C#CCOCCOc1cccc(C(=O)NC[C@H](C)O)c1	ZINC000853668220	CC	On-Demand	Mild	DRD4	43	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668227	GE	On-Demand	Anodyne	P2RY12	183	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668227	GE	On-Demand	Anodyne	MTNR1B	15	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668227	GE	On-Demand	Anodyne	EPHX2	36	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668227	GE	On-Demand	Anodyne	ST14	51	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668227	GE	On-Demand	Anodyne	LIMK2	22	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668229	GE	On-Demand	Anodyne	P2RY12	183	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668229	GE	On-Demand	Anodyne	MTNR1B	15	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668229	GE	On-Demand	Anodyne	EPHX2	36	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668229	GE	On-Demand	Anodyne	ST14	51	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C3CC3)c2)CC1	ZINC000853668229	GE	On-Demand	Anodyne	LIMK2	22	47
C#CCCCOc1cccnc1N[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853668233	FG	On-Demand	Mild	PPIA	38	40
CSc1ccc(S(=O)(=O)NCC(=O)O[C@@H](C)C(=O)N(C)Cc2ccccc2C)cc1[N+](=O)[O-]	ZINC000853668243	JE	On-Demand	Bother	COLA	124	41
CSc1ccc(S(=O)(=O)NCC(=O)O[C@H](C)C(=O)N(C)Cc2ccccc2C)cc1[N+](=O)[O-]	ZINC000853668244	JE	On-Demand	Bother	COLA	124	41
CNC(=O)COc1ccc(OCc2oc(C)nc2C)cc1	ZINC000853668265	CD	On-Demand	Anodyne	MAOA	39	40
O=C(Nc1cccc(OCCOC(F)F)c1)C1CC1	ZINC000853668266	CF	On-Demand	Anodyne	EPHX2	26	53
O=C(Nc1cccc(OCCOC(F)F)c1)C1CC1	ZINC000853668266	CF	On-Demand	Anodyne	TYK2	48	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3ccn(C)c3c2=O)CC1	ZINC000853668321	FD	On-Demand	Anodyne	P2RY12	43	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3ccn(C)c3c2=O)CC1	ZINC000853668322	FD	On-Demand	Anodyne	P2RY12	43	38
CCN(C)C(=O)c1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853668341	DG	On-Demand	Anodyne	MTNR1A	18	40
CCN(C)C(=O)c1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853668341	DG	On-Demand	Anodyne	PLA2G4B	26	40
C=C(Cl)COc1cccc(C(=O)N(C)CC)c1	ZINC000853668350	CF	On-Demand	Mild	DRD4	40	30
C=C(Cl)COc1cccc(C(=O)N(C)CC)c1	ZINC000853668350	CF	On-Demand	Mild	PLA2G4B	26	41
Cc1nonc1COc1cccc(C(=O)NC[C@@H](C)O)c1	ZINC000853668365	CD	On-Demand	Anodyne	DRD4	41	32
Cc1nonc1COc1cccc(C(=O)NC[C@H](C)O)c1	ZINC000853668366	CD	On-Demand	Anodyne	DRD4	41	32
C=C(Cl)COc1cccc(C(=O)NCCO)c1	ZINC000853668367	CD	On-Demand	Mild	DRD4	52	39
O=C(Nc1cccc(OCc2csc(Cl)n2)c1)C1CC1	ZINC000853668368	DH	On-Demand	Anodyne	CYSLTR1	21	42
O=C(Nc1cccc(OCc2csc(Cl)n2)c1)C1CC1	ZINC000853668368	DH	On-Demand	Anodyne	EPHX2	22	45
O=C(Nc1cccc(OCc2csc(Cl)n2)c1)C1CC1	ZINC000853668368	DH	On-Demand	Anodyne	TYK2	56	41
O=C(Nc1cccc(OCc2csc(Cl)n2)c1)C1CC1	ZINC000853668368	DH	On-Demand	Anodyne	LIMK2	15	41
CNC(=O)COc1ccc(OCCO[Si](C)(C)C(C)(C)C)cc1	ZINC000853668371	EG	On-Demand	Reactive	PLA2G4B	76	35
O=C(NCCO)c1cccc(OCCC2SCCS2)c1	ZINC000853668378	DD	On-Demand	Anodyne	DRD4	49	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)N(C)CC)c2)CC1	ZINC000853668379	GD	On-Demand	Anodyne	P2RY12	85	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)N(C)CC)c2)CC1	ZINC000853668380	GD	On-Demand	Anodyne	P2RY12	85	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cn2cccn2)CC1	ZINC000853668387	GD	On-Demand	Anodyne	DRD4	18	48
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cn2cccn2)CC1	ZINC000853668387	GD	On-Demand	Anodyne	SIGMAR1	19	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cn2cccn2)CC1	ZINC000853668387	GD	On-Demand	Anodyne	SSTR5	53	39
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cn2cccn2)CC1	ZINC000853668387	GD	On-Demand	Anodyne	MCHR1	28	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cn2cccn2)CC1	ZINC000853668387	GD	On-Demand	Anodyne	CCR8	29	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(NC(=O)C3CC3)c2)C1	ZINC000853668390	GG	On-Demand	Anodyne	EPHX2	32	46
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(NC(=O)C3CC3)c2)C1	ZINC000853668390	GG	On-Demand	Anodyne	LIMK2	20	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(NC(=O)C3CC3)c2)C1	ZINC000853668391	GG	On-Demand	Anodyne	EPHX2	32	46
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(NC(=O)C3CC3)c2)C1	ZINC000853668391	GG	On-Demand	Anodyne	LIMK2	20	41
COC(=O)Cc1ccnc(NCCC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000853668396	GG	On-Demand	Anodyne	GPR119	18	40
COC(=O)Cc1ccnc(NCCC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000853668397	GG	On-Demand	Anodyne	GPR119	18	40
CN(C)CCCOc1ccc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853668433	GF	On-Demand	Anodyne	LTA4H	30	42
CN(C)CCCOc1ccc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853668434	GF	On-Demand	Anodyne	LTA4H	30	42
CN(C)CCCOc1ccc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853668435	GF	On-Demand	Anodyne	LTA4H	30	42
CN(C)CCCOc1ccc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853668436	GF	On-Demand	Anodyne	LTA4H	30	42
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNc1cc(F)ncn1	ZINC000853668437	DG	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNc1cc(F)ncn1	ZINC000853668438	DG	On-Demand	Anodyne	GPR119	28	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3c(C)cccc3c2=O)CC1	ZINC000853668445	FD	On-Demand	Anodyne	P2RY12	63	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3c(C)cccc3c2=O)CC1	ZINC000853668446	FD	On-Demand	Anodyne	P2RY12	63	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cn2cccn2)CC1	ZINC000853668464	FC	On-Demand	Anodyne	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cn2cccn2)CC1	ZINC000853668465	FC	On-Demand	Anodyne	P2RY12	42	36
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000853668486	GG	On-Demand	Bother	GPR119	18	42
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNc1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000853668487	GG	On-Demand	Bother	GPR119	18	42
CNC(=O)COc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853668493	DE	On-Demand	Anodyne	PLA2G4B	81	36
C#CCOCCOc1cccc(C(=O)N(C)CC)c1	ZINC000853668500	CD	On-Demand	Mild	PLA2G4B	26	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(C(=O)NCCO)c2)C1	ZINC000853668505	GD	On-Demand	Anodyne	DRD4	47	36
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(C(=O)NCCO)c2)C1	ZINC000853668506	GD	On-Demand	Anodyne	DRD4	47	36
C#CCOCCOc1cccc(C(=O)NCC(N)=O)c1	ZINC000853668510	CB	On-Demand	Mild	DRD4	41	32
C#CCOCCOc1ccc(OCC(=O)NC)cc1	ZINC000853668522	CC	On-Demand	Mild	PLA2G4B	80	36
Cc1ccc(N2CCC([C@@H]3N(C(=O)OC(C)(C)C)CC3(C)C)CC2)nn1	ZINC000853668536	FH	On-Demand	Anodyne	GPR119	17	46
Cc1ccc(N2CCC([C@H]3N(C(=O)OC(C)(C)C)CC3(C)C)CC2)nn1	ZINC000853668537	FH	On-Demand	Anodyne	GPR119	17	46
C#CCOCCOc1cccc(C(=O)NCCO)c1	ZINC000853668584	CC	On-Demand	Mild	DRD4	47	36
COCCN(CCF)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668616	FG	On-Demand	Anodyne	PDE4A	48	47
COCCN(CCF)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668616	FG	On-Demand	Anodyne	PDE4B	27	47
COCCN(CCF)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668616	FG	On-Demand	Anodyne	PDE4D	33	47
COCCN(CCF)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668616	FG	On-Demand	Anodyne	PDE4C	17	47
COCCN(CCF)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668616	FG	On-Demand	Anodyne	ACKR3	61	32
C=C(Cl)COc1cccc(NC(=O)C2CC2)c1	ZINC000853668621	CG	On-Demand	Mild	EPHX2	29	49
C=C(Cl)COc1cccc(NC(=O)C2CC2)c1	ZINC000853668621	CG	On-Demand	Mild	TYK2	59	42
C=C(Cl)COc1cccc(NC(=O)C2CC2)c1	ZINC000853668621	CG	On-Demand	Mild	KCNK3	35	42
C#CCOCCOc1cccc(NC(=O)C2CC2)c1	ZINC000853668634	CE	On-Demand	Mild	MTNR1A	15	49
C#CCOCCOc1cccc(NC(=O)C2CC2)c1	ZINC000853668634	CE	On-Demand	Mild	EPHX2	24	52
C#CCOCCOc1cccc(NC(=O)C2CC2)c1	ZINC000853668634	CE	On-Demand	Mild	TYK2	46	37
C#CCOCCOc1cccc(NC(=O)C2CC2)c1	ZINC000853668634	CE	On-Demand	Mild	KCNK3	18	40
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C1CCN(c2cc(CO)c(F)cn2)CC1	ZINC000853668642	GH	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C1CCN(c2cc(CO)c(F)cn2)CC1	ZINC000853668643	GH	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CC(C)(C)[C@@H]1C1CCN(c2cnc(F)cn2)CC1	ZINC000853668647	FG	On-Demand	Anodyne	GPR119	19	48
CC(C)(C)OC(=O)N1CC(C)(C)[C@H]1C1CCN(c2cnc(F)cn2)CC1	ZINC000853668648	FG	On-Demand	Anodyne	GPR119	19	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OCC(=O)NC)cc2)CC1	ZINC000853668650	GC	On-Demand	Anodyne	P2RY12	100	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OCC(=O)NC)cc2)CC1	ZINC000853668651	GC	On-Demand	Anodyne	P2RY12	100	41
CC(=O)c1ccnc(NCCC[C@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000853668652	EH	On-Demand	Anodyne	GPR119	22	40
CC(=O)c1ccnc(NCCC[C@@H]2CCCN2C(=O)OC(C)(C)C)c1	ZINC000853668653	EH	On-Demand	Anodyne	GPR119	22	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(=O)c3ccccc32)CC1	ZINC000853668664	FD	On-Demand	Anodyne	P2RY12	61	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(=O)c3ccccc32)CC1	ZINC000853668665	FD	On-Demand	Anodyne	P2RY12	61	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668675	GC	On-Demand	Anodyne	DRD4	53	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668675	GC	On-Demand	Anodyne	P2RY12	140	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668675	GC	On-Demand	Anodyne	TRY2_BOVIN	50	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668675	GC	On-Demand	Anodyne	ST14	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668676	GC	On-Demand	Anodyne	DRD4	53	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668676	GC	On-Demand	Anodyne	P2RY12	140	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668676	GC	On-Demand	Anodyne	TRY2_BOVIN	50	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(=O)NCCO)c2)CC1	ZINC000853668676	GC	On-Demand	Anodyne	ST14	18	40
CC(=O)c1ccnc(N2CCC([C@@H]3N(C(=O)OC(C)(C)C)CC3(C)C)CC2)c1	ZINC000853668681	GI	On-Demand	Anodyne	GPR119	18	48
CC(=O)c1ccnc(N2CCC([C@H]3N(C(=O)OC(C)(C)C)CC3(C)C)CC2)c1	ZINC000853668682	GI	On-Demand	Anodyne	GPR119	18	48
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(C(=O)NCC(N)=O)c2)C1	ZINC000853668689	GC	On-Demand	Anodyne	DRD4	42	33
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(C(=O)NCC(N)=O)c2)C1	ZINC000853668690	GC	On-Demand	Anodyne	DRD4	42	33
CCCC[C@H](NC(=O)N1CC[C@@H]2COC[C@@H]2C1)c1ccc(OC)cc1	ZINC000853668705	EH	On-Demand	Anodyne	EDNRB	15	40
CCCC[C@H](NC(=O)N1CC[C@@H]2COC[C@H]2C1)c1ccc(OC)cc1	ZINC000853668706	EH	On-Demand	Anodyne	EDNRB	15	40
CCCC[C@H](NC(=O)N1CC[C@H]2COC[C@@H]2C1)c1ccc(OC)cc1	ZINC000853668707	EH	On-Demand	Anodyne	EDNRB	15	40
CCCC[C@H](NC(=O)N1CC[C@H]2COC[C@H]2C1)c1ccc(OC)cc1	ZINC000853668708	EH	On-Demand	Anodyne	EDNRB	15	40
Cc1nonc1COc1ccccc1NC(=O)C1CC1	ZINC000853668720	CE	On-Demand	Anodyne	CACNA1D	15	48
CNC(=O)COc1ccc(OCCC2SCCS2)cc1	ZINC000853668724	DE	On-Demand	Anodyne	PLA2G4B	65	33
C=C(Cl)COc1ccc(OCC(=O)NC)cc1	ZINC000853668732	CD	On-Demand	Mild	PLA2G4B	44	32
CCN(C)C(=O)c1cccc(OCCO[Si](C)(C)C(C)(C)C)c1	ZINC000853668739	EI	On-Demand	Reactive	PLA2G4B	22	40
N=C(Cn1cccn1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853668756	ED	On-Demand	Anodyne	GRIN2B	25	40
N=C(Cn1cccn1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853668757	ED	On-Demand	Anodyne	GRIN2B	25	40
C#CCCN(CCOC)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668772	FG	On-Demand	Mild	PDE4A	44	45
C#CCCN(CCOC)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668772	FG	On-Demand	Mild	PDE4B	25	45
C#CCCN(CCOC)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668772	FG	On-Demand	Mild	PDE4D	29	45
C#CCCN(CCOC)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC000853668772	FG	On-Demand	Mild	PDE4C	17	45
CCCC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(=O)C2)c1ccc(OC)cc1	ZINC000853668773	EH	On-Demand	Anodyne	EDNRB	20	41
CCCC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(=O)C2)c1ccc(OC)cc1	ZINC000853668774	EH	On-Demand	Anodyne	EDNRB	20	41
CON(C)CCNC(=O)N[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000853668792	GG	On-Demand	Anodyne	PTGER3	44	39
CON(C)CCNC(=O)N[C@@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000853668792	GG	On-Demand	Anodyne	ACE2	21	45
CON(C)CCNC(=O)N[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000853668793	GG	On-Demand	Anodyne	PTGER3	44	39
CON(C)CCNC(=O)N[C@H](C)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000853668793	GG	On-Demand	Anodyne	ACE2	21	45
CSc1ccc(NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1	ZINC000853668800	JF	On-Demand	Bother	COLA	87	39
CSc1ccc(NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1	ZINC000853668801	JF	On-Demand	Bother	COLA	87	39
Oc1cc(N2CCCCCCCC2)c2ncccc2n1	ZINC000853668812	CG	On-Demand	Anodyne	METAP1	40	39
CCC(CC)CONC(=O)Cc1ccc(OC)c(OC)c1	ZINC000853668813	CF	On-Demand	Anodyne	TRPV1	21	42
CCC(CC)CONC(=O)Cc1ccc(OC)c(OC)c1	ZINC000853668813	CF	On-Demand	Anodyne	PTGDR2	20	42
CCC(CC)CONC(=O)Cc1ccc(OC)c(OC)c1	ZINC000853668813	CF	On-Demand	Anodyne	ENPP1	50	30
CSc1ccc(S(=O)(=O)NCC(=O)O[C@@H](C)C(=O)Nc2nc(C)c(C)s2)cc1[N+](=O)[O-]	ZINC000853668818	JE	On-Demand	Bother	COLA	61	31
CSc1ccc(S(=O)(=O)NCC(=O)O[C@H](C)C(=O)Nc2nc(C)c(C)s2)cc1[N+](=O)[O-]	ZINC000853668819	JE	On-Demand	Bother	COLA	61	31
CCCOc1cccc(CONC(=O)Cc2ccc(OC)c(OC)c2)c1	ZINC000853668832	FG	On-Demand	Anodyne	MTNR1A	34	43
CCCOc1cccc(CONC(=O)Cc2ccc(OC)c(OC)c2)c1	ZINC000853668832	FG	On-Demand	Anodyne	MTNR1B	37	46
CCCOc1cccc(CONC(=O)Cc2ccc(OC)c(OC)c2)c1	ZINC000853668832	FG	On-Demand	Anodyne	PLA2G4B	34	42
CCCOc1cccc(CONC(=O)Cc2ccc(OC)c(OC)c2)c1	ZINC000853668832	FG	On-Demand	Anodyne	HCRTR2	20	44
COc1ccc(CC(=O)NOCc2cncs2)cc1OC	ZINC000853668836	DD	On-Demand	Anodyne	ENPP1	45	33
COc1ccc(CC(=O)NOCc2ncnn2CCF)cc1OC	ZINC000853668844	ED	On-Demand	Anodyne	ENPP1	45	32
COc1ccc(CC(=O)NOCc2ncnn2CCF)cc1OC	ZINC000853668844	ED	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1ccc(CC(=O)NOCc2oc(C)nc2C)cc1OC	ZINC000853668852	DE	On-Demand	Anodyne	ENPP1	68	31
COc1ccc(CC(=O)NOCc2oc(C)nc2C)cc1OC	ZINC000853668852	DE	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(CC(=O)NOCCSc2cccc(Cl)c2)cc1OC	ZINC000853668866	GH	On-Demand	Anodyne	ENPP1	61	34
O=[N+]([O-])c1ccc(N2CCC23COC3)cc1	ZINC000853668882	BD	On-Demand	Bother	KCNJ1	28	47
COc1ccc(CC(=O)NOCc2cn(C(C)(C)C)nn2)cc1OC	ZINC000853668891	ED	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(CC(=O)NOCc2cn(C(C)(C)C)nn2)cc1OC	ZINC000853668891	ED	On-Demand	Anodyne	DRTS_TRYCR	45	32
COc1ccc(CC(=O)NOCc2cc(C)nc(C)n2)cc1OC	ZINC000853668900	ED	On-Demand	Anodyne	ENPP1	66	31
COc1ccc(CC(=O)NOCc2cc(C)nc(C)n2)cc1OC	ZINC000853668900	ED	On-Demand	Anodyne	DRTS_TRYCR	46	32
C=C(Cl)COc1cccc(NC(=O)C(C)C)c1	ZINC000853668901	CG	On-Demand	Mild	MTNR1B	23	52
C=C(Cl)COc1cccc(NC(=O)C(C)C)c1	ZINC000853668901	CG	On-Demand	Mild	TAAR1	35	40
C=C(Cl)COc1cccc(NC(=O)C(C)C)c1	ZINC000853668901	CG	On-Demand	Mild	KCNK3	72	37
C=C(Cl)COc1cccc(NC(=O)C(C)C)c1	ZINC000853668901	CG	On-Demand	Mild	KCNK9	68	35
C=C(Cl)COc1cccc(NC(=O)C(C)C)c1	ZINC000853668901	CG	On-Demand	Mild	PDS	42	34
COc1ccc(CC(=O)NOC[C@H](OC)[C@H]2CCOC2)cc1OC	ZINC000853668950	ED	On-Demand	Anodyne	PDE4D	15	40
COc1ccc(CC(=O)NOC[C@H](OC)[C@@H]2CCOC2)cc1OC	ZINC000853668951	ED	On-Demand	Anodyne	PDE4D	15	40
COc1ccc(CC(=O)NOC[C@@H](OC)[C@@H]2CCOC2)cc1OC	ZINC000853668952	ED	On-Demand	Anodyne	PDE4D	15	40
COc1ccc(CC(=O)NOC[C@@H](OC)[C@H]2CCOC2)cc1OC	ZINC000853668953	ED	On-Demand	Anodyne	PDE4D	15	40
COc1ccc(CC(=O)NOC[C@@H](OC)C2CCCCC2)cc1OC	ZINC000853668967	FF	On-Demand	Anodyne	FKBP1A	24	41
COc1ccc(CC(=O)NOC[C@H](OC)C2CCCCC2)cc1OC	ZINC000853668968	FF	On-Demand	Anodyne	FKBP1A	24	41
CCOC(=O)c1nccc(N2CCCCCCCC2)n1	ZINC000853668982	CF	On-Demand	Anodyne	SORD	90	41
CCOC(=O)c1nccc(N2CCCCCCCC2)n1	ZINC000853668982	CF	On-Demand	Anodyne	DGAT1	24	44
CO[C@@H](CONC(=O)Cc1cccc2ccccc12)C1CCC1	ZINC000853668990	DG	On-Demand	Anodyne	NQO2	17	41
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccco1	ZINC000853669003	EI	On-Demand	Anodyne	KCNK3	37	49
Cc1ccccc1CN1CCC(NC(=O)CON=C2CCC2)CC1	ZINC000853669056	EF	On-Demand	Mild	DRD4	23	54
Cc1ccccc1CN1CCC(NC(=O)CON=C2CCC2)CC1	ZINC000853669056	EF	On-Demand	Mild	SIGMAR1	21	50
Cc1ccccc1CN1CCC(NC(=O)CON=C2CCC2)CC1	ZINC000853669056	EF	On-Demand	Mild	CCR3	16	40
Cc1ccccc1CN1CCC(NC(=O)CON=C2CCC2)CC1	ZINC000853669056	EF	On-Demand	Mild	MCHR1	31	42
Cc1ccccc1CN1CCC(NC(=O)CON=C2CCC2)CC1	ZINC000853669056	EF	On-Demand	Mild	CCR8	21	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)ccc2F)CC1	ZINC000853669067	FF	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)ccc2F)CC1	ZINC000853669067	FF	On-Demand	Anodyne	MC4R	65	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)ccc2F)CC1	ZINC000853669068	FF	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)ccc2F)CC1	ZINC000853669068	FF	On-Demand	Anodyne	MC4R	65	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)COC)cc2)CC1	ZINC000853669083	GD	On-Demand	Anodyne	P2RY12	87	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)COC)cc2)CC1	ZINC000853669083	GD	On-Demand	Anodyne	TGM2	21	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)COC)cc2)CC1	ZINC000853669083	GD	On-Demand	Anodyne	F13A1	30	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)COC)cc2)CC1	ZINC000853669085	GD	On-Demand	Anodyne	P2RY12	87	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)COC)cc2)CC1	ZINC000853669085	GD	On-Demand	Anodyne	TGM2	21	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)COC)cc2)CC1	ZINC000853669085	GD	On-Demand	Anodyne	F13A1	30	42
C#CCOCCOc1ccc(NC(=O)COC)cc1	ZINC000853669093	CD	On-Demand	Mild	PLA2G4B	43	31
COc1ccc(CC(=O)NOCCc2cncn2C)cc1OC	ZINC000853669112	DD	On-Demand	Anodyne	ENPP1	50	33
C#CCOCCOc1cccc(NC(=O)C(C)C)c1	ZINC000853669142	CE	On-Demand	Mild	MTNR1B	22	48
C#CCOCCOc1cccc(NC(=O)C(C)C)c1	ZINC000853669142	CE	On-Demand	Mild	EPHX2	17	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669150	GE	On-Demand	Anodyne	P2RY12	106	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669150	GE	On-Demand	Anodyne	TRY2_BOVIN	37	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669150	GE	On-Demand	Anodyne	MTNR1B	17	45
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669150	GE	On-Demand	Anodyne	ST14	40	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669151	GE	On-Demand	Anodyne	P2RY12	106	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669151	GE	On-Demand	Anodyne	TRY2_BOVIN	37	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669151	GE	On-Demand	Anodyne	MTNR1B	17	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000853669151	GE	On-Demand	Anodyne	ST14	40	44
COc1ccc(CC(=O)NOCCOCc2ccccc2)cc1OC	ZINC000853669152	EF	On-Demand	Anodyne	DRTS_PLAFK	31	42
COc1ccc(CC(=O)NOCCOCc2ccccc2)cc1OC	ZINC000853669152	EF	On-Demand	Anodyne	HCRTR1	19	41
COc1ccc(CC(=O)NOCCOCc2ccccc2)cc1OC	ZINC000853669152	EF	On-Demand	Anodyne	PRKCZ	20	41
COc1ccc(CC(=O)NOCCOCc2ccccc2)cc1OC	ZINC000853669152	EF	On-Demand	Anodyne	MTNR1B	16	47
COc1ccc(CC(=O)NOCCOCc2ccccc2)cc1OC	ZINC000853669152	EF	On-Demand	Anodyne	PTGDR2	21	40
COc1ccc(CC(=O)NOCCOCc2ccccc2)cc1OC	ZINC000853669152	EF	On-Demand	Anodyne	DRTS_TRYCR	44	31
CCC(=O)c1ccc(N2CC(c3cccc(Cl)c3)C2)c(S(=O)(=O)NC)c1	ZINC000853669154	GG	On-Demand	Anodyne	MDM2	95	34
COC(=O)c1sc(C)cc1OCc1nonc1C	ZINC000853669157	CE	On-Demand	Anodyne	CACNA1D	20	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669167	FD	On-Demand	Anodyne	P2RY12	89	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669167	FD	On-Demand	Anodyne	TRY2_BOVIN	75	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669167	FD	On-Demand	Anodyne	DPP7	15	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669167	FD	On-Demand	Anodyne	ST14	23	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669168	FD	On-Demand	Anodyne	P2RY12	89	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669168	FD	On-Demand	Anodyne	TRY2_BOVIN	75	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669168	FD	On-Demand	Anodyne	DPP7	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(COC)c2)CC1	ZINC000853669168	FD	On-Demand	Anodyne	ST14	23	41
COC(=O)c1nccc(N2CCCCCCCC2)n1	ZINC000853669183	CE	On-Demand	Anodyne	SORD	85	44
COc1cccc(SCCONC(=O)Cc2ccc(OC)c(OC)c2)c1	ZINC000853669191	GG	On-Demand	Anodyne	MTNR1A	46	52
COc1cccc(SCCONC(=O)Cc2ccc(OC)c(OC)c2)c1	ZINC000853669191	GG	On-Demand	Anodyne	MTNR1B	50	52
COc1cccc(SCCONC(=O)Cc2ccc(OC)c(OC)c2)c1	ZINC000853669191	GG	On-Demand	Anodyne	ENPP1	66	32
CN(CCO)C(=O)c1ccc(OCCO[Si](C)(C)C(C)(C)C)cc1	ZINC000853669203	FG	On-Demand	Reactive	LSS	17	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccccc2-n2ccnc2)C1	ZINC000853669214	FF	On-Demand	Anodyne	NOS2	93	36
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccccc2-n2ccnc2)C1	ZINC000853669215	FF	On-Demand	Anodyne	NOS2	93	36
C#CCOCCOc1ccc(C(=O)N2CCN(S(C)(=O)=O)CC2)cc1	ZINC000853669223	FC	On-Demand	Mild	HRH3	16	43
C=C(Cl)COc1ccc(C(=O)NCCO)cc1	ZINC000853669260	CD	On-Demand	Mild	AOC3	15	41
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	DRD2	19	44
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	DRD4	29	44
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	ACHE	31	43
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	HTR1D	16	40
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	OPRM1	21	48
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	OPRD1	17	42
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	HTR4	52	48
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	LTA4H	17	45
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	SIGMAR1	44	42
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	CCR3	52	45
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	CCR5	30	40
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	CACNA1I	58	38
CON(C)CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853669276	ED	On-Demand	Anodyne	BIRC2	49	43
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	DRD2	19	44
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	DRD4	29	44
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	ACHE	31	43
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	HTR1D	16	40
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	OPRM1	21	48
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	OPRD1	17	42
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	HTR4	52	48
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	LTA4H	17	45
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	SIGMAR1	44	42
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	CCR3	52	45
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	CCR5	30	40
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	CACNA1I	58	38
CON(C)CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853669277	ED	On-Demand	Anodyne	BIRC2	49	43
COc1ccc(CC(=O)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669295	GE	On-Demand	Anodyne	FKBP1A	32	40
COc1ccc(CC(=O)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669295	GE	On-Demand	Anodyne	ACHE	19	43
COc1ccc(CC(=O)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669295	GE	On-Demand	Anodyne	GRIN2B	44	36
COc1ccc(CC(=O)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669295	GE	On-Demand	Anodyne	SIGMAR1	16	51
COc1ccc(CC(=O)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669295	GE	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(CC(=O)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669295	GE	On-Demand	Anodyne	SMO	39	41
COc1ccc(CC(=O)NOC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669295	GE	On-Demand	Anodyne	ACKR3	40	33
COc1ccc(CC(=O)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669296	GE	On-Demand	Anodyne	FKBP1A	32	40
COc1ccc(CC(=O)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669296	GE	On-Demand	Anodyne	ACHE	19	43
COc1ccc(CC(=O)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669296	GE	On-Demand	Anodyne	GRIN2B	44	36
COc1ccc(CC(=O)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669296	GE	On-Demand	Anodyne	SIGMAR1	16	51
COc1ccc(CC(=O)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669296	GE	On-Demand	Anodyne	MTNR1B	15	40
COc1ccc(CC(=O)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669296	GE	On-Demand	Anodyne	SMO	39	41
COc1ccc(CC(=O)NOC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1OC	ZINC000853669296	GE	On-Demand	Anodyne	ACKR3	40	33
COc1ccc(CC(=O)NOC[C@@H]2CCN(S(C)(=O)=O)C2)cc1OC	ZINC000853669297	FC	On-Demand	Anodyne	FKBP1A	24	40
COc1ccc(CC(=O)NOC[C@H]2CCN(S(C)(=O)=O)C2)cc1OC	ZINC000853669298	FC	On-Demand	Anodyne	FKBP1A	24	40
CCN1CC[C@H](ONC(=N)c2cccc(Oc3ccccc3)c2)C1=O	ZINC000853669305	EF	On-Demand	Anodyne	F10	19	45
COc1ccc(CC(=O)NOCc2cccc(C(C)C)c2)cc1OC	ZINC000853669318	EH	On-Demand	Anodyne	HCRTR1	15	44
COc1ccc(CC(=O)NOCc2cccc(C(C)C)c2)cc1OC	ZINC000853669318	EH	On-Demand	Anodyne	ENPP1	50	31
COc1ccc(CC(=O)NOC[C@@H]2CCCCN2C(C)C)cc1OC	ZINC000853669336	FF	On-Demand	Anodyne	FKBP1A	45	39
COc1ccc(CC(=O)NOC[C@H]2CCCCN2C(C)C)cc1OC	ZINC000853669337	FF	On-Demand	Anodyne	FKBP1A	45	39
COc1ccc(CC(=O)NOCc2ccc(C#N)cc2C(F)(F)F)cc1OC	ZINC000853669338	GG	On-Demand	Mild	ESRRA	34	42
COC(=O)c1sc(C)cc1OCc1ccc(OC)cc1	ZINC000853669355	CG	On-Demand	Anodyne	PLK1	20	44
COC(=O)c1sc(C)cc1OCc1ccc(OC)cc1	ZINC000853669355	CG	On-Demand	Anodyne	MTNR1A	23	40
COC(=O)c1sc(C)cc1OCc1ccc(OC)cc1	ZINC000853669355	CG	On-Demand	Anodyne	MTNR1B	21	46
COc1ccc(CC(=O)NOCCSc2ccc(F)cc2)cc1OC	ZINC000853669361	FG	On-Demand	Anodyne	ENPP1	70	33
Cc1nonc1COc1cccc(NC(=O)C(C)C)c1	ZINC000853669376	CF	On-Demand	Anodyne	CACNA1D	15	48
Cc1nonc1COc1cccc(NC(=O)C(C)C)c1	ZINC000853669376	CF	On-Demand	Anodyne	KCNK3	40	33
COc1ccc(CC(=O)NOCCO[C@@H]2CC2(F)F)cc1OC	ZINC000853669377	ED	On-Demand	Anodyne	DRTS_TRYCR	47	33
COc1ccc(CC(=O)NOCCO[C@H]2CC2(F)F)cc1OC	ZINC000853669378	ED	On-Demand	Anodyne	DRTS_TRYCR	47	33
O=C(NCCO)c1ccc(OCCC2SCCS2)cc1	ZINC000853669414	DD	On-Demand	Anodyne	GRIN2B	17	44
FC(F)OCCOc1ccccc1-n1ccnc1	ZINC000853669445	CE	On-Demand	Anodyne	CYP11B1	15	41
N#Cc1cnnc(N2CCCC[C@H]2C(=O)NCC(F)F)c1	ZINC000853669452	CD	On-Demand	Mild	GPBAR1	29	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC(C)C)cc2)CC1	ZINC000853669478	FF	On-Demand	Anodyne	P2RY12	68	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC(C)C)cc2)CC1	ZINC000853669479	FF	On-Demand	Anodyne	P2RY12	68	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=C(N)c2nccc3ccccc23)CC1	ZINC000853669519	GD	On-Demand	Mild	P2RY12	111	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=C(N)c2nccc3ccccc23)CC1	ZINC000853669520	GD	On-Demand	Mild	P2RY12	111	38
COc1ccc(CC(=O)NOCc2csc(Cl)n2)cc1OC	ZINC000853669529	EF	On-Demand	Anodyne	ENPP1	65	32
COc1ccc(CC(=O)NOCc2ncnn2C(C)C)cc1OC	ZINC000853669546	ED	On-Demand	Anodyne	ENPP1	56	35
COc1ccc(CC(=O)NOCc2ncnn2C(C)C)cc1OC	ZINC000853669546	ED	On-Demand	Anodyne	DRTS_TRYCR	43	30
COc1ccc(CC(=O)NOCC[C@@H]2CCc3ccccc32)cc1OC	ZINC000853669555	FG	On-Demand	Anodyne	HCRTR1	23	46
COc1ccc(CC(=O)NOCC[C@@H]2CCc3ccccc32)cc1OC	ZINC000853669555	FG	On-Demand	Anodyne	NQO2	22	43
COc1ccc(CC(=O)NOCC[C@@H]2CCc3ccccc32)cc1OC	ZINC000853669555	FG	On-Demand	Anodyne	PPARD	36	43
COc1ccc(CC(=O)NOCC[C@@H]2CCc3ccccc32)cc1OC	ZINC000853669555	FG	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(CC(=O)NOCC[C@@H]2CCc3ccccc32)cc1OC	ZINC000853669555	FG	On-Demand	Anodyne	MTNR1B	32	41
COc1ccc(CC(=O)NOCC[C@@H]2CCc3ccccc32)cc1OC	ZINC000853669555	FG	On-Demand	Anodyne	HCRTR2	22	46
COc1ccc(CC(=O)NOCC[C@H]2CCc3ccccc32)cc1OC	ZINC000853669556	FG	On-Demand	Anodyne	HCRTR1	23	46
COc1ccc(CC(=O)NOCC[C@H]2CCc3ccccc32)cc1OC	ZINC000853669556	FG	On-Demand	Anodyne	NQO2	22	43
COc1ccc(CC(=O)NOCC[C@H]2CCc3ccccc32)cc1OC	ZINC000853669556	FG	On-Demand	Anodyne	PPARD	36	43
COc1ccc(CC(=O)NOCC[C@H]2CCc3ccccc32)cc1OC	ZINC000853669556	FG	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(CC(=O)NOCC[C@H]2CCc3ccccc32)cc1OC	ZINC000853669556	FG	On-Demand	Anodyne	MTNR1B	32	41
COc1ccc(CC(=O)NOCC[C@H]2CCc3ccccc32)cc1OC	ZINC000853669556	FG	On-Demand	Anodyne	HCRTR2	22	46
COc1ccc(CC(=O)NOCCOC(F)F)cc1OC	ZINC000853669559	DD	On-Demand	Anodyne	DRTS_TRYCR	44	31
COC(=O)Cc1ccnc(N2CCCCCCCC2)c1	ZINC000853669601	CF	On-Demand	Anodyne	GALR2	40	32
C=C(Cl)CONC(=O)Cc1ccc(OC)c(OC)c1	ZINC000853669603	CE	On-Demand	Mild	ENPP1	59	30
C=C(Cl)CONC(=O)Cc1ccc(OC)c(OC)c1	ZINC000853669603	CE	On-Demand	Mild	DRTS_TRYCR	45	32
N#Cc1ccc(N2CCCC[C@H]2C(=O)NCC(F)F)nn1	ZINC000853669691	CD	On-Demand	Mild	LGMN	42	32
CS(=O)(=O)N1CCN(C(=O)c2ccc(OCCOC(F)F)cc2)CC1	ZINC000853669698	GD	On-Demand	Anodyne	HRH3	19	44
CN(CCO)C(=O)c1ccc(OCCOC(F)F)cc1	ZINC000853669737	CD	On-Demand	Anodyne	PLA2G4B	40	34
CN(CCO)C(=O)c1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853669741	EE	On-Demand	Anodyne	LSS	25	41
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc(-n3cccn3)cc2)C1	ZINC000853669765	FF	On-Demand	Anodyne	AMP1_PLAFQ	31	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc(-n3cccn3)cc2)C1	ZINC000853669766	FF	On-Demand	Anodyne	AMP1_PLAFQ	31	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3cncn3)c2)CC1	ZINC000853669767	FD	On-Demand	Anodyne	P2RY12	105	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3cncn3)c2)CC1	ZINC000853669768	FD	On-Demand	Anodyne	P2RY12	105	39
CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853669789	FG	On-Demand	Anodyne	GPR119	50	53
CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853669790	FG	On-Demand	Anodyne	GPR119	50	53
CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853669791	FG	On-Demand	Anodyne	GPR119	50	53
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCN(c3cc(F)ncn3)C2)C1	ZINC000853669792	FG	On-Demand	Anodyne	GPR119	50	53
Fc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000853669794	CG	On-Demand	Anodyne	PRCP	33	55
Fc1cc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000853669794	CG	On-Demand	Anodyne	KCNN3	35	49
Fc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000853669795	CG	On-Demand	Anodyne	PRCP	33	55
Fc1cc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)ncn1	ZINC000853669795	CG	On-Demand	Anodyne	KCNN3	35	49
FC(F)OCCOc1cccc(-n2ccnc2)c1	ZINC000853669798	CE	On-Demand	Anodyne	CYP1A2	15	50
FC(F)OCCOc1cccc(-n2ccnc2)c1	ZINC000853669798	CE	On-Demand	Anodyne	CYP2C19	20	50
FC(F)OCCOc1cccc(-n2ccnc2)c1	ZINC000853669798	CE	On-Demand	Anodyne	HMOX2	25	41
CCCn1ncnc1COc1ccc(-n2cncn2)cc1	ZINC000853669839	CD	On-Demand	Anodyne	CYP2C19	15	65
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(-n3ccnc3)c2)C1	ZINC000853669841	FF	On-Demand	Anodyne	NOS2	82	34
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(-n3ccnc3)c2)C1	ZINC000853669841	FF	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(-n3ccnc3)c2)C1	ZINC000853669842	FF	On-Demand	Anodyne	NOS2	82	34
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(-n3ccnc3)c2)C1	ZINC000853669842	FF	On-Demand	Anodyne	GPR119	28	41
Cc1ccc(N2CCC[C@@H]([C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)nn1	ZINC000853669850	EG	On-Demand	Anodyne	GPR119	44	50
Cc1ccc(N2CCC[C@@H]([C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)nn1	ZINC000853669854	EG	On-Demand	Anodyne	GPR119	44	50
C[C@H]1CN(Cc2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853669870	DF	On-Demand	Anodyne	DRD4	30	40
C[C@H]1CN(Cc2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853669870	DF	On-Demand	Anodyne	SIGMAR1	26	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853669871	DF	On-Demand	Anodyne	DRD4	30	40
C[C@@H]1CN(Cc2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853669871	DF	On-Demand	Anodyne	SIGMAR1	26	40
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	FOLA	27	42
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	DRTS_PLAFK	37	42
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	HCRTR1	19	42
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	DRTS_PLABA	15	42
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	DRTS_TOXGO	26	43
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	DYR_PNECA	17	43
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	ENPP1	63	37
COc1ccc(CC(=O)NOCc2cccnc2N)cc1OC	ZINC000853669882	DD	On-Demand	Anodyne	DRTS_TRYCR	48	34
C#CCCCOc1cccnc1NC1C[C@@H]2CC[C@H](C1)N2C	ZINC000853669888	CF	On-Demand	Mild	EHMT2	41	30
CCn1ncnc1CONC(=O)Cc1ccc(OC)c(OC)c1	ZINC000853669895	DD	On-Demand	Anodyne	ENPP1	67	33
COc1ccc(CC(=O)NOCc2ncsc2Br)cc1OC	ZINC000853669904	GF	On-Demand	Anodyne	ENPP1	46	32
COc1ccc(CC(=O)NOCCSc2ccc(F)cc2F)cc1OC	ZINC000853669907	GG	On-Demand	Anodyne	ENPP1	49	30
COc1ccc(CC(=O)NOCc2cccc(SC)c2)cc1OC	ZINC000853669920	EG	On-Demand	Anodyne	ENPP1	51	33
CCCn1ncnc1CONC(=O)Cc1ccc(OC)c(OC)c1	ZINC000853669926	ED	On-Demand	Anodyne	ENPP1	46	32
COc1ccc(CC(=O)NOCCC2(O)CCC2)cc1OC	ZINC000853669929	DD	On-Demand	Anodyne	ENPP1	49	31
COc1ccc(CC(=O)NOCCO[Si](C)(C)C(C)(C)C)cc1OC	ZINC000853669940	FG	On-Demand	Reactive	FOLA	19	40
COc1ccc(CC(=O)NOCCO[Si](C)(C)C(C)(C)C)cc1OC	ZINC000853669940	FG	On-Demand	Reactive	DRTS_PLAFK	26	40
COc1ccc(CC(=O)NOCCO[Si](C)(C)C(C)(C)C)cc1OC	ZINC000853669940	FG	On-Demand	Reactive	DRTS_PLABA	15	40
COc1ccc(CC(=O)NOCCO[Si](C)(C)C(C)(C)C)cc1OC	ZINC000853669940	FG	On-Demand	Reactive	MT-ND1	24	41
COc1ccc(CC(=O)NOCCO[Si](C)(C)C(C)(C)C)cc1OC	ZINC000853669940	FG	On-Demand	Reactive	ENPP1	48	30
COc1ccc(CC(=O)NOCCO[Si](C)(C)C(C)(C)C)cc1OC	ZINC000853669940	FG	On-Demand	Reactive	DRTS_TRYCR	48	33
O=C(c1ccccc1)N1CC[C@@H](CON=C2CCC2)C1	ZINC000853669978	CF	On-Demand	Mild	SLC6A1	43	38
O=C(c1ccccc1)N1CC[C@@H](CON=C2CCC2)C1	ZINC000853669978	CF	On-Demand	Mild	L3MBTL3	61	38
O=C(c1ccccc1)N1CC[C@H](CON=C2CCC2)C1	ZINC000853669979	CF	On-Demand	Mild	SLC6A1	43	38
O=C(c1ccccc1)N1CC[C@H](CON=C2CCC2)C1	ZINC000853669979	CF	On-Demand	Mild	L3MBTL3	61	38
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853669981	GG	On-Demand	Anodyne	DRD4	17	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853669981	GG	On-Demand	Anodyne	ACHE	19	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853669981	GG	On-Demand	Anodyne	HTR4	36	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853669981	GG	On-Demand	Anodyne	SIGMAR1	33	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853669981	GG	On-Demand	Anodyne	CCR3	37	43
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853669981	GG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853669981	GG	On-Demand	Anodyne	BIRC2	48	39
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853669982	GG	On-Demand	Anodyne	DRD4	17	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853669982	GG	On-Demand	Anodyne	ACHE	19	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853669982	GG	On-Demand	Anodyne	HTR4	36	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853669982	GG	On-Demand	Anodyne	SIGMAR1	33	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853669982	GG	On-Demand	Anodyne	CCR3	37	43
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853669982	GG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853669982	GG	On-Demand	Anodyne	BIRC2	48	39
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853669983	GG	On-Demand	Anodyne	DRD4	17	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853669983	GG	On-Demand	Anodyne	ACHE	19	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853669983	GG	On-Demand	Anodyne	HTR4	36	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853669983	GG	On-Demand	Anodyne	SIGMAR1	33	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853669983	GG	On-Demand	Anodyne	CCR3	37	43
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853669983	GG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853669983	GG	On-Demand	Anodyne	BIRC2	48	39
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853669984	GG	On-Demand	Anodyne	DRD4	17	42
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853669984	GG	On-Demand	Anodyne	ACHE	19	41
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853669984	GG	On-Demand	Anodyne	HTR4	36	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853669984	GG	On-Demand	Anodyne	SIGMAR1	33	46
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853669984	GG	On-Demand	Anodyne	CCR3	37	43
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853669984	GG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853669984	GG	On-Demand	Anodyne	BIRC2	48	39
C[C@@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853670037	JE	On-Demand	Mild	VIPR1	27	43
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853670039	JE	On-Demand	Mild	VIPR1	27	43
COc1ccc(-c2nccc(N3CCCC[C@H]3C(=O)NCC(F)F)n2)cc1	ZINC000853670070	GF	On-Demand	Anodyne	NOS2	19	41
FC(F)OCCOc1cccc(-n2cncn2)c1	ZINC000853670088	CD	On-Demand	Anodyne	HMOX2	17	41
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCN(c3nc(C#N)c(Cl)s3)C2)C1	ZINC000853670090	GI	On-Demand	Mild	GPR119	18	43
CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCN(c3nc(C#N)c(Cl)s3)C2)C1	ZINC000853670092	GI	On-Demand	Mild	GPR119	18	43
CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCN(c3nc(C#N)c(Cl)s3)C2)C1	ZINC000853670094	GI	On-Demand	Mild	GPR119	18	43
CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCN(c3nc(C#N)c(Cl)s3)C2)C1	ZINC000853670095	GI	On-Demand	Mild	GPR119	18	43
c1ncn(-c2ccc(OCCC3SCCS3)cc2)n1	ZINC000853670131	CF	On-Demand	Anodyne	CYP2C19	17	62
CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853670138	FF	On-Demand	Mild	GPR119	38	51
CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853670139	FF	On-Demand	Mild	GPR119	38	51
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853670140	FF	On-Demand	Mild	GPR119	38	51
CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCN(c3cc(C#N)cnn3)C2)C1	ZINC000853670141	FF	On-Demand	Mild	GPR119	38	51
CO[C@@H](CONC(=N)C(C)(C)NC(=O)c1cccc(Cl)c1)C1CCC1	ZINC000853670144	FG	On-Demand	Anodyne	CACNA1I	28	40
C=C(Cl)COc1ccc(NC(=O)COC)cc1	ZINC000853670166	CE	On-Demand	Mild	ADORA2B	40	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)sc2C(=O)OC)CC1	ZINC000853670176	GD	On-Demand	Anodyne	P2RY12	41	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)sc2C(=O)OC)CC1	ZINC000853670177	GD	On-Demand	Anodyne	P2RY12	41	37
COc1ccc(CC(=O)NO[C@H](C)C(C)C)cc1OC	ZINC000853670178	CE	On-Demand	Anodyne	DRTS_PLAFK	17	40
COc1ccc(CC(=O)NO[C@H](C)C(C)C)cc1OC	ZINC000853670178	CE	On-Demand	Anodyne	ENPP1	66	33
COc1ccc(CC(=O)NO[C@H](C)C(C)C)cc1OC	ZINC000853670178	CE	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1ccc(CC(=O)NO[C@@H](C)C(C)C)cc1OC	ZINC000853670179	CE	On-Demand	Anodyne	DRTS_PLAFK	17	40
COc1ccc(CC(=O)NO[C@@H](C)C(C)C)cc1OC	ZINC000853670179	CE	On-Demand	Anodyne	ENPP1	66	33
COc1ccc(CC(=O)NO[C@@H](C)C(C)C)cc1OC	ZINC000853670179	CE	On-Demand	Anodyne	DRTS_TRYCR	44	31
COc1ccc(CC(=O)NOCc2cccc(OC)c2Cl)cc1OC	ZINC000853670196	FG	On-Demand	Anodyne	ENPP1	55	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670216	GF	On-Demand	Mild	ACHE	19	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670216	GF	On-Demand	Mild	HTR4	45	47
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670216	GF	On-Demand	Mild	SIGMAR1	17	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670216	GF	On-Demand	Mild	CACNA1I	50	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670217	GF	On-Demand	Mild	ACHE	19	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670217	GF	On-Demand	Mild	HTR4	45	47
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670217	GF	On-Demand	Mild	SIGMAR1	17	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670217	GF	On-Demand	Mild	CACNA1I	50	36
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	CHRM2	22	48
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	CHRM1	22	48
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	ACE	41	35
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	DRD2	30	52
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	DRD4	57	52
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	ACHE	49	45
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	DRD3	18	52
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	KCNH2	16	43
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	HTR4	20	45
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	CHRM3	30	48
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	LTA4H	25	43
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	SIGMAR1	66	57
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	SSTR5	58	38
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	CACNA1B	15	42
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	CCR3	39	44
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	SLC6A5	19	43
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	MCHR1	55	51
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	CACNA1G	26	45
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	CCR8	17	44
C[C@@H](ON=C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670227	EF	On-Demand	Mild	BIRC2	55	43
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670238	FE	On-Demand	Mild	DRD4	17	42
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670238	FE	On-Demand	Mild	ACHE	19	40
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670238	FE	On-Demand	Mild	SLC6A1	48	34
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670238	FE	On-Demand	Mild	OPRM1	16	43
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670238	FE	On-Demand	Mild	HTR4	45	47
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670238	FE	On-Demand	Mild	SIGMAR1	26	40
C#CCCN(CCOC)C(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670238	FE	On-Demand	Mild	CACNA1I	41	34
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670239	FE	On-Demand	Mild	DRD4	17	42
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670239	FE	On-Demand	Mild	ACHE	19	40
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670239	FE	On-Demand	Mild	SLC6A1	48	34
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670239	FE	On-Demand	Mild	OPRM1	16	43
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670239	FE	On-Demand	Mild	HTR4	45	47
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670239	FE	On-Demand	Mild	SIGMAR1	26	40
C#CCCN(CCOC)C(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670239	FE	On-Demand	Mild	CACNA1I	41	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)NCCO)cc2)CC1	ZINC000853670287	GC	On-Demand	Anodyne	P2RY12	91	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)NCCO)cc2)CC1	ZINC000853670289	GC	On-Demand	Anodyne	P2RY12	91	41
CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853670310	FG	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853670312	FG	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853670314	FG	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCN(c3cnc(F)cn3)C2)C1	ZINC000853670317	FG	On-Demand	Anodyne	GPR119	46	51
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2-n2ccnc2)CC1	ZINC000853670318	FD	On-Demand	Anodyne	P2RY12	115	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2-n2ccnc2)CC1	ZINC000853670320	FD	On-Demand	Anodyne	P2RY12	115	39
CCC(CC)COc1ccc(-n2cncn2)cc1	ZINC000853670369	BG	On-Demand	Anodyne	CYP2C19	21	67
COc1ccc(N2CC[C@H](NC(=O)NC3(C)CCCC3)C2)cc1	ZINC000853670370	DF	On-Demand	Clean	EPHX2	20	41
c1cnn(-c2ccc(OCCC3SCCS3)cc2)c1	ZINC000853670377	CG	On-Demand	Anodyne	AMP1_PLAFQ	52	36
CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCN(c3cnccn3)C2)C1	ZINC000853670381	EF	On-Demand	Anodyne	GPR119	44	73
CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCN(c3cnccn3)C2)C1	ZINC000853670382	EF	On-Demand	Anodyne	GPR119	44	73
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCN(c3cnccn3)C2)C1	ZINC000853670383	EF	On-Demand	Anodyne	GPR119	44	73
CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCN(c3cnccn3)C2)C1	ZINC000853670384	EF	On-Demand	Anodyne	GPR119	44	73
c1cc(OCCC2SCCS2)cc(-n2ccnc2)c1	ZINC000853670391	CG	On-Demand	Anodyne	CYP2C19	19	45
OC1(CCOc2ccc(-n3cncn3)cc2)CCC1	ZINC000853670392	CD	On-Demand	Anodyne	CYP2C19	16	60
FC(F)OCCOc1ccc(-n2cccn2)cc1	ZINC000853670394	CE	On-Demand	Anodyne	CYP2C19	20	41
FC(F)OCCOc1ccc(-n2cccn2)cc1	ZINC000853670394	CE	On-Demand	Anodyne	AMP1_PLAFQ	55	38
CC(C)(C)OC(=O)N1CC[C@H]([C@H]2CCCN(c3ccnc(O)c3[N+](=O)[O-])C2)C1	ZINC000853670401	GG	On-Demand	Bother	GPR119	46	47
CC(C)(C)OC(=O)N1CC[C@H]([C@@H]2CCCN(c3ccnc(O)c3[N+](=O)[O-])C2)C1	ZINC000853670402	GG	On-Demand	Bother	GPR119	46	47
CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCN(c3ccnc(O)c3[N+](=O)[O-])C2)C1	ZINC000853670403	GG	On-Demand	Bother	GPR119	46	47
CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCN(c3ccnc(O)c3[N+](=O)[O-])C2)C1	ZINC000853670404	GG	On-Demand	Bother	GPR119	46	47
O=C(COC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)NCCc1cccc2cccnc12	ZINC000853670435	JD	On-Demand	Mild	RELA	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2Cl)CC1	ZINC000853670471	ED	On-Demand	Anodyne	P2RY12	82	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2Cl)CC1	ZINC000853670471	ED	On-Demand	Anodyne	GPR119	18	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2Cl)CC1	ZINC000853670472	ED	On-Demand	Anodyne	P2RY12	82	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2Cl)CC1	ZINC000853670472	ED	On-Demand	Anodyne	GPR119	18	42
C#CCOCCOc1ccc(C(=O)N(C)CCO)cc1	ZINC000853670493	CC	On-Demand	Mild	PLA2G4B	40	33
C#CCOCCOc1ccc(C(=O)N(C)CCO)cc1	ZINC000853670493	CC	On-Demand	Mild	LSS	28	42
COc1ccc(-c2nn(CCC3SCCS3)c(=O)c3ccccc23)cc1	ZINC000853670497	GI	On-Demand	Anodyne	HRH1	23	42
COc1ccc(-c2nn(CCC3SCCS3)c(=O)c3ccccc23)cc1	ZINC000853670497	GI	On-Demand	Anodyne	AXL	17	40
COc1ccc(-c2nn(CCC3SCCS3)c(=O)c3ccccc23)cc1	ZINC000853670497	GI	On-Demand	Anodyne	MERTK	17	40
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670498	GD	On-Demand	Anodyne	DRD4	18	41
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670498	GD	On-Demand	Anodyne	HTR4	33	45
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670498	GD	On-Demand	Anodyne	SIGMAR1	15	40
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCN(CCc2ccccc2)C1	ZINC000853670498	GD	On-Demand	Anodyne	CCR3	45	45
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670499	GD	On-Demand	Anodyne	DRD4	18	41
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670499	GD	On-Demand	Anodyne	HTR4	33	45
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670499	GD	On-Demand	Anodyne	SIGMAR1	15	40
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCN(CCc2ccccc2)C1	ZINC000853670499	GD	On-Demand	Anodyne	CCR3	45	45
COC(=O)C1(COc2cccnc2Cl)CC1	ZINC000853670504	BE	On-Demand	Anodyne	G2YM83_BOTF4	68	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-n3cncn3)cc2)CC1	ZINC000853670515	FD	On-Demand	Anodyne	P2RY12	55	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-n3cncn3)cc2)CC1	ZINC000853670516	FD	On-Demand	Anodyne	P2RY12	55	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3cccn3)c2)CC1	ZINC000853670666	FD	On-Demand	Anodyne	P2RY12	171	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3cccn3)c2)CC1	ZINC000853670666	FD	On-Demand	Anodyne	AMP1_PLAFQ	45	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3cccn3)c2)CC1	ZINC000853670667	FD	On-Demand	Anodyne	P2RY12	171	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3cccn3)c2)CC1	ZINC000853670667	FD	On-Demand	Anodyne	AMP1_PLAFQ	45	37
Fc1ncnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1Br	ZINC000853670673	GH	On-Demand	Anodyne	PRCP	19	42
Fc1ncnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)c1Br	ZINC000853670673	GH	On-Demand	Anodyne	KCNN3	32	47
Fc1ncnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1Br	ZINC000853670674	GH	On-Demand	Anodyne	PRCP	19	42
Fc1ncnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)c1Br	ZINC000853670674	GH	On-Demand	Anodyne	KCNN3	32	47
FC(F)OCCOc1ccc(-n2cncn2)cc1	ZINC000853670692	CD	On-Demand	Anodyne	CYP2C19	20	69
O=C(c1ccccc1)N1CC[C@H](COc2ccc(-n3cncn3)cc2)C1	ZINC000853670693	EF	On-Demand	Anodyne	CHEK2	18	45
O=C(c1ccccc1)N1CC[C@H](COc2ccc(-n3cncn3)cc2)C1	ZINC000853670693	EF	On-Demand	Anodyne	NR1D1	15	48
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(-n3cncn3)cc2)C1	ZINC000853670694	EF	On-Demand	Anodyne	CHEK2	18	45
O=C(c1ccccc1)N1CC[C@@H](COc2ccc(-n3cncn3)cc2)C1	ZINC000853670694	EF	On-Demand	Anodyne	NR1D1	15	48
C[C@@H](Nc1ncnc(F)c1Br)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853670707	GG	On-Demand	Anodyne	TPP2	67	38
C[C@@H](Nc1cnc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853670711	DE	On-Demand	Anodyne	ACE	16	40
C[C@@H](Nc1cnc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853670711	DE	On-Demand	Anodyne	DRD4	20	40
C[C@@H](Nc1cnc(F)cn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853670711	DE	On-Demand	Anodyne	TPP2	66	37
C#CCOCCOc1cccc(NC(=O)c2cnn(C)c2)c1	ZINC000853670739	CD	On-Demand	Mild	KDR	21	41
C#CCOCCOc1cccc(NC(=O)c2cnn(C)c2)c1	ZINC000853670739	CD	On-Demand	Mild	EPHX2	17	42
C#CCOCCOc1cccc(NC(=O)c2cnn(C)c2)c1	ZINC000853670739	CD	On-Demand	Mild	TAAR1	48	40
C#CCOCCOc1cccc(NC(=O)c2cnn(C)c2)c1	ZINC000853670739	CD	On-Demand	Mild	KCNK3	96	36
C#CCOCCOc1cccc(NC(=O)c2cnn(C)c2)c1	ZINC000853670739	CD	On-Demand	Mild	KCNK9	66	33
C[C@@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670784	JD	On-Demand	Mild	DRD4	26	43
C[C@@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670784	JD	On-Demand	Mild	ACHE	22	40
C[C@@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670784	JD	On-Demand	Mild	SIGMAR1	27	45
C[C@@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670784	JD	On-Demand	Mild	MCHR1	19	41
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670785	JD	On-Demand	Mild	DRD4	26	43
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670785	JD	On-Demand	Mild	ACHE	22	40
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670785	JD	On-Demand	Mild	SIGMAR1	27	45
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853670785	JD	On-Demand	Mild	MCHR1	19	41
COC(=O)c1nccc(N2CCC[C@@H]([C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)n1	ZINC000853670802	GF	On-Demand	Anodyne	GPR119	42	52
COC(=O)c1nccc(N2CCC[C@H]([C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)n1	ZINC000853670803	GF	On-Demand	Anodyne	GPR119	42	52
COC(=O)c1nccc(N2CCC[C@@H]([C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)n1	ZINC000853670804	GF	On-Demand	Anodyne	GPR119	42	52
COC(=O)c1nccc(N2CCC[C@H]([C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)n1	ZINC000853670805	GF	On-Demand	Anodyne	GPR119	42	52
c1ncn(-c2ccc(OCCCC3CCC3)cc2)n1	ZINC000853670809	CG	On-Demand	Anodyne	CYP2C19	20	64
c1ncn(-c2ccc(OCCC3CCC3)cc2)n1	ZINC000853670826	BF	On-Demand	Anodyne	CYP2C19	17	62
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-n3cccn3)cc2)CC1	ZINC000853670827	FD	On-Demand	Anodyne	P2RY12	128	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-n3cccn3)cc2)CC1	ZINC000853670827	FD	On-Demand	Anodyne	AMP1_PLAFQ	58	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-n3cccn3)cc2)CC1	ZINC000853670828	FD	On-Demand	Anodyne	P2RY12	128	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-n3cccn3)cc2)CC1	ZINC000853670828	FD	On-Demand	Anodyne	AMP1_PLAFQ	58	44
CCN1CC[C@H](ONC(=N)C(C)(C)NC(=O)c2cccc(Cl)c2)C1=O	ZINC000853670831	FD	On-Demand	Anodyne	CACNA1I	55	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3ccnc3)c2)CC1	ZINC000853670836	FD	On-Demand	Anodyne	P2RY12	102	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3ccnc3)c2)CC1	ZINC000853670836	FD	On-Demand	Anodyne	CYP26A1	40	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3ccnc3)c2)CC1	ZINC000853670837	FD	On-Demand	Anodyne	P2RY12	102	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3ccnc3)c2)CC1	ZINC000853670837	FD	On-Demand	Anodyne	CYP26A1	40	33
C[C@@H](Nc1cc(F)ncn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853670842	DE	On-Demand	Anodyne	TPP2	71	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C=NO)nc2=O)CC1	ZINC000853670886	FB	On-Demand	Mild	P2RY12	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C=NO)nc2=O)CC1	ZINC000853670887	FB	On-Demand	Mild	P2RY12	43	37
CON1CCN(c2ncnc3ccc(F)cc23)CC1	ZINC000853670931	CD	On-Demand	Anodyne	PDE3A	44	39
CON1CCN(c2ncnc3ccc(F)cc23)CC1	ZINC000853670931	CD	On-Demand	Anodyne	PDGFRB	78	54
CON1CCN(c2ncnc3ccc(F)cc23)CC1	ZINC000853670931	CD	On-Demand	Anodyne	PDE3B	47	37
CON1CCN(c2ccnc(C3CC3)n2)CC1	ZINC000853670933	BD	On-Demand	Anodyne	SORD	94	40
CON1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000853670937	DE	On-Demand	Bother	SERPINE1	18	42
CON1CCN(c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])CC1	ZINC000853670940	DC	On-Demand	Bother	SLC6A9	20	40
CON1CCN(c2nc(C)nc3[nH]ccc23)CC1	ZINC000853670952	BC	On-Demand	Anodyne	AKT2	23	42
CON1CCN(c2ncnc3ccccc23)CC1	ZINC000853670956	BD	On-Demand	Anodyne	PDE3A	43	40
CON1CCN(c2ncnc3ccccc23)CC1	ZINC000853670956	BD	On-Demand	Anodyne	PDGFRB	72	51
CON1CCN(c2ncnc3ccccc23)CC1	ZINC000853670956	BD	On-Demand	Anodyne	PDE3B	47	40
CON1CCN(c2ncnc3ccccc23)CC1	ZINC000853670956	BD	On-Demand	Anodyne	SORD	16	52
CON1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1	ZINC000853670957	DE	On-Demand	Bother	SERPINE1	19	40
CON1CCN(c2ccc([N+](=O)[O-])cc2C#N)CC1	ZINC000853670962	CD	On-Demand	Mild	WDR5	38	44
CON1CCN(c2cc(C(C)C)nc(C(C)C)n2)CC1	ZINC000853670965	CE	On-Demand	Anodyne	SORD	30	42
C=C(Cl)CONC(=N)C(C)(C)NC(=O)c1cccc(Cl)c1	ZINC000853670990	EG	On-Demand	Mild	CACNA1I	24	40
CON1CCN(c2ccc(S(=O)(=O)N3CCCCC3)cc2[N+](=O)[O-])CC1	ZINC000853671021	GD	On-Demand	Bother	NOD2	18	43
CON1CCN(c2ccnc(C(C)(C)C)n2)CC1	ZINC000853671022	CD	On-Demand	Anodyne	SORD	78	40
CON1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000853671025	CD	On-Demand	Anodyne	PDE3A	43	40
CON1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000853671025	CD	On-Demand	Anodyne	PDGFRB	76	51
CON1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000853671025	CD	On-Demand	Anodyne	HRH4	19	46
CON1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000853671025	CD	On-Demand	Anodyne	PDE3B	47	40
CON1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000853671025	CD	On-Demand	Anodyne	AKT1	22	44
C=C(Cl)COc1ccc(C(=O)N(CC)CC)cc1	ZINC000853671028	CG	On-Demand	Mild	OPRD1	36	45
C=C(Cl)COc1ccc(C(=O)N(CC)CC)cc1	ZINC000853671028	CG	On-Demand	Mild	PLA2G4B	75	38
CON1CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000853671030	CD	On-Demand	Anodyne	SORD	93	50
CON1CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000853671030	CD	On-Demand	Anodyne	SMO	15	40
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccccc1	ZINC000853671033	EJ	On-Demand	Anodyne	GRIN2B	18	41
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccccc1	ZINC000853671033	EJ	On-Demand	Anodyne	PRNP	40	43
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccccc1	ZINC000853671033	EJ	On-Demand	Anodyne	EPHX2	29	45
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccccc1	ZINC000853671033	EJ	On-Demand	Anodyne	TAAR1	46	40
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccccc1	ZINC000853671033	EJ	On-Demand	Anodyne	DGAT1	17	42
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccccc1	ZINC000853671033	EJ	On-Demand	Anodyne	KCNK3	133	50
O=C(Nc1cccc(OCCC2SCCS2)c1)c1ccccc1	ZINC000853671033	EJ	On-Demand	Anodyne	KCNK9	87	44
CON1CCN(c2cnc3ccccc3n2)CC1	ZINC000853671058	BD	On-Demand	Anodyne	HTR3A	18	69
CON1CCN(c2cnc3ccccc3n2)CC1	ZINC000853671058	BD	On-Demand	Anodyne	SORD	34	54
CC(C)(C)C(=O)Nc1cnn(CCO[Si](C)(C)C(C)(C)C)c1	ZINC000853671059	EH	On-Demand	Reactive	PANC	51	32
Fc1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cn1	ZINC000853671083	CG	On-Demand	Anodyne	PRCP	22	44
Fc1cnc(N2CCCC[C@@H]2c2nc3ccccc3[nH]2)cn1	ZINC000853671083	CG	On-Demand	Anodyne	KCNN3	33	50
Fc1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)cn1	ZINC000853671085	CG	On-Demand	Anodyne	PRCP	22	44
Fc1cnc(N2CCCC[C@H]2c2nc3ccccc3[nH]2)cn1	ZINC000853671085	CG	On-Demand	Anodyne	KCNN3	33	50
CC(C)(C)OC(=O)N1CCO[C@H](Cn2cc(NC(=O)C(C)(C)C)cn2)C1	ZINC000853671092	FF	On-Demand	Anodyne	PANC	55	37
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2cc(NC(=O)C(C)(C)C)cn2)C1	ZINC000853671094	FF	On-Demand	Anodyne	PANC	55	37
CON1CCN(c2nc(-c3ccncc3)nc3ccccc23)CC1	ZINC000853671095	DE	On-Demand	Anodyne	METAP1	36	46
CON1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000853671097	CD	On-Demand	Anodyne	PDE3A	43	38
CON1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000853671097	CD	On-Demand	Anodyne	PDGFRB	77	54
CON1CCN(c2ncnc3ccc(C)cc23)CC1	ZINC000853671097	CD	On-Demand	Anodyne	PDE3B	47	38
CON1CCN(c2nc(C)cc(C)n2)CC1	ZINC000853671106	BC	On-Demand	Anodyne	SORD	17	44
CON1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)CC1	ZINC000853671109	CD	On-Demand	Bother	PDE3A	40	34
CON1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)CC1	ZINC000853671109	CD	On-Demand	Bother	PDGFRB	74	56
CON1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)CC1	ZINC000853671109	CD	On-Demand	Bother	ABCC1	17	41
CON1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)CC1	ZINC000853671109	CD	On-Demand	Bother	PDE3B	44	34
COc1ccc(OCc2csc(Cl)n2)cc1C	ZINC000853671117	CH	On-Demand	Anodyne	PPARD	37	46
CON1CCN(c2ncnc3ccc(Br)cc23)CC1	ZINC000853671124	DE	On-Demand	Anodyne	PDE3A	43	37
CON1CCN(c2ncnc3ccc(Br)cc23)CC1	ZINC000853671124	DE	On-Demand	Anodyne	PDGFRB	75	51
CON1CCN(c2ncnc3ccc(Br)cc23)CC1	ZINC000853671124	DE	On-Demand	Anodyne	PDE3B	47	37
CON1CCN(c2cc(C)nc(-c3cccnc3)n2)CC1	ZINC000853671126	CD	On-Demand	Anodyne	ROS1	49	45
CON1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000853671139	CD	On-Demand	Bother	WDR5	42	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(NC(=O)C(C)(C)C)cn2)CC1	ZINC000853671146	GD	On-Demand	Anodyne	P2RY12	56	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(NC(=O)C(C)(C)C)cn2)CC1	ZINC000853671147	GD	On-Demand	Anodyne	P2RY12	56	36
CON1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000853671151	FD	On-Demand	Anodyne	PDE3A	43	37
CON1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000853671151	FD	On-Demand	Anodyne	PDGFRB	75	51
CON1CCN(c2ncnc3ccc(I)cc23)CC1	ZINC000853671151	FD	On-Demand	Anodyne	PDE3B	46	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C)nnc2-c2cccc(C#N)c2)CC1	ZINC000853671157	GD	On-Demand	Mild	P2RY12	196	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C)nnc2-c2cccc(C#N)c2)CC1	ZINC000853671157	GD	On-Demand	Mild	MCHR1	19	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C)nnc2-c2cccc(C#N)c2)CC1	ZINC000853671158	GD	On-Demand	Mild	P2RY12	196	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C)nnc2-c2cccc(C#N)c2)CC1	ZINC000853671158	GD	On-Demand	Mild	MCHR1	19	45
CON1CCN(c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)CC1	ZINC000853671164	FD	On-Demand	Bother	SSTR1	19	43
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853671177	JD	On-Demand	Mild	DRD4	24	42
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853671177	JD	On-Demand	Mild	SIGMAR1	19	41
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853671178	JD	On-Demand	Mild	DRD4	24	42
C[C@H](OC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853671178	JD	On-Demand	Mild	SIGMAR1	19	41
CON1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000853671182	CD	On-Demand	Bother	WDR5	37	42
CON1CCN(c2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])CC1	ZINC000853671187	GD	On-Demand	Bother	NOD2	18	43
CON1CCN(c2nc(-c3ccccn3)nc3c2CCC3)CC1	ZINC000853671189	DD	On-Demand	Anodyne	METAP1	28	41
CON1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1	ZINC000853671199	EF	On-Demand	Bother	TAAR1	23	48
CON1CCN(c2ccc(S(=O)(=O)N3CCN(C)CC3)cc2[N+](=O)[O-])CC1	ZINC000853671210	GC	On-Demand	Bother	NOD2	19	43
CON1CCN(c2ccnc(C)n2)CC1	ZINC000853671222	BC	On-Demand	Anodyne	SORD	99	46
CON1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1	ZINC000853671245	FF	On-Demand	Bother	HTR1B	16	42
CON1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1	ZINC000853671245	FF	On-Demand	Bother	CPT1A	42	37
CON1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1	ZINC000853671245	FF	On-Demand	Bother	CPT2	40	33
CON1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1	ZINC000853671245	FF	On-Demand	Bother	PRNP	54	37
CON1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1	ZINC000853671245	FF	On-Demand	Bother	TAAR1	54	60
CON1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1	ZINC000853671245	FF	On-Demand	Bother	WDR5	37	45
CON1CCN(c2nc(-c3cccnc3)nc(C)c2C)CC1	ZINC000853671249	CD	On-Demand	Anodyne	ROS1	40	35
NC(=O)COc1ccc(OCCC2SCCS2)cc1	ZINC000853671250	CE	On-Demand	Anodyne	PLA2G4B	64	33
CON1CCN(c2ccnc(C(C)C)n2)CC1	ZINC000853671255	BD	On-Demand	Anodyne	SORD	153	51
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)CC1	ZINC000853671258	JC	On-Demand	Mild	P2RY12	44	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)CC1	ZINC000853671259	JC	On-Demand	Mild	P2RY12	44	36
CON1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853671261	CD	On-Demand	Bother	SLC6A9	26	48
CON1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853671261	CD	On-Demand	Bother	WDR5	41	48
CON1CCN(c2nccc(C(F)(F)F)n2)CC1	ZINC000853671265	CD	On-Demand	Anodyne	SORD	20	44
COc1ccc(OCc2oc(C)nc2C)cc1C	ZINC000853671272	BG	On-Demand	Anodyne	PPARD	35	47
CON1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000853671284	CD	On-Demand	Bother	WDR5	33	40
CON1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000853671302	BD	On-Demand	Bother	SSTR1	43	41
CON1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000853671309	GC	On-Demand	Bother	CREBBP	42	33
CON1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000853671309	GC	On-Demand	Bother	NOD2	18	41
CON1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1	ZINC000853671309	GC	On-Demand	Bother	BRD9	42	33
CON1CCN(c2cc(-c3cccnc3)nc(C)n2)CC1	ZINC000853671314	CD	On-Demand	Anodyne	CYP11B2	40	38
CON1CCN(c2cc(-c3cccnc3)nc(C)n2)CC1	ZINC000853671314	CD	On-Demand	Anodyne	ROS1	32	41
CCn1ncnc1COc1ccnc2cc(OC)ccc12	ZINC000853671323	CE	On-Demand	Anodyne	PDGFRB	36	42
CCn1ncnc1COc1ccnc2cc(OC)ccc12	ZINC000853671323	CE	On-Demand	Anodyne	CSF1R	15	42
CON1CCN(c2nccc(C)n2)CC1	ZINC000853671333	BC	On-Demand	Anodyne	SORD	41	52
CC(C)(C)C(=O)Nc1cnn(CC2=NS(=O)(=O)c3ccccc32)c1	ZINC000853671339	EE	On-Demand	Anodyne	PANC	52	35
CON1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000853671341	CC	On-Demand	Anodyne	P2RY12	16	53
CON1CCN(c2ncc(C(N)=O)cc2Cl)CC1	ZINC000853671341	CC	On-Demand	Anodyne	CXCR3	27	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OCC(N)=O)cc2)CC1	ZINC000853671347	GC	On-Demand	Anodyne	P2RY12	76	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OCC(N)=O)cc2)CC1	ZINC000853671348	GC	On-Demand	Anodyne	P2RY12	76	38
C=C(Cl)Cn1cc(NC(=O)C(C)(C)C)cn1	ZINC000853671353	BF	On-Demand	Mild	PANC	52	34
CCCn1ncnc1COc1ccnc2cc(OC)ccc12	ZINC000853671354	CF	On-Demand	Anodyne	PDGFRB	30	40
CON1CCN(c2ccc(S(C)(=O)=O)cc2S(C)(=O)=O)CC1	ZINC000853671363	EC	On-Demand	Anodyne	SLC6A9	32	43
CON1CCN(c2ncnc3sc(-c4ccccc4)cc23)CC1	ZINC000853671367	EG	On-Demand	Anodyne	PDGFRB	35	41
NC(=O)COc1ccc(OCCOC(F)F)cc1	ZINC000853671368	CD	On-Demand	Anodyne	PLA2G4B	82	37
CC(C)(C)C(=O)Nc1cnn(Cc2csc(Cl)n2)c1	ZINC000853671385	CG	On-Demand	Anodyne	PANC	57	38
COc1ccc(-c2csc3ncnc(N4CCN(OC)CC4)c23)cc1	ZINC000853671397	FG	On-Demand	Anodyne	ADRB3	17	54
CON1CCN(c2ncnc3ccsc23)CC1	ZINC000853671398	CD	On-Demand	Anodyne	SIRT3	70	33
CON1CCN(c2ncnc3ccsc23)CC1	ZINC000853671398	CD	On-Demand	Anodyne	SIRT2	63	31
CON1CCN(c2ncnc3ccsc23)CC1	ZINC000853671398	CD	On-Demand	Anodyne	SIRT1	54	33
C#CCOCCOc1cccc(C(=O)N(CC)CC)c1	ZINC000853671400	CE	On-Demand	Mild	OPRD1	23	42
C#CCOCCOc1cccc(C(=O)N(CC)CC)c1	ZINC000853671400	CE	On-Demand	Mild	PLA2G4B	26	41
CON1CCN(c2ncnc3n[nH]cc23)CC1	ZINC000853671425	BC	On-Demand	Anodyne	PDGFRB	17	49
C#CCOCCOc1ccc(OCC(N)=O)cc1	ZINC000853671431	BC	On-Demand	Mild	PLA2G4B	75	35
COC[C@@H](COc1ccnc2cc(OC)ccc12)OC	ZINC000853671441	CE	On-Demand	Anodyne	PDGFRB	29	40
COC[C@@H](COc1ccnc2cc(OC)ccc12)OC	ZINC000853671441	CE	On-Demand	Anodyne	FGFR2	41	39
COC[C@@H](COc1ccnc2cc(OC)ccc12)OC	ZINC000853671441	CE	On-Demand	Anodyne	KDR	42	39
COC[C@@H](COc1ccnc2cc(OC)ccc12)OC	ZINC000853671441	CE	On-Demand	Anodyne	PDGFRA	42	37
Cc1nonc1Cn1cc(NC(=O)C(C)(C)C)cn1	ZINC000853671446	CD	On-Demand	Anodyne	PANC	55	36
CON1CCN(c2ccc3nnc(-c4ccccc4)n3n2)CC1	ZINC000853671452	DD	On-Demand	Anodyne	LRRK2	18	48
CON1CCN(c2ccc3nccnc3n2)CC1	ZINC000853671455	BC	On-Demand	Anodyne	SORD	51	37
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	PDGFRB	53	47
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	IGF1R	16	41
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	FGFR2	38	42
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	KDR	77	45
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	MTNR1A	36	42
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	MTNR1B	31	42
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	MET	41	40
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	FLT4	27	42
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	PDGFRA	59	44
COC(=O)C1(COc2ccnc3cc(OC)ccc23)CC1	ZINC000853671457	CF	On-Demand	Anodyne	CSF1R	23	47
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671468	GE	On-Demand	Anodyne	P2RY12	52	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671468	GE	On-Demand	Anodyne	PDGFRB	50	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671468	GE	On-Demand	Anodyne	IGF1R	16	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671468	GE	On-Demand	Anodyne	KDR	57	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671468	GE	On-Demand	Anodyne	MET	41	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671468	GE	On-Demand	Anodyne	PDGFRA	47	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671468	GE	On-Demand	Anodyne	CSF1R	18	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671469	GE	On-Demand	Anodyne	P2RY12	52	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671469	GE	On-Demand	Anodyne	PDGFRB	50	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671469	GE	On-Demand	Anodyne	IGF1R	16	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671469	GE	On-Demand	Anodyne	KDR	57	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671469	GE	On-Demand	Anodyne	MET	41	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671469	GE	On-Demand	Anodyne	PDGFRA	47	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3cc(OC)ccc23)CC1	ZINC000853671469	GE	On-Demand	Anodyne	CSF1R	18	43
CC(C)c1cccc(CONC(=N)CC(=O)N2CCCCC2)c1	ZINC000853671484	DG	On-Demand	Anodyne	TRY2_BOVIN	55	41
CC(C)c1cccc(CONC(=N)CC(=O)N2CCCCC2)c1	ZINC000853671484	DG	On-Demand	Anodyne	DPP7	52	38
CON1CCN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)CC1	ZINC000853671491	ED	On-Demand	Anodyne	HSD11B1	15	40
C#CCCCOc1cccnc1NC1CCN(C2CCC2)CC1	ZINC000853671500	DG	On-Demand	Mild	EHMT2	68	37
CON1CCN(c2cc(Cl)nc(N)n2)CC1	ZINC000853671501	BC	On-Demand	Anodyne	HRH4	54	48
COC(=O)c1ccc([N+](=O)[O-])c(N2CCN(OC)CC2)c1	ZINC000853671505	CD	On-Demand	Bother	TAAR1	22	44
C=C(Cl)COc1cccc(C(=O)N(CC)CC)c1	ZINC000853671507	CG	On-Demand	Mild	DRD4	40	31
C=C(Cl)COc1cccc(C(=O)N(CC)CC)c1	ZINC000853671507	CG	On-Demand	Mild	OPRD1	36	45
C=C(Cl)COc1cccc(C(=O)N(CC)CC)c1	ZINC000853671507	CG	On-Demand	Mild	PLA2G4B	26	42
CC(C)(C)C(=O)Nc1cnn(CCC2SCCS2)c1	ZINC000853671508	CG	On-Demand	Anodyne	PANC	50	32
CON1CCN(c2nc(-c3cccs3)nc3ccccc23)CC1	ZINC000853671510	EG	On-Demand	Anodyne	METAP1	21	41
CON1CCN(c2cc(C(F)(F)F)nc(-c3cccnc3)n2)CC1	ZINC000853671524	EE	On-Demand	Anodyne	ROS1	28	41
CC(C)(C)C(=O)Nc1cnn(CCOC(F)F)c1	ZINC000853671526	CE	On-Demand	Anodyne	PANC	51	34
CON1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853671527	BC	On-Demand	Anodyne	PDGFRB	40	36
CON1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853671527	BC	On-Demand	Anodyne	AKT2	66	68
CON1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853671527	BC	On-Demand	Anodyne	AKT3	37	46
CON1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853671527	BC	On-Demand	Anodyne	JAK3	20	68
CON1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853671527	BC	On-Demand	Anodyne	ROCK2	17	46
CON1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853671527	BC	On-Demand	Anodyne	AKT1	28	50
CON1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853671528	DE	On-Demand	Anodyne	METAP1	28	43
CON1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853671528	DE	On-Demand	Anodyne	PIK3CA	15	40
CON1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853671528	DE	On-Demand	Anodyne	MTOR	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)cn2)CC1	ZINC000853671538	DD	On-Demand	Anodyne	P2RY12	67	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)cn2)CC1	ZINC000853671539	DD	On-Demand	Anodyne	P2RY12	67	37
CON1CCN(c2ncnc3c2oc2ccccc23)CC1	ZINC000853671542	CE	On-Demand	Anodyne	HRH4	21	75
CON1CCN(c2cc(C)nc(-c3ccccn3)n2)CC1	ZINC000853671552	CD	On-Demand	Anodyne	METAP1	39	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)ccc2F)CC1	ZINC000853671564	EE	On-Demand	Anodyne	P2RY12	50	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)ccc2F)CC1	ZINC000853671565	EE	On-Demand	Anodyne	P2RY12	50	38
C#CCOCCOc1ccnc2cc(OC)ccc12	ZINC000853671570	CE	On-Demand	Mild	PDGFRB	26	41
CON1CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC1	ZINC000853671576	DF	On-Demand	Anodyne	HTR3A	16	49
CON1CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC1	ZINC000853671576	DF	On-Demand	Anodyne	PRKCD	22	42
CON1CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC1	ZINC000853671576	DF	On-Demand	Anodyne	PRKCE	20	42
CON1CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC1	ZINC000853671576	DF	On-Demand	Anodyne	PRKCH	23	42
CON1CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC1	ZINC000853671576	DF	On-Demand	Anodyne	PRKCB	26	42
CON1CCN(c2nc(-c3ccccc3)c3ccccc3n2)CC1	ZINC000853671576	DF	On-Demand	Anodyne	PRKCQ	16	42
CON1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000853671585	DD	On-Demand	Anodyne	PRNP	52	37
CON1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000853671585	DD	On-Demand	Anodyne	SCD1	69	59
CON1CCN(c2ccc(C(=O)Nc3ccccc3)nn2)CC1	ZINC000853671585	DD	On-Demand	Anodyne	SCD	50	59
C#CCOCCOc1ccc(C(=O)N(CC)CC)cc1	ZINC000853671590	CE	On-Demand	Mild	OPRD1	22	44
C#CCOCCOc1ccc(C(=O)N(CC)CC)cc1	ZINC000853671590	CE	On-Demand	Mild	PLA2G4B	64	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)c(C)c2)CC1	ZINC000853671597	FE	On-Demand	Anodyne	P2RY12	65	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)c(C)c2)CC1	ZINC000853671598	FE	On-Demand	Anodyne	P2RY12	65	40
C=C(Cl)COc1ccc(O[C@H](C)C(N)=O)cc1	ZINC000853671626	CE	On-Demand	Mild	PLA2G4B	58	35
C=C(Cl)COc1ccc(O[C@@H](C)C(N)=O)cc1	ZINC000853671627	CE	On-Demand	Mild	PLA2G4B	58	35
CCOC(=O)c1nccc(N2CCN(OC)CC2)n1	ZINC000853671662	CC	On-Demand	Anodyne	SORD	90	41
CON1CCN(c2ncnc3cc(Br)sc23)CC1	ZINC000853671667	EE	On-Demand	Anodyne	SIRT3	86	39
CON1CCN(c2ncnc3cc(Br)sc23)CC1	ZINC000853671667	EE	On-Demand	Anodyne	SIRT2	73	39
CON1CCN(c2ncnc3cc(Br)sc23)CC1	ZINC000853671667	EE	On-Demand	Anodyne	SIRT1	63	39
CON1CCN(c2ccc([N+](=O)[O-])cc2Br)CC1	ZINC000853671687	DE	On-Demand	Bother	WDR5	37	41
O=C(Nc1cccc(OCCC2SCCS2)c1)c1cccs1	ZINC000853671693	FJ	On-Demand	Anodyne	NOS1	35	60
O=C(Nc1cccc(OCCC2SCCS2)c1)c1cccs1	ZINC000853671693	FJ	On-Demand	Anodyne	KCNK3	42	50
O=C(Nc1cccc(OCCC2SCCS2)c1)c1cccs1	ZINC000853671693	FJ	On-Demand	Anodyne	KCNK9	40	50
COC[C@@H](COc1ccc(NC(=O)OC(C)(C)C)cc1)OC	ZINC000853671695	DG	On-Demand	Anodyne	ADRB1	18	42
C[C@@H](Oc1ccc(OCCCCC2(C)OCCO2)cc1)C(N)=O	ZINC000853671700	DE	On-Demand	Anodyne	PLA2G4B	68	32
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1(c2ccc(F)cc2)CCC1	ZINC000853671708	GH	On-Demand	Clean	CACNA1G	26	40
N=C(CC(=O)N1CCCCC1)NOCCOCc1ccccc1	ZINC000853671723	DE	On-Demand	Anodyne	PREP	41	41
N=C(CC(=O)N1CCCCC1)NOCCOCc1ccccc1	ZINC000853671723	DE	On-Demand	Anodyne	DPP7	47	40
N=C(CC(=O)N1CCCCC1)NOCCOCc1ccccc1	ZINC000853671723	DE	On-Demand	Anodyne	SLC12A5	58	35
CON1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000853671729	CD	On-Demand	Anodyne	ABCC1	75	40
CON1CCN(c2ncnc3c(F)cccc23)CC1	ZINC000853671729	CD	On-Demand	Anodyne	ABCB1A	41	38
C#CCOCCOc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000853671742	CG	On-Demand	Mild	FAAH	22	41
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2cc(C#N)cnn2)C1	ZINC000853671747	DC	On-Demand	Mild	GPR119	20	43
CON1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853671748	CE	On-Demand	Anodyne	PDE3A	45	44
CON1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853671748	CE	On-Demand	Anodyne	PDGFRB	80	53
CON1CCN(c2ncnc3ccc(C(C)C)cc23)CC1	ZINC000853671748	CE	On-Demand	Anodyne	PDE3B	49	44
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2cnccn2)C1	ZINC000853671785	CC	On-Demand	Anodyne	GPR119	29	48
C#CCOCCOc1ccc(O[C@H](C)C(N)=O)cc1	ZINC000853671798	CC	On-Demand	Mild	PLA2G4B	59	33
C#CCOCCOc1ccc(O[C@@H](C)C(N)=O)cc1	ZINC000853671799	CC	On-Demand	Mild	PLA2G4B	59	33
COc1ccc(-c2nnc(N3CCN(OC)CC3)c3ccccc23)cc1	ZINC000853671845	FF	On-Demand	Anodyne	SMO	53	66
COc1ccc(-c2nccc(N3CCN(OC)CC3)n2)cc1	ZINC000853671851	DD	On-Demand	Anodyne	SORD	67	38
C#CCOCCOc1cccc(NC(=O)OC)c1	ZINC000853671858	BD	On-Demand	Mild	MTNR1B	23	40
C#CCOCCOc1cccc(NC(=O)OC)c1	ZINC000853671858	BD	On-Demand	Mild	EPHX2	18	44
C#CCOCCOc1cccc(NC(=O)OC)c1	ZINC000853671858	BD	On-Demand	Mild	KCNK3	42	35
CON1CCN(c2ncnc3sc([N+](=O)[O-])cc23)CC1	ZINC000853671879	CD	On-Demand	Bother	PDGFRB	19	41
O=C(CN1CCCC1=O)Nc1cccc(OCCC2SCCS2)c1	ZINC000853671886	FF	On-Demand	Anodyne	EPHX2	21	44
CON1CCN(c2ccnc(C#N)n2)CC1	ZINC000853671889	BC	On-Demand	Mild	SORD	73	40
CON1CCN(c2ncnc3ccc(S(C)(=O)=O)cc23)CC1	ZINC000853671908	DC	On-Demand	Anodyne	PDE3A	40	35
CON1CCN(c2ncnc3ccc(S(C)(=O)=O)cc23)CC1	ZINC000853671908	DC	On-Demand	Anodyne	PDGFRB	74	43
CON1CCN(c2ncnc3ccc(S(C)(=O)=O)cc23)CC1	ZINC000853671908	DC	On-Demand	Anodyne	PDE3B	44	35
CCCOc1cccc(CONC(=N)CC(=O)N2CCCCC2)c1	ZINC000853671915	EF	On-Demand	Anodyne	HRH2	56	50
CCCOc1cccc(CONC(=N)CC(=O)N2CCCCC2)c1	ZINC000853671915	EF	On-Demand	Anodyne	HRH3	16	40
CCCOc1cccc(CONC(=N)CC(=O)N2CCCCC2)c1	ZINC000853671915	EF	On-Demand	Anodyne	DPP7	28	40
CON1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000853671925	CD	On-Demand	Bother	PDGFRB	28	41
CON1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000853671925	CD	On-Demand	Bother	ABCC1	17	40
CON1CCN(c2ncnc3cccc([N+](=O)[O-])c23)CC1	ZINC000853671925	CD	On-Demand	Bother	ABCB1A	21	40
CON1CCN(c2ncnc3cc(I)sc23)CC1	ZINC000853671934	GD	On-Demand	Anodyne	SIRT3	86	39
CON1CCN(c2ncnc3cc(I)sc23)CC1	ZINC000853671934	GD	On-Demand	Anodyne	SIRT2	73	39
CON1CCN(c2ncnc3cc(I)sc23)CC1	ZINC000853671934	GD	On-Demand	Anodyne	SIRT1	63	39
O=C(CN1CCCC1=O)Nc1cccc(OCCOC(F)F)c1	ZINC000853671935	ED	On-Demand	Anodyne	EPHX2	22	44
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2ncnc3c2ncn3-c2ccccc2)C1	ZINC000853671936	GE	On-Demand	Anodyne	ADORA1	33	42
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2ncnc3c2ncn3-c2ccccc2)C1	ZINC000853671936	GE	On-Demand	Anodyne	GPR119	28	50
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2cc(C(C)(C)C)ncn2)C1	ZINC000853671944	EE	On-Demand	Anodyne	GPR119	45	38
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2cnc(F)cn2)C1	ZINC000853671952	CD	On-Demand	Anodyne	GPR119	33	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(O[C@@H](C)C(N)=O)cc2)CC1	ZINC000853671955	GD	On-Demand	Anodyne	P2RY12	96	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(O[C@H](C)C(N)=O)cc2)CC1	ZINC000853671956	GD	On-Demand	Anodyne	P2RY12	96	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(O[C@@H](C)C(N)=O)cc2)CC1	ZINC000853671957	GD	On-Demand	Anodyne	P2RY12	96	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(O[C@H](C)C(N)=O)cc2)CC1	ZINC000853671958	GD	On-Demand	Anodyne	P2RY12	96	39
CON1CCN(c2ncnc3cc(F)c(Br)cc23)CC1	ZINC000853671965	EE	On-Demand	Anodyne	PDE3A	42	37
CON1CCN(c2ncnc3cc(F)c(Br)cc23)CC1	ZINC000853671965	EE	On-Demand	Anodyne	PDGFRB	74	45
CON1CCN(c2ncnc3cc(F)c(Br)cc23)CC1	ZINC000853671965	EE	On-Demand	Anodyne	PDE3B	46	37
Cc1n[nH]c(C)c1CCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000853671981	DE	On-Demand	Bother	HAO2	49	32
C[C@@H](Oc1ccc(OCCOC(F)F)cc1)C(N)=O	ZINC000853671982	CD	On-Demand	Anodyne	PLA2G4B	74	34
Cn1nnc2c(N[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)ncnc21	ZINC000853671994	EC	On-Demand	Anodyne	GPR119	26	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(=O)OC)nc2C)CC1	ZINC000853671996	FC	On-Demand	Anodyne	P2RY12	122	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(=O)OC)nc2C)CC1	ZINC000853671997	FC	On-Demand	Anodyne	P2RY12	122	42
C#CCOCCOc1cccc(NC(=O)CN2CCCC2=O)c1	ZINC000853672038	DD	On-Demand	Mild	EPHX2	18	42
O=C(CN1CCCC1=O)Nc1cccc(OCc2csc(Cl)n2)c1	ZINC000853672046	FF	On-Demand	Anodyne	CYSLTR1	15	43
CCOc1cc(N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)nc(C)n1	ZINC000853672052	ED	On-Demand	Anodyne	P2RY12	44	34
CCOc1cc(N[C@@H]2CN(C(=O)OC(C)(C)C)C[C@H]2O)nc(C)n1	ZINC000853672052	ED	On-Demand	Anodyne	GPR119	40	36
CCn1c(=O)c(N2CCN(OC)CC2)nc2ccccc21	ZINC000853672055	CD	On-Demand	Anodyne	HRH1	29	43
CON1CCN(c2nc(C)cc(OCc3ccccc3)n2)CC1	ZINC000853672063	DE	On-Demand	Anodyne	SORD	20	40
C=C(Cl)COc1cccc(NC(=O)CN2CCCC2=O)c1	ZINC000853672071	DE	On-Demand	Mild	EPHX2	20	40
COC[C@@H](COc1cccc(NC(=O)OC)c1)OC	ZINC000853672077	CD	On-Demand	Anodyne	MTNR1B	26	42
COC[C@@H](COc1cccc(NC(=O)OC)c1)OC	ZINC000853672077	CD	On-Demand	Anodyne	TAAR1	32	40
COC[C@@H](COc1cccc(NC(=O)OC)c1)OC	ZINC000853672077	CD	On-Demand	Anodyne	KCNK3	55	36
COC[C@@H](COc1cccc(NC(=O)OC)c1)OC	ZINC000853672077	CD	On-Demand	Anodyne	KCNK9	59	36
COC[C@@H](COc1cccc(NC(=O)OC)c1)OC	ZINC000853672077	CD	On-Demand	Anodyne	PDS	97	47
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2cc(F)ncn2)C1	ZINC000853672089	CD	On-Demand	Anodyne	GPR119	44	36
CON1CCN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)CC1	ZINC000853672103	DC	On-Demand	Bother	SLC6A9	22	44
CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](Nc2ccc([N+](=O)[O-])c(C(N)=O)c2)C1	ZINC000853672106	FD	On-Demand	Bother	GPR119	16	40
Cc1n[nH]c(C)c1CCNc1ccc(F)cc1S(=O)(=O)C(F)(F)F	ZINC000853672107	FG	On-Demand	Anodyne	HAO2	45	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672110	GD	On-Demand	Anodyne	P2RY12	114	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672110	GD	On-Demand	Anodyne	MTNR1B	21	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672110	GD	On-Demand	Anodyne	ST14	30	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672110	GD	On-Demand	Anodyne	KCNK3	41	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672110	GD	On-Demand	Anodyne	KCNK9	43	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672111	GD	On-Demand	Anodyne	P2RY12	114	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672111	GD	On-Demand	Anodyne	MTNR1B	21	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672111	GD	On-Demand	Anodyne	ST14	30	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672111	GD	On-Demand	Anodyne	KCNK3	41	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(NC(=O)OC)c2)CC1	ZINC000853672111	GD	On-Demand	Anodyne	KCNK9	43	34
N=C(CC(=O)N1CCCCC1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853672130	FE	On-Demand	Anodyne	SLC6A1	42	33
N=C(CC(=O)N1CCCCC1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853672130	FE	On-Demand	Anodyne	PREP	40	39
N=C(CC(=O)N1CCCCC1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853672130	FE	On-Demand	Anodyne	L3MBTL3	73	38
N=C(CC(=O)N1CCCCC1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853672131	FE	On-Demand	Anodyne	SLC6A1	42	33
N=C(CC(=O)N1CCCCC1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853672131	FE	On-Demand	Anodyne	PREP	40	39
N=C(CC(=O)N1CCCCC1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853672131	FE	On-Demand	Anodyne	L3MBTL3	73	38
CON1CCN(c2nccc(Oc3ccccc3)n2)CC1	ZINC000853672174	CD	On-Demand	Anodyne	SORD	42	40
COC(=O)c1nccc(N2CCN(OC)CC2)n1	ZINC000853672185	CB	On-Demand	Anodyne	SORD	89	42
Cn1nnc2c(NC[C@@H]3CN(C(=O)OC(C)(C)C)CCCO3)ncnc21	ZINC000853672198	FD	On-Demand	Anodyne	GPR119	19	40
Cn1nnc2c(NC[C@H]3CN(C(=O)OC(C)(C)C)CCCO3)ncnc21	ZINC000853672199	FD	On-Demand	Anodyne	GPR119	19	40
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)c1cccs1	ZINC000853672205	EG	On-Demand	Anodyne	NPR	45	34
O=C(NCCCc1nc[nH]n1)NOCc1ccccc1	ZINC000853672215	CD	On-Demand	Anodyne	HRH2	38	43
O=C(NCCCc1nc[nH]n1)NOCc1ccccc1	ZINC000853672215	CD	On-Demand	Anodyne	CAPNS1	53	36
O=C(NCCCc1nc[nH]n1)NOCc1ccccc1	ZINC000853672215	CD	On-Demand	Anodyne	CAPN1	43	37
O=C(NCCCc1nc[nH]n1)NOCc1ccccc1	ZINC000853672215	CD	On-Demand	Anodyne	CAPN2	76	37
O=C(NCCCc1nc[nH]n1)NOCc1ccccc1	ZINC000853672215	CD	On-Demand	Anodyne	NPR	45	34
N#C[C@@H]1CCCC[C@@H]1NC(=O)NOCc1ccccc1	ZINC000853672216	CE	On-Demand	Mild	CTSK	22	45
N#C[C@@H]1CCCC[C@@H]1NC(=O)NOCc1ccccc1	ZINC000853672216	CE	On-Demand	Mild	CTSL	23	45
N#C[C@H]1CCCC[C@@H]1NC(=O)NOCc1ccccc1	ZINC000853672217	CE	On-Demand	Mild	CTSK	22	45
N#C[C@H]1CCCC[C@@H]1NC(=O)NOCc1ccccc1	ZINC000853672217	CE	On-Demand	Mild	CTSL	23	45
N#C[C@@H]1CCCC[C@H]1NC(=O)NOCc1ccccc1	ZINC000853672218	CE	On-Demand	Mild	CTSK	22	45
N#C[C@@H]1CCCC[C@H]1NC(=O)NOCc1ccccc1	ZINC000853672218	CE	On-Demand	Mild	CTSL	23	45
N#C[C@H]1CCCC[C@H]1NC(=O)NOCc1ccccc1	ZINC000853672219	CE	On-Demand	Mild	CTSK	22	45
N#C[C@H]1CCCC[C@H]1NC(=O)NOCc1ccccc1	ZINC000853672219	CE	On-Demand	Mild	CTSL	23	45
O=C(NOCc1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853672221	EE	On-Demand	Anodyne	GRIN2B	30	40
O=C(NOCc1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853672221	EE	On-Demand	Anodyne	HRH3	19	50
O=C(NOCc1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853672221	EE	On-Demand	Anodyne	PREP	50	42
O=C(NOCc1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853672221	EE	On-Demand	Anodyne	CTSS	23	41
O=C(NOCc1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853672221	EE	On-Demand	Anodyne	L3MBTL3	106	42
O=C(NOCc1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853672222	EE	On-Demand	Anodyne	GRIN2B	30	40
O=C(NOCc1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853672222	EE	On-Demand	Anodyne	HRH3	19	50
O=C(NOCc1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853672222	EE	On-Demand	Anodyne	PREP	50	42
O=C(NOCc1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853672222	EE	On-Demand	Anodyne	CTSS	23	41
O=C(NOCc1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853672222	EE	On-Demand	Anodyne	L3MBTL3	106	42
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NOCc2ccccc2)C3)cn1	ZINC000853672223	FE	On-Demand	Anodyne	P2RY14	40	33
O=C(NOCc1ccccc1)N(CCOCCO)C1CCC1	ZINC000853672233	DD	On-Demand	Anodyne	AMY2	43	29
CN1C[C@@H](CNC(=O)NOCc2ccccc2)CC1=O	ZINC000853672266	CC	On-Demand	Anodyne	NAAA	46	39
CN1C[C@H](CNC(=O)NOCc2ccccc2)CC1=O	ZINC000853672267	CC	On-Demand	Anodyne	NAAA	46	39
COc1ccc(OCc2oc(C)nc2C)cc1OC	ZINC000853672270	CF	On-Demand	Anodyne	PPARD	16	40
O=C(NOCc1ccccc1)N[C@@H](c1ccncc1)C1(CO)CCC1	ZINC000853672271	EF	On-Demand	Anodyne	SLC12A5	45	32
O=C(NOCc1ccccc1)N[C@H](c1ccncc1)C1(CO)CCC1	ZINC000853672272	EF	On-Demand	Anodyne	SLC12A5	45	32
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@H](c1cccs1)C(C)(C)CO	ZINC000853672296	GG	On-Demand	Anodyne	PAPA1_CARPA	26	41
CC(C)(C)OC(=O)NCCCNC(=O)N[C@H](c1cccs1)C(C)(C)CO	ZINC000853672297	GG	On-Demand	Anodyne	PAPA1_CARPA	26	41
COc1cccc(C2(NC(=O)NCCCNC(=O)OC(C)(C)C)CCC2)c1	ZINC000853672324	GG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2(NC(=O)NCCCNC(=O)OC(C)(C)C)CCC2)c1	ZINC000853672324	GG	On-Demand	Anodyne	HRH2	18	40
CC(C)(C)OC(=O)NCCCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853672338	FF	On-Demand	Anodyne	CHRM3	26	44
CC(C)(C)OC(=O)NCCCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853672338	FF	On-Demand	Anodyne	EPHX2	27	46
COC(=O)C1(COc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000853672366	CF	On-Demand	Bother	CACNA1D	52	38
O=C1CC[C@@H](CNC(=O)NOCc2ccccc2)N1	ZINC000853672394	CC	On-Demand	Anodyne	CAPNS1	42	34
O=C1CC[C@@H](CNC(=O)NOCc2ccccc2)N1	ZINC000853672394	CC	On-Demand	Anodyne	CAPN2	56	35
C#CCOCCOc1cc(Cl)ccc1C(=O)NCCCC	ZINC000853672397	DF	On-Demand	Mild	FOLH1	22	44
CC(=O)Nc1ccc(OCCO[Si](C)(C)C(C)(C)C)c(F)c1	ZINC000853672398	EI	On-Demand	Reactive	MET	56	37
O=C(NOCc1ccccc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853672411	GF	On-Demand	Anodyne	HTR1A	20	42
O=C(NOCc1ccccc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853672411	GF	On-Demand	Anodyne	HTR7	23	40
O=C(NOCc1ccccc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853672411	GF	On-Demand	Anodyne	SLC12A5	74	39
C=CCOc1ccc(O[C@@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853672412	FE	On-Demand	Mild	P2RY12	53	39
C=CCOc1ccc(O[C@H](C)C(=O)N2CCN(C(=O)OCC)CC2)cc1	ZINC000853672413	FE	On-Demand	Mild	P2RY12	53	39
CS(=O)(=O)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000853672422	CC	On-Demand	Anodyne	CTSK	32	40
CS(=O)(=O)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000853672422	CC	On-Demand	Anodyne	CTSL	34	40
CS(=O)(=O)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000853672422	CC	On-Demand	Anodyne	CAPNS1	52	36
CS(=O)(=O)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000853672422	CC	On-Demand	Anodyne	CAPN1	53	39
CS(=O)(=O)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000853672422	CC	On-Demand	Anodyne	CAPN2	54	33
CS(=O)(=O)C1CN(C(=O)NOCc2ccccc2)C1	ZINC000853672422	CC	On-Demand	Anodyne	SLC12A5	53	34
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(C(=O)NOCc2ccccc2)C1	ZINC000853672427	FF	On-Demand	Anodyne	RBP4	42	33
O=C1CCCN1C[C@@H]1CCN(C(=O)NOCc2ccccc2)C1	ZINC000853672432	DD	On-Demand	Anodyne	ACHE	15	44
O=C1CCCN1C[C@@H]1CCN(C(=O)NOCc2ccccc2)C1	ZINC000853672432	DD	On-Demand	Anodyne	GRIN2B	49	43
O=C1CCCN1C[C@H]1CCN(C(=O)NOCc2ccccc2)C1	ZINC000853672433	DD	On-Demand	Anodyne	ACHE	15	44
O=C1CCCN1C[C@H]1CCN(C(=O)NOCc2ccccc2)C1	ZINC000853672433	DD	On-Demand	Anodyne	GRIN2B	49	43
O=C(NOCc1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853672439	FG	On-Demand	Anodyne	CPT1A	78	40
O=C(NOCc1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853672439	FG	On-Demand	Anodyne	PREP	65	38
O=C(NOCc1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853672440	FG	On-Demand	Anodyne	CPT1A	78	40
O=C(NOCc1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853672440	FG	On-Demand	Anodyne	PREP	65	38
COC(=O)[C@@H]1C[C@@H](NC(=O)NOCc2ccccc2)C1	ZINC000853672442	CD	On-Demand	Anodyne	EPHX2	17	50
COC(=O)[C@@H]1C[C@@H](NC(=O)NOCc2ccccc2)C1	ZINC000853672442	CD	On-Demand	Anodyne	NAAA	38	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NOCc2ccccc2)C1	ZINC000853672442	CD	On-Demand	Anodyne	SLC12A5	65	36
O=C(NC[C@@H](CO)CC1CC1)NOCc1ccccc1	ZINC000853672471	CD	On-Demand	Anodyne	KLK3	52	34
O=C(NC[C@@H](CO)CC1CC1)NOCc1ccccc1	ZINC000853672471	CD	On-Demand	Anodyne	CAPN2	49	34
O=C(NC[C@@H](CO)CC1CC1)NOCc1ccccc1	ZINC000853672471	CD	On-Demand	Anodyne	NPR	40	32
O=C(NC[C@H](CO)CC1CC1)NOCc1ccccc1	ZINC000853672472	CD	On-Demand	Anodyne	KLK3	52	34
O=C(NC[C@H](CO)CC1CC1)NOCc1ccccc1	ZINC000853672472	CD	On-Demand	Anodyne	CAPN2	49	34
O=C(NC[C@H](CO)CC1CC1)NOCc1ccccc1	ZINC000853672472	CD	On-Demand	Anodyne	NPR	40	32
C=Cc1cc(OC)c(OCCOCc2ccccc2)c(OC)c1	ZINC000853672517	DH	On-Demand	Anodyne	ADCYAP1R1	26	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000853672524	GE	On-Demand	Bother	P2RY12	43	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000853672524	GE	On-Demand	Bother	CACNA1D	56	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000853672525	GE	On-Demand	Bother	P2RY12	43	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000853672525	GE	On-Demand	Bother	CACNA1D	56	36
CC(C)(C)OC(=O)NCCCNC(=O)N1CC[C@@H](CN2CCCC2=O)C1	ZINC000853672546	FD	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)NCCCNC(=O)N1CC[C@H](CN2CCCC2=O)C1	ZINC000853672547	FD	On-Demand	Anodyne	GPR119	19	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OCCO)cc2)CC1	ZINC000853672580	FD	On-Demand	Anodyne	P2RY12	114	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OCCO)cc2)CC1	ZINC000853672581	FD	On-Demand	Anodyne	P2RY12	114	46
CC(C)(C)OC(=O)NCCCNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853672593	FG	On-Demand	Mild	IMDH_CRYPV	51	33
COC(=O)c1cnc([C@H]2CCCN(C(=O)NOCc3ccccc3)C2)s1	ZINC000853672603	GF	On-Demand	Anodyne	PREP	49	39
COC(=O)c1cnc([C@@H]2CCCN(C(=O)NOCc3ccccc3)C2)s1	ZINC000853672604	GF	On-Demand	Anodyne	PREP	49	39
O=C(NCC1CCC(O)CC1)NOCc1ccccc1	ZINC000853672624	CD	On-Demand	Anodyne	GRIN2B	34	40
O=C(NCC1CCC(O)CC1)NOCc1ccccc1	ZINC000853672624	CD	On-Demand	Anodyne	CAPN2	41	39
O=C(NCC1CCC(O)CC1)NOCc1ccccc1	ZINC000853672624	CD	On-Demand	Anodyne	NPR	40	32
O=C(NCC1CCC(O)CC1)NOCc1ccccc1	ZINC000853672624	CD	On-Demand	Anodyne	VCP	56	34
O=C(NCC1CCC(O)CC1)NOCc1ccccc1	ZINC000853672624	CD	On-Demand	Anodyne	SLC12A5	50	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000853672636	EE	On-Demand	Anodyne	PREP	56	39
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NOCc2ccccc2)C1	ZINC000853672637	EE	On-Demand	Anodyne	PREP	56	39
COc1cccc(C2(NC(=O)NOCc3ccccc3)CCC2)c1	ZINC000853672643	EH	On-Demand	Anodyne	SLC12A5	61	37
C=CCC1(NC(=O)NOCc2ccccc2)CCCC1	ZINC000853672649	CG	On-Demand	Mild	SLC12A5	64	37
CC(C)(C)OC(=O)N1CCCO[C@H](CNc2nc3ccc(N)cc3s2)C1	ZINC000853672653	GG	On-Demand	Anodyne	LCK	22	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNc2nc3ccc(N)cc3s2)C1	ZINC000853672654	GG	On-Demand	Anodyne	LCK	22	40
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	ACE	40	47
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	FKBP1A	46	43
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	CELA1	20	43
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	CTSB	20	42
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	CTSK	24	42
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	CTSL	30	42
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	PREP	49	43
O=C(NOCc1ccccc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853672655	CF	On-Demand	Anodyne	SLC12A5	71	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(C)=O)cc2F)CC1	ZINC000853672657	GD	On-Demand	Anodyne	P2RY12	61	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(C)=O)cc2F)CC1	ZINC000853672657	GD	On-Demand	Anodyne	MET	40	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(C)=O)cc2F)CC1	ZINC000853672658	GD	On-Demand	Anodyne	P2RY12	61	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(C)=O)cc2F)CC1	ZINC000853672658	GD	On-Demand	Anodyne	MET	40	35
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	KLK3	76	33
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CTSB	65	41
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	PAPA1_CARPA	69	39
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CTSK	40	42
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CTSL	30	42
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CHRNA4	22	56
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CAPNS1	65	40
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CTSS	16	41
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CAPN1	82	42
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	CAPN2	121	42
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	LAP3	18	43
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	NPR	85	49
C[C@@H](CCNC(=O)NOCc1ccccc1)N(C)C	ZINC000853672683	CD	On-Demand	Anodyne	PDS	50	35
O=C(NOCc1ccccc1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853672689	CD	On-Demand	Anodyne	GHRHR	59	35
O=C(NOCc1ccccc1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853672689	CD	On-Demand	Anodyne	SLC12A5	65	37
CCN1CCC[C@H](CN(C)C(=O)NOCc2ccccc2)[C@H]1c1cnn(C)c1	ZINC000853672693	GF	On-Demand	Anodyne	PREP	40	35
C#CCOCCONC(=N)COc1cccc(C(=O)OC)c1	ZINC000853672707	DD	On-Demand	Mild	ACR	15	41
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@H](c1cccs1)C1(CO)CCC1	ZINC000853672753	GG	On-Demand	Anodyne	PAPA1_CARPA	26	40
CC(C)(C)OC(=O)NCCCNC(=O)N[C@H](c1cccs1)C1(CO)CCC1	ZINC000853672754	GG	On-Demand	Anodyne	PAPA1_CARPA	26	40
CC(C)(C)OC(=O)NCCCNC(=O)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853672777	ED	On-Demand	Anodyne	EPHX2	20	41
CC(C)(C)OC(=O)NCCCNC(=O)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853672778	ED	On-Demand	Anodyne	EPHX2	20	41
CCN1CCC[C@H](CN(C)C(=O)NOCc2ccccc2)[C@@H]1c1cnn(C)c1	ZINC000853672794	GF	On-Demand	Anodyne	PREP	40	35
O=C(NOCc1ccccc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853672795	EF	On-Demand	Anodyne	SLC6A3	21	44
O=C(NOCc1ccccc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853672795	EF	On-Demand	Anodyne	GRIN2B	34	42
O=C(NOCc1ccccc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853672795	EF	On-Demand	Anodyne	CCR5	31	43
O=C(NOCc1ccccc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853672795	EF	On-Demand	Anodyne	EPHX2	22	40
O=C(NOCc1ccccc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853672795	EF	On-Demand	Anodyne	KDM1A	21	40
CC(=O)Nc1ccc(OCCOC(F)F)c(F)c1	ZINC000853672796	CE	On-Demand	Anodyne	MET	41	37
O=C(NOCc1ccccc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853672805	CD	On-Demand	Anodyne	GRIN2B	36	40
O=C(NOCc1ccccc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853672805	CD	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NOCc1ccccc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853672805	CD	On-Demand	Anodyne	EPHX2	16	40
O=C(NOCc1ccccc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853672805	CD	On-Demand	Anodyne	SLC12A5	68	37
O=C(NOCc1ccccc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853672806	CD	On-Demand	Anodyne	GRIN2B	36	40
O=C(NOCc1ccccc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853672806	CD	On-Demand	Anodyne	SIGMAR1	15	41
O=C(NOCc1ccccc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853672806	CD	On-Demand	Anodyne	EPHX2	16	40
O=C(NOCc1ccccc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853672806	CD	On-Demand	Anodyne	SLC12A5	68	37
CC(=O)Nc1ccc(OCCCCC2(C)OCCO2)c(F)c1	ZINC000853672812	DG	On-Demand	Anodyne	MET	40	36
O=C(NOCc1ccccc1)N[C@@H]1C[C@@H](N2CCOCC2)C12CCC2	ZINC000853672813	EE	On-Demand	Anodyne	SLC12A5	58	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2NC(=O)OC)CC1	ZINC000853672822	GD	On-Demand	Anodyne	P2RY12	117	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2NC(=O)OC)CC1	ZINC000853672823	GD	On-Demand	Anodyne	P2RY12	117	41
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	MME	49	38
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	KLK3	53	30
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	CTSB	50	41
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	PAPA1_CARPA	45	36
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	CTSK	27	41
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	CTSL	25	41
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	CAPNS1	58	40
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	CAPN1	75	40
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	CAPN2	106	40
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	ACE2	44	38
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	NPR	87	41
CC[C@H](C)N(CC)C(=O)NOCc1ccccc1	ZINC000853672835	CF	On-Demand	Anodyne	PDS	47	34
O=C(NOCc1ccccc1)N(CCC1CC1)CC1CC1	ZINC000853672844	CG	On-Demand	Anodyne	ACHE	25	44
O=C(NCC1(O)CCC(F)(F)CC1)NOCc1ccccc1	ZINC000853672856	DE	On-Demand	Anodyne	CTSK	18	42
O=C(NCC1(O)CCC(F)(F)CC1)NOCc1ccccc1	ZINC000853672856	DE	On-Demand	Anodyne	CAPNS1	44	35
O=C(NCC1(O)CCC(F)(F)CC1)NOCc1ccccc1	ZINC000853672856	DE	On-Demand	Anodyne	CAPN2	56	33
O=C(NCC1(O)CCC(F)(F)CC1)NOCc1ccccc1	ZINC000853672856	DE	On-Demand	Anodyne	NPR	51	33
O=C(NCC1(O)CCC(F)(F)CC1)NOCc1ccccc1	ZINC000853672856	DE	On-Demand	Anodyne	SLC12A5	51	34
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NOCc1ccccc1	ZINC000853672859	CE	On-Demand	Anodyne	FKBP1A	17	41
CCn1c(O)nnc1C1CCN(C(=O)NOCc2ccccc2)CC1	ZINC000853672860	EE	On-Demand	Anodyne	GRIN2B	40	40
O=C(NOCc1ccccc1)N1CCC2(COC2)C1	ZINC000853672874	CD	On-Demand	Anodyne	SLC12A5	73	41
O=C(NOCc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853672875	DE	On-Demand	Anodyne	FKBP1A	47	43
O=C(NOCc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853672875	DE	On-Demand	Anodyne	OPRM1	15	43
O=C(NOCc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853672875	DE	On-Demand	Anodyne	CELA1	19	41
O=C(NOCc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853672875	DE	On-Demand	Anodyne	CPT1A	123	41
O=C(NOCc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853672875	DE	On-Demand	Anodyne	PREP	59	43
O=C(NOCc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853672875	DE	On-Demand	Anodyne	SLC12A5	40	36
O=C(NOCc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853672876	DE	On-Demand	Anodyne	FKBP1A	47	43
O=C(NOCc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853672876	DE	On-Demand	Anodyne	OPRM1	15	43
O=C(NOCc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853672876	DE	On-Demand	Anodyne	CELA1	19	41
O=C(NOCc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853672876	DE	On-Demand	Anodyne	CPT1A	123	41
O=C(NOCc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853672876	DE	On-Demand	Anodyne	PREP	59	43
O=C(NOCc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853672876	DE	On-Demand	Anodyne	SLC12A5	40	36
C=Cc1cc(OC)c(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c(OC)c1	ZINC000853672896	FH	On-Demand	Anodyne	ACKR3	72	39
C=Cc1cc(OC)c(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c(OC)c1	ZINC000853672897	FH	On-Demand	Anodyne	ACKR3	72	39
COCC1(NC(=O)NCCCNC(=O)OC(C)(C)C)CCCC1	ZINC000853672923	EE	On-Demand	Anodyne	EPHX2	16	43
CC(C)(C)OC(=O)N1CCCO[C@H](CNc2cc(C#N)cnn2)C1	ZINC000853672999	ED	On-Demand	Mild	GPR119	27	41
CC(C)(C)OC(=O)N1CCCO[C@@H](CNc2cc(C#N)cnn2)C1	ZINC000853673000	ED	On-Demand	Mild	GPR119	27	41
O=C(NOCc1ccccc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853673005	DD	On-Demand	Anodyne	SLC6A5	17	41
O=C(NOCc1ccccc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853673005	DD	On-Demand	Anodyne	SLC12A5	57	37
O=C(NOCc1ccccc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853673005	DD	On-Demand	Anodyne	L3MBTL3	56	37
O=C(NOCc1ccccc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853673006	DD	On-Demand	Anodyne	SLC6A5	17	41
O=C(NOCc1ccccc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853673006	DD	On-Demand	Anodyne	SLC12A5	57	37
O=C(NOCc1ccccc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853673006	DD	On-Demand	Anodyne	L3MBTL3	56	37
O=C(NOCc1ccccc1)N1CCC(CO)(CO)C1	ZINC000853673022	CC	On-Demand	Anodyne	SLC12A5	76	41
O=C(NOCc1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853673024	DF	On-Demand	Anodyne	KCNH2	39	40
O=C(NOCc1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853673024	DF	On-Demand	Anodyne	CHRM3	21	45
O=C(NOCc1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853673024	DF	On-Demand	Anodyne	GRIN2B	52	43
O=C(NOCc1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853673024	DF	On-Demand	Anodyne	PRSS2	48	35
O=C(NOCc1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853673024	DF	On-Demand	Anodyne	CTSL	15	40
O=C(NOCc1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853673024	DF	On-Demand	Anodyne	EPHX2	32	49
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	FKBP1A	38	43
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	CELA1	24	43
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	CTRA_BOVIN	52	31
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	TRY1_BOVIN	43	31
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	PREP	67	43
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	CELA2A	47	31
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	LGMN	63	40
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@H]1CCO	ZINC000853673036	CE	On-Demand	Anodyne	SLC12A5	52	34
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	FKBP1A	38	43
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	CELA1	24	43
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	CTRA_BOVIN	52	31
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	TRY1_BOVIN	43	31
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	PREP	67	43
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	CELA2A	47	31
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	LGMN	63	40
C[C@@H]1CCCN(C(=O)NOCc2ccccc2)[C@@H]1CCO	ZINC000853673037	CE	On-Demand	Anodyne	SLC12A5	52	34
O=C(NC/C=C\CO)NOCc1ccccc1	ZINC000853673049	BC	On-Demand	Anodyne	KLK3	40	31
O=C(NC/C=C\CO)NOCc1ccccc1	ZINC000853673049	BC	On-Demand	Anodyne	CAPNS1	43	36
O=C(NC/C=C\CO)NOCc1ccccc1	ZINC000853673049	BC	On-Demand	Anodyne	CAPN1	40	40
O=C(NC/C=C\CO)NOCc1ccccc1	ZINC000853673049	BC	On-Demand	Anodyne	CAPN2	56	33
O=C(NC/C=C\CO)NOCc1ccccc1	ZINC000853673049	BC	On-Demand	Anodyne	NPR	52	33
O=C(NC/C=C/CO)NOCc1ccccc1	ZINC000853673050	BC	On-Demand	Anodyne	KLK3	40	31
O=C(NC/C=C/CO)NOCc1ccccc1	ZINC000853673050	BC	On-Demand	Anodyne	CAPNS1	43	36
O=C(NC/C=C/CO)NOCc1ccccc1	ZINC000853673050	BC	On-Demand	Anodyne	CAPN1	40	40
O=C(NC/C=C/CO)NOCc1ccccc1	ZINC000853673050	BC	On-Demand	Anodyne	CAPN2	56	33
O=C(NC/C=C/CO)NOCc1ccccc1	ZINC000853673050	BC	On-Demand	Anodyne	NPR	52	33
C#CCN(CC(=O)OC(C)(C)C)C(=O)NOCc1ccccc1	ZINC000853673060	DE	On-Demand	Mild	CTSB	35	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	CHRM2	24	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	DRD2	18	44
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	DRD4	48	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	ACHE	36	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	HRH2	15	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	OPRK1	25	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	LTA4H	23	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	SIGMAR1	60	51
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	CCR3	37	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	CCR5	22	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	MCHR1	25	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	NPFFR1	44	36
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	SLC12A5	65	37
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673061	FE	On-Demand	Anodyne	TMPRSS11D	40	33
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	CHRM2	24	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	DRD2	18	44
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	DRD4	48	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	ACHE	36	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	HRH2	15	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	OPRK1	25	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	LTA4H	23	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	SIGMAR1	60	51
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	CCR3	37	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	CCR5	22	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	MCHR1	25	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	NPFFR1	44	36
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	SLC12A5	65	37
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOCc1ccccc1	ZINC000853673062	FE	On-Demand	Anodyne	TMPRSS11D	40	33
C[C@@H]1CN(C(=O)NOCc2ccccc2)C[C@@H](C)C1O	ZINC000853673092	CD	On-Demand	Anodyne	NAAA	53	40
C[C@@H]1CN(C(=O)NOCc2ccccc2)C[C@@H](C)C1O	ZINC000853673092	CD	On-Demand	Anodyne	SLC12A5	49	34
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@]1(C)CC1(C)C	ZINC000853673145	CE	On-Demand	Anodyne	EPHX2	15	44
CC(C)(C)OC(=O)NCCCNC(=O)N[C@]1(C)CC1(C)C	ZINC000853673146	CE	On-Demand	Anodyne	EPHX2	15	44
C=C(Cl)COc1ccc(OCCO)cc1	ZINC000853673186	BE	On-Demand	Mild	PLA2G4B	44	32
C[C@@H](CCNC(=O)NCCCNC(=O)OC(C)(C)C)N(C)C	ZINC000853673240	DD	On-Demand	Anodyne	CTSK	15	44
C[C@@H](CCNC(=O)NCCCNC(=O)OC(C)(C)C)N(C)C	ZINC000853673240	DD	On-Demand	Anodyne	CHRNA4	21	47
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	MME	29	42
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	CTSB	24	41
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	PAPA1_CARPA	49	45
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	CCKAR	44	37
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	CTSL	18	45
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	TACR3	19	48
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	NPY5R	17	42
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	FPR1	50	43
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853673261	FE	On-Demand	Anodyne	NPFFR1	45	31
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	MME	29	42
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	CTSB	24	41
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	PAPA1_CARPA	49	45
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	CCKAR	44	37
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	CTSL	18	45
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	TACR3	19	48
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	NPY5R	17	42
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	FPR1	50	43
CN(C(=O)NCCCNC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853673263	FE	On-Demand	Anodyne	NPFFR1	45	31
CC(=O)Nc1ccc(OCc2oc(C)nc2C)c(F)c1	ZINC000853673303	CF	On-Demand	Anodyne	TSHR	42	33
CC(=O)Nc1ccc(OCc2oc(C)nc2C)c(F)c1	ZINC000853673303	CF	On-Demand	Anodyne	MET	50	38
COCC1(NC(=O)NOCc2ccccc2)CCCC1	ZINC000853673311	CE	On-Demand	Anodyne	SLC12A5	76	45
CO[C@]1(CO)CCCN(C(=O)NOCc2ccccc2)C1	ZINC000853673315	CD	On-Demand	Anodyne	SLC12A5	83	47
Cn1c(S)nnc1CCNC(=O)NOCc1ccccc1	ZINC000853673330	DD	On-Demand	Anodyne	CAPN2	49	33
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	NA	25	46
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	CTSB	17	40
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	CTSK	18	42
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	CTSL	24	40
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	EPHX2	17	56
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	NAAA	51	42
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	KDM1A	16	40
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853673331	BC	On-Demand	Anodyne	SLC12A5	67	37
O=C(NOCc1ccccc1)N(CCN1CCOCC1)CC1CC1	ZINC000853673336	ED	On-Demand	Anodyne	CASR	61	49
O=C(NOCc1ccccc1)N(CCN1CCOCC1)CC1CC1	ZINC000853673336	ED	On-Demand	Anodyne	SIGMAR1	32	40
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	CHRM2	16	44
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	CHRM1	21	44
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	OPRM1	18	40
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	CHRM4	18	44
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	CHRM5	39	44
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	CHRM3	19	44
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	CCR5	72	51
CCN1CC[C@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673337	CE	On-Demand	Anodyne	SLC12A5	47	33
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	CHRM2	16	44
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	CHRM1	21	44
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	OPRM1	18	40
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	CHRM4	18	44
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	CHRM5	39	44
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	CHRM3	19	44
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	CCR5	72	51
CCN1CC[C@@H](N(CC)C(=O)NOCc2ccccc2)C1	ZINC000853673338	CE	On-Demand	Anodyne	SLC12A5	47	33
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	GHRHR	48	34
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	MME	61	35
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	PGC	42	33
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	KLK3	49	33
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CTSB	52	40
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	PAPA1_CARPA	60	37
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CYSP_TRYCR	53	39
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CTSL	47	39
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	TIMP3	74	35
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CTRB1	43	37
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	AMY2	43	29
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CAPNS1	62	40
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	REN	44	35
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CAPN1	82	40
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CAPN2	89	38
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	ACE2	44	34
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	FPR1	40	36
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	CTRB_BOVIN	54	32
CC(C)(CO)[C@H](NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673340	CE	On-Demand	Anodyne	NPR	65	34
COCc1n[nH]c(CNC(=O)NOCc2ccccc2)n1	ZINC000853673341	CC	On-Demand	Anodyne	CAPNS1	53	36
COCc1n[nH]c(CNC(=O)NOCc2ccccc2)n1	ZINC000853673341	CC	On-Demand	Anodyne	CAPN2	58	34
COCc1n[nH]c(CNC(=O)NOCc2ccccc2)n1	ZINC000853673341	CC	On-Demand	Anodyne	NPR	49	32
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NOCc2ccccc2)C1	ZINC000853673342	EF	On-Demand	Anodyne	SLC12A5	61	37
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NOCc2ccccc2)C1	ZINC000853673343	EF	On-Demand	Anodyne	SLC12A5	61	37
O=C(NOCc1ccccc1)N1CCC(O)(CO)CC1	ZINC000853673350	CC	On-Demand	Anodyne	GHRHR	50	34
O=C(NOCc1ccccc1)N1CCC(O)(CO)CC1	ZINC000853673350	CC	On-Demand	Anodyne	SLC12A5	73	39
O=C(NOCc1ccccc1)N1CCC[C@H](c2nnc(S)n2C2CC2)C1	ZINC000853673355	FF	On-Demand	Anodyne	PREP	57	38
O=C(NOCc1ccccc1)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1	ZINC000853673356	FF	On-Demand	Anodyne	PREP	57	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)c(OC)c2)CC1	ZINC000853673357	FD	On-Demand	Anodyne	P2RY12	74	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)c(OC)c2)CC1	ZINC000853673357	FD	On-Demand	Anodyne	MTNR1B	23	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)c(OC)c2)CC1	ZINC000853673358	FD	On-Demand	Anodyne	P2RY12	74	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)c(OC)c2)CC1	ZINC000853673358	FD	On-Demand	Anodyne	MTNR1B	23	40
CC(C)(C)OC(=O)N1CCCO[C@@H](CNc2cc(C(C)(C)C)ncn2)C1	ZINC000853673362	FG	On-Demand	Anodyne	GPR119	44	38
CC(C)(C)OC(=O)N1CCCO[C@H](CNc2cc(C(C)(C)C)ncn2)C1	ZINC000853673363	FG	On-Demand	Anodyne	GPR119	44	38
CC(=O)Nc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c(F)c1	ZINC000853673367	FF	On-Demand	Anodyne	F13A1	15	41
CC(=O)Nc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c(F)c1	ZINC000853673368	FF	On-Demand	Anodyne	F13A1	15	41
O=C(NOCc1ccccc1)N1CC[C@H](Cn2ccnn2)C1	ZINC000853673369	DD	On-Demand	Anodyne	GRIN2B	46	45
O=C(NOCc1ccccc1)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853673370	DD	On-Demand	Anodyne	GRIN2B	46	45
CC[C@@](C)(NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673374	CF	On-Demand	Anodyne	FKBP1A	24	40
CC[C@@](C)(NC(=O)NOCc1ccccc1)C1CC1	ZINC000853673374	CF	On-Demand	Anodyne	AMY2	55	33
O=C(NCC(O)(C1CC1)C1CC1)NOCc1ccccc1	ZINC000853673378	CD	On-Demand	Anodyne	CAPNS1	42	34
N=C(CC1CC1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853673390	DE	On-Demand	Anodyne	L3MBTL3	46	35
N=C(CC1CC1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853673391	DE	On-Demand	Anodyne	L3MBTL3	46	35
CC(C)(C)OC(=O)NCCCNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853673510	GF	On-Demand	Anodyne	SLC6A3	16	42
CC(C)(C)OC(=O)NCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853673525	FD	On-Demand	Anodyne	CPT1A	55	33
CC(C)(C)OC(=O)NCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853673526	FD	On-Demand	Anodyne	CPT1A	55	33
CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1NCCNC(=O)OC	ZINC000853673540	FD	On-Demand	Bother	TBXA2R	25	40
Cn1cncc1CCOc1cc([N+](=O)[O-])ccc1Cl	ZINC000853673598	CF	On-Demand	Bother	SNCA	44	33
CC(C)(C)OC(=O)NCCCNC(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853673604	EF	On-Demand	Anodyne	NQO2	20	44
CC(C)(C)OC(=O)NCCCNC(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853673605	EF	On-Demand	Anodyne	NQO2	20	44
CON(C)CCNC(=O)NOCc1ccccc1	ZINC000853673642	CC	On-Demand	Anodyne	CTSB	49	37
CON(C)CCNC(=O)NOCc1ccccc1	ZINC000853673642	CC	On-Demand	Anodyne	CTSK	19	42
CON(C)CCNC(=O)NOCc1ccccc1	ZINC000853673642	CC	On-Demand	Anodyne	CAPNS1	55	37
CON(C)CCNC(=O)NOCc1ccccc1	ZINC000853673642	CC	On-Demand	Anodyne	CAPN1	50	40
CON(C)CCNC(=O)NOCc1ccccc1	ZINC000853673642	CC	On-Demand	Anodyne	CAPN2	76	36
CON(C)CCNC(=O)NOCc1ccccc1	ZINC000853673642	CC	On-Demand	Anodyne	NPR	72	38
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)CC2CC2)CC1	ZINC000853673659	FE	On-Demand	Anodyne	DRD4	25	55
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)CC2CC2)CC1	ZINC000853673659	FE	On-Demand	Anodyne	SIGMAR1	22	47
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	PTGER3	23	41
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	CTSB	43	40
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	PAPA1_CARPA	46	34
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	ROCK1	16	40
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	CAPNS1	53	36
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	MTNR1A	38	41
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	MTNR1B	40	41
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	CAPN1	58	43
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	CAPN2	67	40
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	FFAR1	23	40
COC[C@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673666	EF	On-Demand	Anodyne	PDS	55	40
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	PTGER3	23	41
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	CTSB	43	40
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	PAPA1_CARPA	46	34
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	ROCK1	16	40
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	CAPNS1	53	36
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	MTNR1A	38	41
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	MTNR1B	40	41
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	CAPN1	58	43
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	CAPN2	67	40
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	FFAR1	23	40
COC[C@@H](NC(=O)NOCc1ccccc1)c1cccc(OC)c1	ZINC000853673667	EF	On-Demand	Anodyne	PDS	55	40
CC(=O)Nc1ccc(OCc2nonc2C)c(F)c1	ZINC000853673673	CE	On-Demand	Anodyne	MET	48	36
CC(C)(C)OC(=O)NC1(CNC(=O)NOCc2ccccc2)CCCC1	ZINC000853673674	FG	On-Demand	Anodyne	CTSK	19	43
CC(C)(C)OC(=O)NC1(CNC(=O)NOCc2ccccc2)CCCC1	ZINC000853673674	FG	On-Demand	Anodyne	CTSL	15	41
CC(C)(C)OC(=O)NC1(CNC(=O)NOCc2ccccc2)CCCC1	ZINC000853673674	FG	On-Demand	Anodyne	SLC12A5	64	35
CC(C)c1ccc2ncnc(N(C)Cc3csc(C(C)(C)O)n3)c2c1	ZINC000853673683	FI	On-Demand	Anodyne	CLK1	16	46
CC(C)c1ccc2ncnc(N(C)Cc3csc(C(C)(C)O)n3)c2c1	ZINC000853673683	FI	On-Demand	Anodyne	CLK2	18	46
CC(C)c1ccc2ncnc(N(C)Cc3csc(C(C)(C)O)n3)c2c1	ZINC000853673683	FI	On-Demand	Anodyne	CLK4	24	46
O=C(NOCc1ccccc1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853673685	FC	On-Demand	Anodyne	TGM2	43	43
O=C(NOCc1ccccc1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853673685	FC	On-Demand	Anodyne	F13A1	55	42
Cn1ncc(C#N)c1NC[C@@H]1CN(C(=O)OC(C)(C)C)CCCO1	ZINC000853673691	ED	On-Demand	Mild	GPR119	30	41
Cn1ncc(C#N)c1NC[C@H]1CN(C(=O)OC(C)(C)C)CCCO1	ZINC000853673692	ED	On-Demand	Mild	GPR119	30	41
O=C(NOCc1ccccc1)NC1CC(CO)C1	ZINC000853673697	CD	On-Demand	Anodyne	NAAA	32	40
O=C(NOCc1ccccc1)NC1CC(CO)C1	ZINC000853673697	CD	On-Demand	Anodyne	SLC12A5	47	33
C[C@@H]1CN(C(=O)NOCc2ccccc2)C[C@@]1(C)CO	ZINC000853673698	CD	On-Demand	Anodyne	SLC12A5	52	34
C[C@@H]1CN(C(=O)NOCc2ccccc2)C[C@]1(C)CO	ZINC000853673699	CD	On-Demand	Anodyne	SLC12A5	52	34
C=C(Cl)CONC(=N)c1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853673736	EH	On-Demand	Mild	KCNK3	68	34
OCc1cccc(OCCOC(F)F)c1	ZINC000853673793	BD	On-Demand	Anodyne	UPP1	49	34
CN1CCN(C(=O)NOCc2ccccc2)CCC1=O	ZINC000853673809	CC	On-Demand	Anodyne	SLC12A5	61	35
OCc1cccc(OCCC2SCCS2)c1	ZINC000853673814	CF	On-Demand	Anodyne	UPP1	40	32
O=C(NOCc1ccccc1)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853673841	CD	On-Demand	Anodyne	SLC12A5	58	34
O=C(NOCc1ccccc1)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853673843	CD	On-Demand	Anodyne	SLC12A5	58	34
O=C(NOCc1ccccc1)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853673844	CD	On-Demand	Anodyne	SLC12A5	58	34
O=C(NOCc1ccccc1)N[C@H]1C[C@H](O)C12CCC2	ZINC000853673845	CD	On-Demand	Anodyne	SLC12A5	58	34
C=CCN(C(=O)NOCc1ccccc1)[C@H](C)COC	ZINC000853673852	CE	On-Demand	Mild	KLK3	47	31
C=CCN(C(=O)NOCc1ccccc1)[C@H](C)COC	ZINC000853673852	CE	On-Demand	Mild	CAPNS1	44	35
C=CCN(C(=O)NOCc1ccccc1)[C@H](C)COC	ZINC000853673852	CE	On-Demand	Mild	CAPN1	45	42
C=CCN(C(=O)NOCc1ccccc1)[C@H](C)COC	ZINC000853673852	CE	On-Demand	Mild	CAPN2	59	33
C=CCN(C(=O)NOCc1ccccc1)[C@H](C)COC	ZINC000853673852	CE	On-Demand	Mild	NPR	58	34
C=CCN(C(=O)NOCc1ccccc1)[C@@H](C)COC	ZINC000853673853	CE	On-Demand	Mild	KLK3	47	31
C=CCN(C(=O)NOCc1ccccc1)[C@@H](C)COC	ZINC000853673853	CE	On-Demand	Mild	CAPNS1	44	35
C=CCN(C(=O)NOCc1ccccc1)[C@@H](C)COC	ZINC000853673853	CE	On-Demand	Mild	CAPN1	45	42
C=CCN(C(=O)NOCc1ccccc1)[C@@H](C)COC	ZINC000853673853	CE	On-Demand	Mild	CAPN2	59	33
C=CCN(C(=O)NOCc1ccccc1)[C@@H](C)COC	ZINC000853673853	CE	On-Demand	Mild	NPR	58	34
CC(=O)Nc1ccc(OCCC2SCCS2)c(F)c1	ZINC000853673861	DG	On-Demand	Anodyne	MET	55	35
O=C(NOCc1ccccc1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853673869	CE	On-Demand	Anodyne	FKBP1A	30	46
O=C(NOCc1ccccc1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853673869	CE	On-Demand	Anodyne	PREP	60	46
O=C(NOCc1ccccc1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853673869	CE	On-Demand	Anodyne	SLC12A5	79	43
O=C(NOCc1ccccc1)N1CCC[C@](O)(C2CC2)C1	ZINC000853673870	CE	On-Demand	Anodyne	FKBP1A	30	46
O=C(NOCc1ccccc1)N1CCC[C@](O)(C2CC2)C1	ZINC000853673870	CE	On-Demand	Anodyne	PREP	60	46
O=C(NOCc1ccccc1)N1CCC[C@](O)(C2CC2)C1	ZINC000853673870	CE	On-Demand	Anodyne	SLC12A5	79	43
O=C(NOCc1ccccc1)N1CCC(n2cnnc2O)CC1	ZINC000853673873	DD	On-Demand	Anodyne	GRIN2B	54	42
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	CELA1	17	40
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	BMP1	15	43
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	KLK3	41	33
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	CTSB	60	41
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	PAPA1_CARPA	67	35
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	CTSK	33	43
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	CTSL	32	40
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	CAPNS1	62	40
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	CAPN1	83	41
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	CAPN2	127	41
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	NPR	72	39
CC[C@@H](O)CNC(=O)NOCc1ccccc1	ZINC000853673885	BD	On-Demand	Anodyne	PDS	67	39
COc1cccc(SCCONC(=N)[C@H](C)OC)c1	ZINC000853673892	CE	On-Demand	Anodyne	MTNR1A	22	54
COc1cccc(SCCONC(=N)[C@H](C)OC)c1	ZINC000853673892	CE	On-Demand	Anodyne	MTNR1B	25	54
COc1cccc(SCCONC(=N)[C@@H](C)OC)c1	ZINC000853673893	CE	On-Demand	Anodyne	MTNR1A	22	54
COc1cccc(SCCONC(=N)[C@@H](C)OC)c1	ZINC000853673893	CE	On-Demand	Anodyne	MTNR1B	25	54
C#CCOCCOc1cccc(CO)c1	ZINC000853673897	BD	On-Demand	Mild	UPP1	49	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2CO)CC1	ZINC000853673918	ED	On-Demand	Anodyne	P2RY12	96	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2CO)CC1	ZINC000853673919	ED	On-Demand	Anodyne	P2RY12	96	41
Cn1cncc1CCOc1cccc(CO)c1	ZINC000853674013	BD	On-Demand	Anodyne	UPP1	51	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3cc(C(C)=O)ccc3c2)CC1	ZINC000853674044	GG	On-Demand	Anodyne	P2RY12	112	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3cc(C(C)=O)ccc3c2)CC1	ZINC000853674044	GG	On-Demand	Anodyne	TRY2_BOVIN	37	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3cc(C(C)=O)ccc3c2)CC1	ZINC000853674045	GG	On-Demand	Anodyne	P2RY12	112	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3cc(C(C)=O)ccc3c2)CC1	ZINC000853674045	GG	On-Demand	Anodyne	TRY2_BOVIN	37	40
CCCOc1cccc(CONC(=N)CC(=O)NC)c1	ZINC000853674191	CD	On-Demand	Anodyne	HRH2	28	40
CCCOc1cccc(CONC(=N)CC(=O)NC)c1	ZINC000853674191	CD	On-Demand	Anodyne	UPP1	58	40
COc1cccc(SCCOc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853674197	EH	On-Demand	Anodyne	MTNR1A	43	54
COc1cccc(SCCOc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853674197	EH	On-Demand	Anodyne	MTNR1B	45	54
COc1cccc(SCCOc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853674197	EH	On-Demand	Anodyne	HSD17B2	23	40
CCOC(=O)COc1ccc(OCCOC(F)F)cc1	ZINC000853674200	CE	On-Demand	Anodyne	PLA2G4B	94	40
CC(=O)N(C)c1ccc(OCCC2CCC2)cc1	ZINC000853674210	BG	On-Demand	Anodyne	HPGD	17	42
C#CCOCCOc1ccc(OCC(=O)OCC)cc1	ZINC000853674215	CD	On-Demand	Mild	PLA2G4B	87	38
COC(=O)[C@H](Cc1ccc(OCc2conc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674220	GG	On-Demand	Anodyne	PAPA1_CARPA	46	45
COC(=O)[C@H](Cc1ccc(OCc2conc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674220	GG	On-Demand	Anodyne	FPR1	48	40
C=C(Cl)CONC(=N)c1ccc(N2CCN(c3ccc(F)cc3)CC2)nc1	ZINC000853674319	GG	On-Demand	Mild	SLC27A1	40	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc([C@H](C)O)c2)CC1	ZINC000853674324	FD	On-Demand	Anodyne	P2RY12	97	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc([C@H](C)O)c2)CC1	ZINC000853674324	FD	On-Demand	Anodyne	TRY2_BOVIN	15	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc([C@@H](C)O)c2)CC1	ZINC000853674326	FD	On-Demand	Anodyne	P2RY12	97	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc([C@@H](C)O)c2)CC1	ZINC000853674326	FD	On-Demand	Anodyne	TRY2_BOVIN	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc([C@H](C)O)c2)CC1	ZINC000853674328	FD	On-Demand	Anodyne	P2RY12	97	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc([C@H](C)O)c2)CC1	ZINC000853674328	FD	On-Demand	Anodyne	TRY2_BOVIN	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc([C@@H](C)O)c2)CC1	ZINC000853674330	FD	On-Demand	Anodyne	P2RY12	97	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc([C@@H](C)O)c2)CC1	ZINC000853674330	FD	On-Demand	Anodyne	TRY2_BOVIN	15	40
C=C(Cl)COc1ccc(OCC(=O)OCC)cc1	ZINC000853674355	CF	On-Demand	Mild	PLA2G4B	64	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2OCCO)CC1	ZINC000853674378	FD	On-Demand	Anodyne	P2RY12	196	44
COC(=O)C1(CONC(=N)c2cccc(OC)c2)CC1	ZINC000853674379	CD	On-Demand	Anodyne	DRD4	48	37
COC(=O)C1(CONC(=N)c2cccc(OC)c2)CC1	ZINC000853674379	CD	On-Demand	Anodyne	MTNR1B	37	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2OCCO)CC1	ZINC000853674380	FD	On-Demand	Anodyne	P2RY12	196	44
CCCOc1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853674440	GI	On-Demand	Anodyne	HRH2	46	43
CCCOc1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853674440	GI	On-Demand	Anodyne	CAPN2	80	38
CCCOc1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853674440	GI	On-Demand	Anodyne	NPR	55	34
CCCOc1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853674440	GI	On-Demand	Anodyne	PDS	93	45
CO[C@@H](COc1cccc(CO)c1)C1CCC1	ZINC000853674441	BE	On-Demand	Anodyne	PDS	41	33
CN(C)S(=O)(=O)c1ccccc1N[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000853674472	GG	On-Demand	Anodyne	ACACB	15	43
CN(C)S(=O)(=O)c1ccccc1N[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853674474	GG	On-Demand	Anodyne	ACACB	15	43
CN(C)S(=O)(=O)c1ccccc1N[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000853674476	GG	On-Demand	Anodyne	ACACB	15	43
CN(C)S(=O)(=O)c1ccccc1N[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853674478	GG	On-Demand	Anodyne	ACACB	15	43
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCC1	ZINC000853674480	FH	On-Demand	Anodyne	CTSB	40	38
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCC1	ZINC000853674480	FH	On-Demand	Anodyne	CYSP_TRYCR	44	38
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCC1	ZINC000853674480	FH	On-Demand	Anodyne	CTSL	40	38
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCC1	ZINC000853674480	FH	On-Demand	Anodyne	CAPNS1	48	32
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCC1	ZINC000853674480	FH	On-Demand	Anodyne	CAPN1	53	37
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCC1	ZINC000853674480	FH	On-Demand	Anodyne	CAPN2	96	35
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCC1	ZINC000853674480	FH	On-Demand	Anodyne	NPR	60	34
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	CELA1	17	41
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	KLK3	44	32
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	CTSB	56	39
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	PAPA1_CARPA	57	36
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	CYSP_TRYCR	50	38
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	CTSL	42	38
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	CAPNS1	61	36
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	CAPN1	72	42
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	CAPN2	118	42
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	NPR	69	39
CCC(CC)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674507	DH	On-Demand	Anodyne	PDS	61	40
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc(N3CCCC3)cc2)C1	ZINC000853674516	FG	On-Demand	Clean	GPR119	37	45
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc(N3CCCC3)cc2)C1	ZINC000853674517	FG	On-Demand	Clean	GPR119	37	45
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674518	FH	On-Demand	Anodyne	LCK	22	44
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674518	FH	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674519	FH	On-Demand	Anodyne	LCK	22	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674519	FH	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674520	FH	On-Demand	Anodyne	LCK	22	44
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674520	FH	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674521	FH	On-Demand	Anodyne	LCK	22	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](Nc2nc3ccc(N)cc3s2)C1	ZINC000853674521	FH	On-Demand	Anodyne	ACACB	15	42
c1cc(N2CCCC2)ccc1OCCC1SCCS1	ZINC000853674526	CH	On-Demand	Clean	HRH3	33	44
c1cc(N2CCCC2)ccc1OCCC1SCCS1	ZINC000853674526	CH	On-Demand	Clean	PSMB1	40	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)n(C)n2)CC1	ZINC000853674528	DC	On-Demand	Anodyne	P2RY12	59	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)n(C)n2)CC1	ZINC000853674529	DC	On-Demand	Anodyne	P2RY12	59	37
CNC(=O)c1cc(Oc2cccc(OCc3oc(C)nc3C)c2C)ccn1	ZINC000853674553	FH	On-Demand	Anodyne	RAF1	66	45
CNC(=O)c1cc(Oc2cccc(OCCc3cncn3C)c2C)ccn1	ZINC000853674574	FF	On-Demand	Anodyne	RAF1	61	40
O=C(NCc1cnn(C[C@@H]2CC[C@@H](c3ccccc3)C2)c1)OCc1ccccc1	ZINC000853674580	GJ	On-Demand	Anodyne	NPR	41	31
C#C[C@H](NC(=O)NC1(c2ccc(OC)cc2)CCCC1)C1CCOCC1	ZINC000853674585	FG	On-Demand	Mild	NPBWR1	43	30
C#C[C@@H](NC(=O)NC1(c2ccc(OC)cc2)CCCC1)C1CCOCC1	ZINC000853674586	FG	On-Demand	Mild	NPBWR1	43	30
O=C(NCc1cnn(CCOC(F)F)c1)OCc1ccccc1	ZINC000853674597	EF	On-Demand	Anodyne	CYSP_TRYCR	45	34
O=C(NCc1cnn(CCOC(F)F)c1)OCc1ccccc1	ZINC000853674597	EF	On-Demand	Anodyne	CAPNS1	51	32
O=C(NCc1cnn(CCOC(F)F)c1)OCc1ccccc1	ZINC000853674597	EF	On-Demand	Anodyne	CAPN1	48	35
O=C(NCc1cnn(CCOC(F)F)c1)OCc1ccccc1	ZINC000853674597	EF	On-Demand	Anodyne	CAPN2	81	35
O=C(NCc1cnn(CCOC(F)F)c1)OCc1ccccc1	ZINC000853674597	EF	On-Demand	Anodyne	NPR	65	37
O=C(NCc1cnn(CCOC(F)F)c1)OCc1ccccc1	ZINC000853674597	EF	On-Demand	Anodyne	PDS	44	35
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cnccn2)CC1	ZINC000853674598	GD	On-Demand	Anodyne	DRD4	16	48
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cnccn2)CC1	ZINC000853674598	GD	On-Demand	Anodyne	SIGMAR1	16	44
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cnccn2)CC1	ZINC000853674598	GD	On-Demand	Anodyne	SSTR5	49	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cnccn2)CC1	ZINC000853674598	GD	On-Demand	Anodyne	MCHR1	26	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cnccn2)CC1	ZINC000853674598	GD	On-Demand	Anodyne	CCR8	28	42
CCCn1ncnc1CONC(=N)c1cccc(OC)c1	ZINC000853674615	CD	On-Demand	Anodyne	DRD4	41	32
COC(=O)[C@H](Cc1ccc(OCc2cncs2)cc1)NC(=O)OC(C)(C)C	ZINC000853674636	GG	On-Demand	Anodyne	PGC	49	35
COC(=O)[C@H](Cc1ccc(OCc2cncs2)cc1)NC(=O)OC(C)(C)C	ZINC000853674636	GG	On-Demand	Anodyne	PAPA1_CARPA	45	45
COC(=O)[C@H](Cc1ccc(OCc2cncs2)cc1)NC(=O)OC(C)(C)C	ZINC000853674636	GG	On-Demand	Anodyne	CACNA1B	29	42
COC(=O)[C@H](Cc1ccc(OCc2cncs2)cc1)NC(=O)OC(C)(C)C	ZINC000853674636	GG	On-Demand	Anodyne	REN	56	39
COC(=O)[C@H](Cc1ccc(OCc2cncs2)cc1)NC(=O)OC(C)(C)C	ZINC000853674636	GG	On-Demand	Anodyne	FPR1	48	41
COC(=O)[C@H](Cc1ccc(OCc2cncs2)cc1)NC(=O)OC(C)(C)C	ZINC000853674636	GG	On-Demand	Anodyne	CYP3A4	46	42
COC(=O)c1cccc(C(=N)NOCCC=C(C)C)c1	ZINC000853674645	CF	On-Demand	Anodyne	ACR	15	42
COC(=O)c1cccc(C(=N)NOCCC=C(C)C)c1	ZINC000853674645	CF	On-Demand	Anodyne	TRPA1	23	44
C#CCOCCOc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853674650	CG	On-Demand	Mild	EPHX2	17	42
COC(=O)[C@H](Cc1ccc(OCc2nonc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674658	GF	On-Demand	Anodyne	PGC	41	35
COC(=O)[C@H](Cc1ccc(OCc2nonc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674658	GF	On-Demand	Anodyne	GSTM2	15	43
COC(=O)[C@H](Cc1ccc(OCc2nonc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674658	GF	On-Demand	Anodyne	PAPA1_CARPA	47	45
COC(=O)[C@H](Cc1ccc(OCc2nonc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674658	GF	On-Demand	Anodyne	CACNA1B	22	40
COC(=O)[C@H](Cc1ccc(OCc2nonc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674658	GF	On-Demand	Anodyne	REN	42	39
COC(=O)[C@H](Cc1ccc(OCc2nonc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674658	GF	On-Demand	Anodyne	FPR1	48	41
COC(=O)[C@H](Cc1ccc(OCc2nonc2C)cc1)NC(=O)OC(C)(C)C	ZINC000853674658	GF	On-Demand	Anodyne	CTRB_BOVIN	29	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cnccn2)CC1	ZINC000853674666	FC	On-Demand	Anodyne	P2RY12	60	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cnccn2)CC1	ZINC000853674667	FC	On-Demand	Anodyne	P2RY12	60	38
C[C@H](O)c1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853674671	GF	On-Demand	Anodyne	CPT1A	57	37
C[C@H](O)c1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853674671	GF	On-Demand	Anodyne	CPT2	42	36
C[C@H](O)c1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853674671	GF	On-Demand	Anodyne	C3AR1	40	40
C[C@H](O)c1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853674671	GF	On-Demand	Anodyne	FAAH	23	45
C[C@H](O)c1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853674671	GF	On-Demand	Anodyne	WNT3	49	30
C[C@@H]1CCCC[C@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674692	EI	On-Demand	Anodyne	PREP	33	40
C[C@@H]1CCCC[C@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674692	EI	On-Demand	Anodyne	CAPN1	41	34
C[C@@H]1CCCC[C@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674692	EI	On-Demand	Anodyne	CAPN2	69	34
C[C@@H]1CCCC[C@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674692	EI	On-Demand	Anodyne	NPR	57	33
C[C@@H]1CCCC[C@@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674695	EI	On-Demand	Anodyne	PREP	33	40
C[C@@H]1CCCC[C@@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674695	EI	On-Demand	Anodyne	CAPN1	41	34
C[C@@H]1CCCC[C@@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674695	EI	On-Demand	Anodyne	CAPN2	69	34
C[C@@H]1CCCC[C@@H]1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674695	EI	On-Demand	Anodyne	NPR	57	33
C[C@H](O)c1cccc(OCc2csc(Cl)n2)c1	ZINC000853674698	CG	On-Demand	Anodyne	NR1H4	50	35
CON(C)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000853674699	GF	On-Demand	Anodyne	CYP19A1	22	42
CON(C)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000853674699	GF	On-Demand	Anodyne	CYP11B1	51	47
CON(C)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000853674699	GF	On-Demand	Anodyne	AGTR2	18	42
CON(C)CCNC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000853674699	GF	On-Demand	Anodyne	CYP11B2	26	47
O=C(NCc1cnn(Cc2cc(C3CC3)no2)c1)OCc1ccccc1	ZINC000853674700	FG	On-Demand	Anodyne	PREP	28	41
O=C(NCc1cnn(Cc2cc(C3CC3)no2)c1)OCc1ccccc1	ZINC000853674700	FG	On-Demand	Anodyne	PANC	51	37
O=C(NCc1cnn(CC23CCC(CC2)C3)c1)OCc1ccccc1	ZINC000853674701	EH	On-Demand	Anodyne	NPR	44	32
Cc1ccccc1CC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853674706	FG	On-Demand	Anodyne	GRIN2B	37	42
Cc1ccccc1CC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853674707	FG	On-Demand	Anodyne	GRIN2B	37	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(Br)n2)CC1	ZINC000853674709	FD	On-Demand	Anodyne	P2RY12	107	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(Br)n2)CC1	ZINC000853674710	FD	On-Demand	Anodyne	P2RY12	107	42
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@@H](C)O)c2)CC1	ZINC000853674725	GG	On-Demand	Anodyne	DRD4	24	54
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@@H](C)O)c2)CC1	ZINC000853674725	GG	On-Demand	Anodyne	SIGMAR1	20	50
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@@H](C)O)c2)CC1	ZINC000853674725	GG	On-Demand	Anodyne	SSTR5	47	38
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@@H](C)O)c2)CC1	ZINC000853674725	GG	On-Demand	Anodyne	CCR3	27	41
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@@H](C)O)c2)CC1	ZINC000853674725	GG	On-Demand	Anodyne	CCR2	16	47
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@@H](C)O)c2)CC1	ZINC000853674725	GG	On-Demand	Anodyne	MCHR1	39	54
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@@H](C)O)c2)CC1	ZINC000853674725	GG	On-Demand	Anodyne	CCR8	15	46
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@H](C)O)c2)CC1	ZINC000853674726	GG	On-Demand	Anodyne	DRD4	24	54
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@H](C)O)c2)CC1	ZINC000853674726	GG	On-Demand	Anodyne	SIGMAR1	20	50
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@H](C)O)c2)CC1	ZINC000853674726	GG	On-Demand	Anodyne	SSTR5	47	38
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@H](C)O)c2)CC1	ZINC000853674726	GG	On-Demand	Anodyne	CCR3	27	41
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@H](C)O)c2)CC1	ZINC000853674726	GG	On-Demand	Anodyne	CCR2	16	47
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@H](C)O)c2)CC1	ZINC000853674726	GG	On-Demand	Anodyne	MCHR1	39	54
Cc1ccccc1CN1CCC(NC(=O)COc2cccc([C@H](C)O)c2)CC1	ZINC000853674726	GG	On-Demand	Anodyne	CCR8	15	46
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CELA1	17	41
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	KLK3	77	39
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CTSB	63	39
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	PAPA1_CARPA	67	36
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CYSP_TRYCR	51	38
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CTSK	36	41
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CTSL	44	38
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CAPNS1	64	37
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	MMP11	41	32
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CTSS	15	41
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CAPN1	78	40
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	CAPN2	125	40
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	NPR	79	42
C[C@H](O)CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674729	DE	On-Demand	Anodyne	PDS	50	36
O=C(NCc1cnn(CC2C[C@@H]3C[C@H]3C2)c1)OCc1ccccc1	ZINC000853674731	EG	On-Demand	Anodyne	CAPN2	48	33
O=C(NCc1cnn(CC2C[C@@H]3C[C@H]3C2)c1)OCc1ccccc1	ZINC000853674731	EG	On-Demand	Anodyne	NPR	54	33
O=C(NCc1cnn(CC2C[C@H]3C[C@@H]3C2)c1)OCc1ccccc1	ZINC000853674733	EG	On-Demand	Anodyne	CAPN2	48	33
O=C(NCc1cnn(CC2C[C@H]3C[C@@H]3C2)c1)OCc1ccccc1	ZINC000853674733	EG	On-Demand	Anodyne	NPR	54	33
O=C(NCc1cnn(C[C@H]2C[C@@H]3C[C@@H]3C2)c1)OCc1ccccc1	ZINC000853674736	EG	On-Demand	Anodyne	CAPN2	48	33
O=C(NCc1cnn(C[C@H]2C[C@@H]3C[C@@H]3C2)c1)OCc1ccccc1	ZINC000853674736	EG	On-Demand	Anodyne	NPR	54	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)oc3cccnc32)CC1	ZINC000853674745	EC	On-Demand	Anodyne	P2RY12	59	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)oc3cccnc32)CC1	ZINC000853674746	EC	On-Demand	Anodyne	P2RY12	59	37
COc1ccc(Cn2c(=O)oc3cc(C(=O)C(C)C)ccc32)cc1	ZINC000853674750	EG	On-Demand	Anodyne	PTGS2	19	41
COc1ccc(Cn2c(=O)oc3cc(C(=O)C(C)C)ccc32)cc1	ZINC000853674750	EG	On-Demand	Anodyne	PPARG	18	40
COc1ccc(Cn2c(=O)oc3cc(C(=O)C(C)C)ccc32)cc1	ZINC000853674750	EG	On-Demand	Anodyne	MIF	17	42
COc1ccc(Cn2c(=O)oc3cc(C(=O)C(C)C)ccc32)cc1	ZINC000853674750	EG	On-Demand	Anodyne	PROKR1	64	34
CN1CCC(CCNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853674762	EF	On-Demand	Reactive	CACNA1H	35	41
CN1CCC(CCNC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853674762	EF	On-Demand	Reactive	CACNA1I	77	42
O=Cc1cc(F)c(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c(F)c1	ZINC000853674770	EG	On-Demand	Anodyne	ACKR3	55	32
O=Cc1cc(F)c(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c(F)c1	ZINC000853674773	EG	On-Demand	Anodyne	ACKR3	55	32
CC(=O)N(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853674793	FG	On-Demand	Anodyne	GRIN2B	19	40
CC(=O)N(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853674793	FG	On-Demand	Anodyne	CHEK2	16	44
CC(=O)N(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853674793	FG	On-Demand	Anodyne	SLC18A3	15	42
CC(=O)N(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853674794	FG	On-Demand	Anodyne	GRIN2B	19	40
CC(=O)N(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853674794	FG	On-Demand	Anodyne	CHEK2	16	44
CC(=O)N(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853674794	FG	On-Demand	Anodyne	SLC18A3	15	42
COC(=O)C1(COc2cccc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000853674803	DG	On-Demand	Anodyne	EPHX2	20	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674825	GD	On-Demand	Anodyne	DRD4	50	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674825	GD	On-Demand	Anodyne	P2RY12	100	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674825	GD	On-Demand	Anodyne	TRY2_BOVIN	88	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674825	GD	On-Demand	Anodyne	TRY1_BOVIN	16	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674825	GD	On-Demand	Anodyne	MTNR1A	40	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674825	GD	On-Demand	Anodyne	MTNR1B	44	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674825	GD	On-Demand	Anodyne	ST14	37	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674826	GD	On-Demand	Anodyne	DRD4	50	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674826	GD	On-Demand	Anodyne	P2RY12	100	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674826	GD	On-Demand	Anodyne	TRY2_BOVIN	88	43
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674826	GD	On-Demand	Anodyne	TRY1_BOVIN	16	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674826	GD	On-Demand	Anodyne	MTNR1A	40	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674826	GD	On-Demand	Anodyne	MTNR1B	44	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cccc(OC)c2)CC1	ZINC000853674826	GD	On-Demand	Anodyne	ST14	37	42
CCn1ncnc1CONC(=N)c1cccc(OC)c1	ZINC000853674835	CD	On-Demand	Anodyne	DRD4	40	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(CC)nc2CC)CC1	ZINC000853674836	ED	On-Demand	Anodyne	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(CC)nc2CC)CC1	ZINC000853674837	ED	On-Demand	Anodyne	P2RY12	40	36
CC(=O)N(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853674849	CG	On-Demand	Anodyne	ALOX5	21	49
CC(=O)N(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853674849	CG	On-Demand	Anodyne	PPARA	19	41
CC(=O)N(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853674849	CG	On-Demand	Anodyne	LTA4H	49	43
CC(=O)N(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853674849	CG	On-Demand	Anodyne	PLA2G4B	61	37
CC(=O)N(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853674849	CG	On-Demand	Anodyne	ESRRG	45	33
CC(=O)N(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853674849	CG	On-Demand	Anodyne	FFAR1	34	40
COC[C@@H](CONC(=N)c1cccc(OC)c1)OC	ZINC000853674852	CD	On-Demand	Anodyne	DRD4	42	32
COC[C@@H](CONC(=N)c1cccc(OC)c1)OC	ZINC000853674852	CD	On-Demand	Anodyne	MTNR1A	21	44
COC[C@@H](CONC(=N)c1cccc(OC)c1)OC	ZINC000853674852	CD	On-Demand	Anodyne	MTNR1B	23	44
COc1cccc(SCCOc2cccc([C@@H](C)O)c2)c1	ZINC000853674874	DH	On-Demand	Anodyne	MTNR1A	15	50
COc1cccc(SCCOc2cccc([C@@H](C)O)c2)c1	ZINC000853674874	DH	On-Demand	Anodyne	MTNR1B	17	50
COc1cccc(SCCOc2cccc([C@H](C)O)c2)c1	ZINC000853674875	DH	On-Demand	Anodyne	MTNR1A	15	50
COc1cccc(SCCOc2cccc([C@H](C)O)c2)c1	ZINC000853674875	DH	On-Demand	Anodyne	MTNR1B	17	50
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCCC1	ZINC000853674883	FH	On-Demand	Anodyne	CTSL	41	39
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCCC1	ZINC000853674883	FH	On-Demand	Anodyne	CAPNS1	43	32
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCCC1	ZINC000853674883	FH	On-Demand	Anodyne	CAPN1	47	38
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCCC1	ZINC000853674883	FH	On-Demand	Anodyne	CAPN2	86	36
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCCCC1	ZINC000853674883	FH	On-Demand	Anodyne	NPR	58	34
O=C(NCc1cnn(CC2CC=CC2)c1)OCc1ccccc1	ZINC000853674897	DG	On-Demand	Anodyne	CAPN2	55	33
O=C(NCc1cnn(CC2CC=CC2)c1)OCc1ccccc1	ZINC000853674897	DG	On-Demand	Anodyne	NPR	57	33
CC(=O)Nc1ccc(CCNC(=O)N2CCN(c3ccc(C)cc3C)CC2)cc1	ZINC000853674900	GG	On-Demand	Anodyne	HTR1B	20	53
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	CTSB	48	36
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	PAPA1_CARPA	50	35
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	CYSP_TRYCR	41	35
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	CAPNS1	59	35
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	CAPN1	68	41
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	CAPN2	114	41
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	NPR	68	38
CC[C@@H](CC(F)F)Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674901	FH	On-Demand	Anodyne	PDS	56	37
O=C(NCc1cnn(C[C@@H]2CC[C@@H]3C[C@H]3C2)c1)OCc1ccccc1	ZINC000853674934	EH	On-Demand	Anodyne	NPR	43	31
O=C(NCc1cnn(C[C@@H]2CC[C@H]3C[C@@H]3C2)c1)OCc1ccccc1	ZINC000853674936	EH	On-Demand	Anodyne	NPR	43	31
O=C(NCc1cnn(C[C@@H]2CC[C@H]3C[C@H]3C2)c1)OCc1ccccc1	ZINC000853674937	EH	On-Demand	Anodyne	NPR	43	31
O=C(NCc1cnn(C[C@@H]2CC[C@@H]3C[C@@H]3C2)c1)OCc1ccccc1	ZINC000853674939	EH	On-Demand	Anodyne	NPR	43	31
O=C(NCc1cnn(CCC2(O)CCC2)c1)OCc1ccccc1	ZINC000853674954	EF	On-Demand	Anodyne	NPR	57	34
O=C(NCc1cnn(CCC2(O)CCC2)c1)OCc1ccccc1	ZINC000853674954	EF	On-Demand	Anodyne	SLC12A5	58	35
CCCn1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674962	FE	On-Demand	Anodyne	CAPN2	71	36
CCCn1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674962	FE	On-Demand	Anodyne	NPR	61	36
CCCn1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853674962	FE	On-Demand	Anodyne	PDS	44	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000853674976	GD	On-Demand	Anodyne	P2RY12	49	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(N(C)C(C)=O)cc2)CC1	ZINC000853674977	GD	On-Demand	Anodyne	P2RY12	49	36
CCOC(=O)COc1ccc(OCCC2SCCS2)cc1	ZINC000853674984	EG	On-Demand	Anodyne	PLA2G4B	78	35
CC(=O)N(C)c1ccc(OCCCC2CCC2)cc1	ZINC000853674987	CH	On-Demand	Anodyne	PLA2G4B	49	33
CC(=O)N(C)c1ccc(OC[C@@H]2CCCCN2C(C)C)cc1	ZINC000853675029	DG	On-Demand	Anodyne	CHRNA10	50	38
CC(=O)N(C)c1ccc(OC[C@H]2CCCCN2C(C)C)cc1	ZINC000853675030	DG	On-Demand	Anodyne	CHRNA10	50	38
Cc1nonc1COc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853675036	DG	On-Demand	Anodyne	CACNA1D	15	49
COC(=O)[C@H](Cc1ccc(OC[C@@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675058	GE	On-Demand	Anodyne	PGC	48	36
COC(=O)[C@H](Cc1ccc(OC[C@@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675058	GE	On-Demand	Anodyne	PAPA1_CARPA	39	42
COC(=O)[C@H](Cc1ccc(OC[C@@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675058	GE	On-Demand	Anodyne	CACNA1B	21	41
COC(=O)[C@H](Cc1ccc(OC[C@@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675058	GE	On-Demand	Anodyne	REN	51	38
COC(=O)[C@H](Cc1ccc(OC[C@@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675058	GE	On-Demand	Anodyne	KLK5	32	41
COC(=O)[C@H](Cc1ccc(OC[C@@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675058	GE	On-Demand	Anodyne	FPR1	48	40
COC(=O)[C@H](Cc1ccc(OC[C@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675059	GE	On-Demand	Anodyne	PGC	48	36
COC(=O)[C@H](Cc1ccc(OC[C@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675059	GE	On-Demand	Anodyne	PAPA1_CARPA	39	42
COC(=O)[C@H](Cc1ccc(OC[C@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675059	GE	On-Demand	Anodyne	CACNA1B	21	41
COC(=O)[C@H](Cc1ccc(OC[C@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675059	GE	On-Demand	Anodyne	REN	51	38
COC(=O)[C@H](Cc1ccc(OC[C@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675059	GE	On-Demand	Anodyne	KLK5	32	41
COC(=O)[C@H](Cc1ccc(OC[C@H]2COCCO2)cc1)NC(=O)OC(C)(C)C	ZINC000853675059	GE	On-Demand	Anodyne	FPR1	48	40
C#CCOCCOc1cccc(Oc2ccnc(C(=O)NC)c2)c1C	ZINC000853675063	EF	On-Demand	Mild	RAF1	59	39
Cc1nocc1COc1ccc(N2CCCC2)cc1	ZINC000853675064	CG	On-Demand	Clean	CACNA2D2	40	37
C#CCOCCOc1ccc(CCC)cc1	ZINC000853675075	BF	On-Demand	Mild	PLA2G4B	49	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(=O)N(C)C)CC1	ZINC000853675076	GD	On-Demand	Anodyne	P2RY12	79	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2C(=O)N(C)C)CC1	ZINC000853675076	GD	On-Demand	Anodyne	HCN1	52	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(=O)N(C)C)CC1	ZINC000853675077	GD	On-Demand	Anodyne	P2RY12	79	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2C(=O)N(C)C)CC1	ZINC000853675077	GD	On-Demand	Anodyne	HCN1	52	33
C=C[C@H](CO)NC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccc(C(C)C)cc1	ZINC000853675114	GG	On-Demand	Mild	SOAT1	21	54
C=C[C@H](CO)NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccc(C(C)C)cc1	ZINC000853675116	GG	On-Demand	Mild	SOAT1	21	54
CNC(=O)c1cc(Oc2cccc(OC[C@@H](OC)[C@@H]3CCOC3)c2C)ccn1	ZINC000853675131	GF	On-Demand	Anodyne	RAF1	57	38
CNC(=O)c1cc(Oc2cccc(OC[C@@H](OC)[C@H]3CCOC3)c2C)ccn1	ZINC000853675133	GF	On-Demand	Anodyne	RAF1	57	38
CNC(=O)c1cc(Oc2cccc(OC[C@H](OC)[C@@H]3CCOC3)c2C)ccn1	ZINC000853675134	GF	On-Demand	Anodyne	RAF1	57	38
CNC(=O)c1cc(Oc2cccc(OC[C@H](OC)[C@H]3CCOC3)c2C)ccn1	ZINC000853675135	GF	On-Demand	Anodyne	RAF1	57	38
O=C(NCc1cnn(CCO[C@H]2CC2(F)F)c1)OCc1ccccc1	ZINC000853675144	FF	On-Demand	Anodyne	CAPN2	51	33
O=C(NCc1cnn(CCO[C@H]2CC2(F)F)c1)OCc1ccccc1	ZINC000853675144	FF	On-Demand	Anodyne	NPR	60	34
O=C(NCc1cnn(CCO[C@@H]2CC2(F)F)c1)OCc1ccccc1	ZINC000853675145	FF	On-Demand	Anodyne	CAPN2	51	33
O=C(NCc1cnn(CCO[C@@H]2CC2(F)F)c1)OCc1ccccc1	ZINC000853675145	FF	On-Demand	Anodyne	NPR	60	34
CCOC(=O)COc1ccc(OCCc2cncn2C)cc1	ZINC000853675154	DD	On-Demand	Anodyne	PLA2G4B	68	33
C#CCOCCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675164	DD	On-Demand	Mild	NPR	57	34
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Nc2cc(O)nc3cccnc23)C1	ZINC000853675191	FG	On-Demand	Anodyne	ACACB	17	47
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](Nc2cc(O)nc3cccnc23)C1	ZINC000853675193	FG	On-Demand	Anodyne	ACACB	17	47
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](Nc2cc(O)nc3cccnc23)C1	ZINC000853675195	FG	On-Demand	Anodyne	ACACB	17	47
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](Nc2cc(O)nc3cccnc23)C1	ZINC000853675197	FG	On-Demand	Anodyne	ACACB	17	47
CN1CCC(CCNC(=O)NNc2ccc(Cl)cc2Br)CC1	ZINC000853675203	GG	On-Demand	Reactive	CACNA1I	51	35
CNC(=O)c1cc(Oc2cccc(OCCC3SCCS3)c2C)ccn1	ZINC000853675216	GI	On-Demand	Anodyne	RAF1	61	41
CN1CCC(CCNC(=O)N2CC(O)(c3ccc(Br)cc3)C2)CC1	ZINC000853675218	GE	On-Demand	Anodyne	SIRT3	50	31
CN1CCC(CCNC(=O)N2CC(O)(c3ccc(Br)cc3)C2)CC1	ZINC000853675218	GE	On-Demand	Anodyne	SIRT2	51	32
CN1CCC(CCNC(=O)N2CC(O)(c3ccc(Br)cc3)C2)CC1	ZINC000853675218	GE	On-Demand	Anodyne	SIRT1	50	31
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	ALOX5	19	45
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	MAOB	23	50
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	LTA4H	19	42
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	PPARD	25	42
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	PLA2G4B	69	37
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	ACR	15	43
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	FFAR1	48	50
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	PPO2	17	48
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	FFAR4	25	40
CCOC(=O)COc1ccc(OCc2ccc(OC)cc2)cc1	ZINC000853675223	DG	On-Demand	Anodyne	PROKR1	41	31
CCCOc1cccc(COc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853675230	DI	On-Demand	Anodyne	ALOX5	26	44
CCCOc1cccc(COc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853675230	DI	On-Demand	Anodyne	MAOB	65	42
CCCOc1cccc(COc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853675230	DI	On-Demand	Anodyne	PLA2G4B	60	44
CCCOc1cccc(COc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853675230	DI	On-Demand	Anodyne	GYS1	46	36
CCCOc1cccc(COc2ccc(N(C)C(C)=O)cc2)c1	ZINC000853675230	DI	On-Demand	Anodyne	FFAR1	64	49
O=C(NCc1cnn(CCC2SCCS2)c1)OCc1ccccc1	ZINC000853675265	FH	On-Demand	Anodyne	CAPN2	41	32
O=C(NCc1cnn(CCC2SCCS2)c1)OCc1ccccc1	ZINC000853675265	FH	On-Demand	Anodyne	NPR	59	34
O=C(NCc1cnn(CCC2CCC2)c1)OCc1ccccc1	ZINC000853675266	DG	On-Demand	Anodyne	CTSB	23	40
O=C(NCc1cnn(CCC2CCC2)c1)OCc1ccccc1	ZINC000853675266	DG	On-Demand	Anodyne	CTSK	27	40
O=C(NCc1cnn(CCC2CCC2)c1)OCc1ccccc1	ZINC000853675266	DG	On-Demand	Anodyne	CTSL	36	40
O=C(NCc1cnn(CCC2CCC2)c1)OCc1ccccc1	ZINC000853675266	DG	On-Demand	Anodyne	PREP	36	42
O=C(NCc1cnn(CCC2CCC2)c1)OCc1ccccc1	ZINC000853675266	DG	On-Demand	Anodyne	CAPN2	49	37
O=C(NCc1cnn(CCC2CCC2)c1)OCc1ccccc1	ZINC000853675266	DG	On-Demand	Anodyne	NPR	61	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(=O)cc2Cl)CC1	ZINC000853675277	ED	On-Demand	Anodyne	P2RY12	82	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(=O)cc2Cl)CC1	ZINC000853675280	ED	On-Demand	Anodyne	P2RY12	82	39
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	CTSB	47	36
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	CYSP_TRYCR	44	35
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	CAPNS1	59	35
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	CAPN1	68	37
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	CAPN2	110	37
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	NPR	67	37
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	CARM1	29	40
CC(C)c1cccc(Cn2cc(CNC(=O)OCc3ccccc3)cn2)c1	ZINC000853675281	FI	On-Demand	Anodyne	PDS	58	45
CNC(=O)c1cc(Oc2cccc(OCCOC(F)F)c2C)ccn1	ZINC000853675283	FG	On-Demand	Anodyne	RAF1	63	42
CNC(=O)c1cc(Oc2cccc(OCCOC(F)F)c2C)ccn1	ZINC000853675283	FG	On-Demand	Anodyne	PYGM	28	40
COC[C@@H](COc1cccc(NC(=O)OC(C)(C)C)c1)OC	ZINC000853675284	DG	On-Demand	Anodyne	KCNK3	47	33
COC[C@@H](COc1cccc(NC(=O)OC(C)(C)C)c1)OC	ZINC000853675284	DG	On-Demand	Anodyne	KCNK9	44	33
COC[C@@H](COc1cccc(NC(=O)OC(C)(C)C)c1)OC	ZINC000853675284	DG	On-Demand	Anodyne	PDS	86	46
O=C(NCc1cnn(CC[C@@H]2CCc3ccccc32)c1)OCc1ccccc1	ZINC000853675293	GI	On-Demand	Anodyne	NPR	48	33
O=C(NCc1cnn(CC[C@H]2CCc3ccccc32)c1)OCc1ccccc1	ZINC000853675295	GI	On-Demand	Anodyne	NPR	48	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)nc(C)c2)CC1	ZINC000853675312	ED	On-Demand	Anodyne	P2RY12	133	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)nc(C)c2)CC1	ZINC000853675314	ED	On-Demand	Anodyne	P2RY12	133	40
OC1(CCOc2ccc(N3CCCC3)cc2)CCC1	ZINC000853675326	CF	On-Demand	Clean	HRH3	25	44
OC1(CCOc2ccc(N3CCCC3)cc2)CCC1	ZINC000853675326	CF	On-Demand	Clean	PSMB1	42	37
CS(=O)(=O)N1CC[C@@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675328	GD	On-Demand	Anodyne	CAPN2	52	33
CS(=O)(=O)N1CC[C@@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675328	GD	On-Demand	Anodyne	TGM2	36	44
CS(=O)(=O)N1CC[C@@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675328	GD	On-Demand	Anodyne	NPR	48	32
CS(=O)(=O)N1CC[C@@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675328	GD	On-Demand	Anodyne	F13A1	27	44
CS(=O)(=O)N1CC[C@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675330	GD	On-Demand	Anodyne	CAPN2	52	33
CS(=O)(=O)N1CC[C@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675330	GD	On-Demand	Anodyne	TGM2	36	44
CS(=O)(=O)N1CC[C@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675330	GD	On-Demand	Anodyne	NPR	48	32
CS(=O)(=O)N1CC[C@H](Cn2cc(CNC(=O)OCc3ccccc3)cn2)C1	ZINC000853675330	GD	On-Demand	Anodyne	F13A1	27	44
C#CCOCCOc1ccc(N2CCCC2)cc1	ZINC000853675379	BE	On-Demand	Mild	HRH3	27	44
C#CCOCCONC(=N)c1cccc(OC)c1	ZINC000853675380	BD	On-Demand	Mild	DRD4	42	33
COC(=O)C1(Cn2cc(CNC(=O)OCc3ccccc3)cn2)CC1	ZINC000853675405	EE	On-Demand	Anodyne	CTSK	21	40
COC(=O)C1(Cn2cc(CNC(=O)OCc3ccccc3)cn2)CC1	ZINC000853675405	EE	On-Demand	Anodyne	CAPN1	41	34
COC(=O)C1(Cn2cc(CNC(=O)OCc3ccccc3)cn2)CC1	ZINC000853675405	EE	On-Demand	Anodyne	CAPN2	74	34
COC(=O)C1(Cn2cc(CNC(=O)OCc3ccccc3)cn2)CC1	ZINC000853675405	EE	On-Demand	Anodyne	NPR	57	36
COC(=O)C1(Cn2cc(CNC(=O)OCc3ccccc3)cn2)CC1	ZINC000853675405	EE	On-Demand	Anodyne	SLC12A5	68	39
COC[C@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675412	ED	On-Demand	Anodyne	CYSP_TRYCR	48	35
COC[C@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675412	ED	On-Demand	Anodyne	CAPNS1	57	33
COC[C@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675412	ED	On-Demand	Anodyne	CAPN1	57	36
COC[C@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675412	ED	On-Demand	Anodyne	CAPN2	91	36
COC[C@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675412	ED	On-Demand	Anodyne	NPR	63	36
COC[C@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675412	ED	On-Demand	Anodyne	PDS	55	38
COC[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675413	ED	On-Demand	Anodyne	CYSP_TRYCR	48	35
COC[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675413	ED	On-Demand	Anodyne	CAPNS1	57	33
COC[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675413	ED	On-Demand	Anodyne	CAPN1	57	36
COC[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675413	ED	On-Demand	Anodyne	CAPN2	91	36
COC[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675413	ED	On-Demand	Anodyne	NPR	63	36
COC[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)OC	ZINC000853675413	ED	On-Demand	Anodyne	PDS	55	38
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](Nc2nccc3c(N)cccc23)C1	ZINC000853675418	FH	On-Demand	Anodyne	ACACB	15	45
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](Nc2nccc3c(N)cccc23)C1	ZINC000853675420	FH	On-Demand	Anodyne	ACACB	15	45
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](Nc2nccc3c(N)cccc23)C1	ZINC000853675422	FH	On-Demand	Anodyne	ACACB	15	45
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Nc2nccc3c(N)cccc23)C1	ZINC000853675424	FH	On-Demand	Anodyne	ACACB	15	45
Cn1cncc1CCOc1ccc(N2CCCC2)cc1	ZINC000853675453	CF	On-Demand	Clean	HRH3	37	44
Cn1cncc1CCOc1ccc(N2CCCC2)cc1	ZINC000853675453	CF	On-Demand	Clean	CYP2C19	23	40
N#Cc1ccc(CCOc2ccc(N3CCCC3)cc2)cc1	ZINC000853675473	CH	On-Demand	Mild	LTA4H	36	43
N#Cc1ccc(CCOc2ccc(N3CCCC3)cc2)cc1	ZINC000853675473	CH	On-Demand	Mild	HRH3	35	53
N#Cc1ccc(CCOc2ccc(N3CCCC3)cc2)cc1	ZINC000853675473	CH	On-Demand	Mild	PSMB2	31	40
N#Cc1ccc(CCOc2ccc(N3CCCC3)cc2)cc1	ZINC000853675473	CH	On-Demand	Mild	PSMB1	35	40
CCCOc1cccc(Cn2ccc(=O)cc2Cl)c1	ZINC000853675506	CG	On-Demand	Anodyne	UPP1	60	43
FC(F)OCCOc1ccc(N2CCCC2)cc1	ZINC000853675508	CF	On-Demand	Clean	HRH3	33	45
FC(F)OCCOc1ccc(N2CCCC2)cc1	ZINC000853675508	CF	On-Demand	Clean	PSMB1	40	38
Cc1cc(CO)cc(N[C@@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853675509	EF	On-Demand	Anodyne	ACACB	15	43
Cn1cncc1CCOc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853675510	DG	On-Demand	Anodyne	EPHX2	17	41
Cc1cc(CO)cc(N[C@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853675511	EF	On-Demand	Anodyne	ACACB	15	43
Cc1cc(CO)cc(N[C@@H]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853675514	EF	On-Demand	Anodyne	ACACB	15	43
Cc1cc(CO)cc(N[C@H]2CC[C@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853675516	EF	On-Demand	Anodyne	ACACB	15	43
Cn1cncc1CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675523	EE	On-Demand	Anodyne	CAPN1	40	34
Cn1cncc1CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675523	EE	On-Demand	Anodyne	CAPN2	78	34
Cn1cncc1CCn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675523	EE	On-Demand	Anodyne	NPR	62	35
O=C(NCc1cnn(CCCC2CCC2)c1)OCc1ccccc1	ZINC000853675546	EH	On-Demand	Anodyne	PREP	37	40
O=C(NCc1cnn(CCCC2CCC2)c1)OCc1ccccc1	ZINC000853675546	EH	On-Demand	Anodyne	CAPN2	45	36
O=C(NCc1cnn(CCCC2CCC2)c1)OCc1ccccc1	ZINC000853675546	EH	On-Demand	Anodyne	NPR	57	33
CN1CCC(CCNC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)CC1	ZINC000853675561	GF	On-Demand	Anodyne	GPR119	24	42
CCOC(=O)COc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853675563	EG	On-Demand	Anodyne	PLA2G4B	49	33
CCOC(=O)COc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853675563	EG	On-Demand	Anodyne	NR1H4	41	33
CCCc1ccc(OCCOC(F)F)cc1	ZINC000853675568	BG	On-Demand	Anodyne	PLA2G4B	58	36
CC(C)n1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675573	FF	On-Demand	Anodyne	CYSP_TRYCR	41	34
CC(C)n1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675573	FF	On-Demand	Anodyne	CAPNS1	58	34
CC(C)n1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675573	FF	On-Demand	Anodyne	CAPN1	61	38
CC(C)n1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675573	FF	On-Demand	Anodyne	CAPN2	99	36
CC(C)n1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675573	FF	On-Demand	Anodyne	NPR	66	36
CC(C)n1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675573	FF	On-Demand	Anodyne	PDS	51	34
CO[C@@H](COc1ccccc1C(=O)N(C)C)C1CCC1	ZINC000853675577	CF	On-Demand	Anodyne	ABCB1	25	40
CO[C@@H](COc1ccccc1C(=O)N(C)C)C1CCC1	ZINC000853675577	CF	On-Demand	Anodyne	HCN1	60	33
CO[C@@H](COc1ccccc1C(=O)N(C)C)C1CCC1	ZINC000853675577	CF	On-Demand	Anodyne	HCN4	49	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(N3CCCC3)cc2)CC1	ZINC000853675591	GE	On-Demand	Clean	P2RY12	90	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(N3CCCC3)cc2)CC1	ZINC000853675593	GE	On-Demand	Clean	P2RY12	90	43
N#CCC1(Cn2cc(CNC(=O)OCc3ccccc3)cn2)CC1	ZINC000853675596	DG	On-Demand	Mild	CTSL	16	40
N#CCC1(Cn2cc(CNC(=O)OCc3ccccc3)cn2)CC1	ZINC000853675596	DG	On-Demand	Mild	NPR	41	31
CN1CCC(CCNC(=O)NNc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853675598	EE	On-Demand	Reactive	WDR5	37	41
Cc1nonc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675608	EE	On-Demand	Anodyne	CAPN2	56	34
Cc1nonc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675608	EE	On-Demand	Anodyne	NPR	59	33
CN1CCC(CCNC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853675610	FG	On-Demand	Reactive	LCK	18	44
CN1CCC(CCNC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853675610	FG	On-Demand	Reactive	CSNK1D	38	41
CN1CCC(CCNC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853675610	FG	On-Demand	Reactive	SIRT3	57	36
CN1CCC(CCNC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853675610	FG	On-Demand	Reactive	SIRT2	57	36
CN1CCC(CCNC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853675610	FG	On-Demand	Reactive	SIRT1	56	36
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2C)CC1	ZINC000853675631	GD	On-Demand	Anodyne	P2RY12	151	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2ccccc2C)CC1	ZINC000853675631	GD	On-Demand	Anodyne	TGM2	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2C)CC1	ZINC000853675633	GD	On-Demand	Anodyne	P2RY12	151	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2ccccc2C)CC1	ZINC000853675633	GD	On-Demand	Anodyne	TGM2	19	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(-n3cccc3)cn2)CC1	ZINC000853675640	ED	On-Demand	Anodyne	P2RY12	64	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(-n3cccc3)cn2)CC1	ZINC000853675642	ED	On-Demand	Anodyne	P2RY12	64	38
O=C(c1ccccc1)N1CC[C@H](Cn2ccc(=O)cc2Cl)C1	ZINC000853675645	DF	On-Demand	Anodyne	L3MBTL3	48	34
O=C(c1ccccc1)N1CC[C@@H](Cn2ccc(=O)cc2Cl)C1	ZINC000853675646	DF	On-Demand	Anodyne	L3MBTL3	48	34
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(=O)cc2Cl)CC1	ZINC000853675649	FF	On-Demand	Anodyne	DRD4	38	53
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(=O)cc2Cl)CC1	ZINC000853675649	FF	On-Demand	Anodyne	HTR4	23	40
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(=O)cc2Cl)CC1	ZINC000853675649	FF	On-Demand	Anodyne	SIGMAR1	22	50
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(=O)cc2Cl)CC1	ZINC000853675649	FF	On-Demand	Anodyne	SSTR5	48	37
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(=O)cc2Cl)CC1	ZINC000853675649	FF	On-Demand	Anodyne	CCR3	17	40
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(=O)cc2Cl)CC1	ZINC000853675649	FF	On-Demand	Anodyne	MCHR1	31	40
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(=O)cc2Cl)CC1	ZINC000853675649	FF	On-Demand	Anodyne	CCR8	52	33
Cc1nonc1COc1ccc(N2CCCC2)cc1	ZINC000853675697	CF	On-Demand	Clean	CACNA2D1	52	43
Cc1nonc1COc1ccc(N2CCCC2)cc1	ZINC000853675697	CF	On-Demand	Clean	CACNA2D2	68	40
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)[C@@H]1CCOC1	ZINC000853675708	FE	On-Demand	Anodyne	CAPN2	57	33
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)[C@@H]1CCOC1	ZINC000853675708	FE	On-Demand	Anodyne	NPR	60	34
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)[C@H]1CCOC1	ZINC000853675710	FE	On-Demand	Anodyne	CAPN2	57	33
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)[C@H]1CCOC1	ZINC000853675710	FE	On-Demand	Anodyne	NPR	60	34
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCC1	ZINC000853675717	EG	On-Demand	Anodyne	CAPNS1	43	32
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCC1	ZINC000853675717	EG	On-Demand	Anodyne	CAPN1	47	36
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCC1	ZINC000853675717	EG	On-Demand	Anodyne	CAPN2	86	35
CO[C@@H](Cn1cc(CNC(=O)OCc2ccccc2)cn1)C1CCC1	ZINC000853675717	EG	On-Demand	Anodyne	NPR	58	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1cnccn1	ZINC000853675724	ED	On-Demand	Anodyne	GRIN2B	26	46
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1cnccn1	ZINC000853675725	ED	On-Demand	Anodyne	GRIN2B	26	46
FC1(F)C[C@@H]1OCCOc1ccc(N2CCCC2)cc1	ZINC000853675734	CG	On-Demand	Clean	HRH3	20	41
FC1(F)C[C@H]1OCCOc1ccc(N2CCCC2)cc1	ZINC000853675735	CG	On-Demand	Clean	HRH3	20	41
O=C(NCc1cnn(C[C@H]2COCCO2)c1)OCc1ccccc1	ZINC000853675746	ED	On-Demand	Anodyne	NPR	57	32
O=C(NCc1cnn(C[C@@H]2COCCO2)c1)OCc1ccccc1	ZINC000853675747	ED	On-Demand	Anodyne	NPR	57	32
CC(=O)Nc1ccc(CCNC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853675767	GF	On-Demand	Anodyne	ADRB2	31	43
CC(=O)Nc1ccc(CCNC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853675767	GF	On-Demand	Anodyne	ADRB1	42	43
CC(=O)Nc1ccc(CCNC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853675767	GF	On-Demand	Anodyne	ADRB3	66	43
CC(=O)Nc1ccc(CCNC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853675768	GF	On-Demand	Anodyne	ADRB2	31	43
CC(=O)Nc1ccc(CCNC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853675768	GF	On-Demand	Anodyne	ADRB1	42	43
CC(=O)Nc1ccc(CCNC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)cc1	ZINC000853675768	GF	On-Demand	Anodyne	ADRB3	66	43
CCn1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675773	ED	On-Demand	Anodyne	CAPN2	79	35
CCn1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675773	ED	On-Demand	Anodyne	NPR	60	34
CCn1ncnc1Cn1cc(CNC(=O)OCc2ccccc2)cn1	ZINC000853675773	ED	On-Demand	Anodyne	PDS	45	34
C[C@H](O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853675775	EG	On-Demand	Anodyne	GRIN2B	42	43
C[C@H](O)c1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853675775	EG	On-Demand	Anodyne	CHRNA10	41	34
C[C@H](O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853675777	EG	On-Demand	Anodyne	GRIN2B	42	43
C[C@H](O)c1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853675777	EG	On-Demand	Anodyne	CHRNA10	41	34
CC(=O)Nc1ccc(CCNC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853675784	GD	On-Demand	Anodyne	CA1	16	44
CC(=O)Nc1ccc(CCNC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853675784	GD	On-Demand	Anodyne	CA12	15	43
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3ncnc(F)c3Br)[C@@H]2C1	ZINC000853675803	GF	On-Demand	Anodyne	GPR119	45	42
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3cc(F)ncn3)[C@@H]2C1	ZINC000853675813	DE	On-Demand	Anodyne	GPR119	45	50
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3nc4ccc(N)cc4s3)[C@@H]2C1	ZINC000853675844	FG	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3cnc(F)cn3)[C@@H]2C1	ZINC000853675853	DE	On-Demand	Anodyne	GPR119	44	45
COC(=O)c1cn(CCSc2cccc(OC)c2)c(C2CC2)n1	ZINC000853675864	EG	On-Demand	Anodyne	MTNR1A	18	46
COC(=O)c1cn(CCSc2cccc(OC)c2)c(C2CC2)n1	ZINC000853675864	EG	On-Demand	Anodyne	MTNR1B	19	46
COC(=O)c1cn(CCSc2cccc(OC)c2)c(C2CC2)n1	ZINC000853675864	EG	On-Demand	Anodyne	FAS	27	44
C=C(Cl)COc1ccc(NC(=O)C(C)C)cc1	ZINC000853675880	CG	On-Demand	Mild	LTA4H	20	46
C=C(Cl)COc1ccc(NC(=O)C(C)C)cc1	ZINC000853675880	CG	On-Demand	Mild	SCN2A	20	40
CCCOc1cccc(Cn2cc(C(=O)OC)nc2C2CC2)c1	ZINC000853675892	DG	On-Demand	Anodyne	HRH2	33	41
CCOc1cc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)nc(C)n1	ZINC000853675914	EF	On-Demand	Anodyne	GPR119	36	46
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3ccc(N)c([N+](=O)[O-])n3)[C@@H]2C1	ZINC000853675918	EE	On-Demand	Bother	GPR119	28	45
CCCc1ccc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)nn1	ZINC000853675961	EF	On-Demand	Anodyne	GPR119	38	42
CCCOc1cccc(CN2C(=O)SC(C)(C)C2=O)c1	ZINC000853675981	CG	On-Demand	Anodyne	HRH2	26	40
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3cc(C#N)cnn3)[C@@H]2C1	ZINC000853675987	DD	On-Demand	Mild	GPR119	31	48
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3nc4ncccc4cc3C#N)[C@@H]2C1	ZINC000853675990	FF	On-Demand	Mild	GPR119	29	44
Cc1cc(CO)cc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)n1	ZINC000853676000	EE	On-Demand	Anodyne	GPR119	32	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2-c2nnco2)CC1	ZINC000853676006	FD	On-Demand	Anodyne	P2RY12	55	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2-c2nnco2)CC1	ZINC000853676007	FD	On-Demand	Anodyne	P2RY12	55	36
CCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nn(CCC2CCC2)c1=O	ZINC000853676021	GG	On-Demand	Anodyne	GPR119	37	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2F)CC1	ZINC000853676043	ED	On-Demand	Anodyne	P2RY12	87	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2F)CC1	ZINC000853676043	ED	On-Demand	Anodyne	GPR119	22	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2F)CC1	ZINC000853676045	ED	On-Demand	Anodyne	P2RY12	87	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2F)CC1	ZINC000853676045	ED	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3ccc(OCC(F)(F)F)nn3)[C@@H]2C1	ZINC000853676087	GF	On-Demand	Anodyne	GPR119	38	45
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000853676094	GE	On-Demand	Anodyne	P2RY12	60	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000853676094	GE	On-Demand	Anodyne	TGM2	25	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000853676094	GE	On-Demand	Anodyne	F13A1	44	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000853676096	GE	On-Demand	Anodyne	P2RY12	60	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000853676096	GE	On-Demand	Anodyne	TGM2	25	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000853676096	GE	On-Demand	Anodyne	F13A1	44	43
O=C(COc1cccnc1F)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853676106	FE	On-Demand	Anodyne	C3AR1	42	46
O=C(COc1cccnc1F)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853676106	FE	On-Demand	Anodyne	EPHX2	32	43
C[C@@](O)(c1ccc(OCCO[C@H]2CC2(F)F)cc1)C(F)(F)F	ZINC000853676165	EG	On-Demand	Anodyne	HSD11B1	24	41
C[C@@](O)(c1ccc(OCCO[C@@H]2CC2(F)F)cc1)C(F)(F)F	ZINC000853676169	EG	On-Demand	Anodyne	HSD11B1	24	41
Cn1ncnc1N1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21	ZINC000853676186	CD	On-Demand	Anodyne	GPR119	36	45
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3nccc4c(N)cccc34)[C@@H]2C1	ZINC000853676192	FG	On-Demand	Anodyne	GPR119	30	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)ccc2C#N)CC1	ZINC000853676196	FE	On-Demand	Mild	P2RY12	56	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)ccc2C#N)CC1	ZINC000853676196	FE	On-Demand	Mild	NOS2	17	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)ccc2C#N)CC1	ZINC000853676198	FE	On-Demand	Mild	P2RY12	56	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)ccc2C#N)CC1	ZINC000853676198	FE	On-Demand	Mild	NOS2	17	43
C#Cc1cccnc1N1CCN(c2ccc(OC)cn2)CC1	ZINC000853676208	CD	On-Demand	Mild	DRD4	19	41
Cc1cc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)cc(C#N)c1[N+](=O)[O-]	ZINC000853676241	FG	On-Demand	Mild	GPR119	18	42
C[C@@](O)(c1ccc(OCCc2ccc(C#N)cc2)cc1)C(F)(F)F	ZINC000853676263	EH	On-Demand	Mild	HSD11B1	20	45
CCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nn(Cc2cncs2)c1=O	ZINC000853676277	GF	On-Demand	Anodyne	GPR119	35	40
COC(=O)c1cn(Cc2ccc(OC)cc2)c(C2CC2)n1	ZINC000853676285	CF	On-Demand	Anodyne	MMP9	15	40
COC(=O)c1cn(Cc2ccc(OC)cc2)c(C2CC2)n1	ZINC000853676285	CF	On-Demand	Anodyne	MMP1	18	42
COC(=O)c1cn(Cc2ccc(OC)cc2)c(C2CC2)n1	ZINC000853676285	CF	On-Demand	Anodyne	PROKR1	60	33
CCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nn(CCC=C(C)C)c1=O	ZINC000853676287	GH	On-Demand	Anodyne	GPR119	31	40
CCCOc1cccc(COc2cccnc2F)c1	ZINC000853676288	CH	On-Demand	Anodyne	MAOB	18	42
COC(=O)C1(CN2C(=O)N[C@@](C)(c3cccnc3Cl)C2=O)CC1	ZINC000853676290	ED	On-Demand	Anodyne	G2YM83_BOTF4	40	35
COC(=O)C1(CN2C(=O)N[C@](C)(c3cccnc3Cl)C2=O)CC1	ZINC000853676293	ED	On-Demand	Anodyne	G2YM83_BOTF4	40	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)nc2)CC1	ZINC000853676309	ED	On-Demand	Anodyne	P2RY12	86	37
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)[C@@H]2C1	ZINC000853676324	GE	On-Demand	Bother	GPR119	26	47
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3cc(C(C)(C)C)ncn3)[C@@H]2C1	ZINC000853676338	EG	On-Demand	Anodyne	GPR119	43	50
Fc1cnc(N2CCC3(CC2)OCCc2ccccc23)cn1	ZINC000853676339	CF	On-Demand	Anodyne	SIGMAR1	17	50
CC(=O)Nc1cccc(OCCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853676463	GC	On-Demand	Anodyne	HRH2	36	41
CC(=O)Nc1cccc(OCCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853676463	GC	On-Demand	Anodyne	MTNR1A	32	43
CC(=O)Nc1cccc(OCCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853676463	GC	On-Demand	Anodyne	MTNR1B	24	43
CCOC(=O)c1nccc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)n1	ZINC000853676491	FE	On-Demand	Anodyne	GPR119	48	46
COC(=O)[C@@H](C)c1c(C)nn(Cc2ccc(OC)cc2)c1C	ZINC000853676496	DF	On-Demand	Anodyne	PROKR1	63	34
COC(=O)Cc1ccnc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1	ZINC000853676517	FE	On-Demand	Anodyne	GPR119	39	46
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(N)=O)cn2)CC1	ZINC000853676544	DB	On-Demand	Anodyne	P2RY12	45	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(N)=O)cn2)CC1	ZINC000853676545	DB	On-Demand	Anodyne	P2RY12	45	38
CO[C@@H](COc1ccc([C@](C)(O)C(F)(F)F)cc1)C1CCCC1	ZINC000853676585	EI	On-Demand	Anodyne	HSD11B1	26	42
CO[C@@H](COc1ccc([C@@](C)(O)C(F)(F)F)cc1)C1CCCC1	ZINC000853676587	EI	On-Demand	Anodyne	HSD11B1	26	42
C[C@@](O)(c1ccc(OCC2(CC#N)CC2)cc1)C(F)(F)F	ZINC000853676601	CH	On-Demand	Mild	HSD11B1	25	42
COC[C@@H](COc1ccc([C@@](C)(O)C(F)(F)F)cc1)OC	ZINC000853676605	DE	On-Demand	Anodyne	HSD11B1	19	44
COC[C@@H](COc1ccc([C@](C)(O)C(F)(F)F)cc1)OC	ZINC000853676606	DE	On-Demand	Anodyne	HSD11B1	19	44
C=C(Cl)COc1ccc([C@@](C)(O)C(F)(F)F)cc1	ZINC000853676611	CH	On-Demand	Mild	HSD11B1	23	47
C=C(Cl)COc1ccc([C@](C)(O)C(F)(F)F)cc1	ZINC000853676612	CH	On-Demand	Mild	HSD11B1	23	47
C[C@@](O)(c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676613	GH	On-Demand	Anodyne	GRIN2B	30	41
C[C@@](O)(c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676613	GH	On-Demand	Anodyne	HSD11B1	30	42
C[C@@](O)(c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676613	GH	On-Demand	Anodyne	CHEK2	17	43
C[C@@](O)(c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676613	GH	On-Demand	Anodyne	SLC18A3	15	42
C[C@@](O)(c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676614	GH	On-Demand	Anodyne	GRIN2B	30	41
C[C@@](O)(c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676614	GH	On-Demand	Anodyne	HSD11B1	30	42
C[C@@](O)(c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676614	GH	On-Demand	Anodyne	CHEK2	17	43
C[C@@](O)(c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1)C(F)(F)F	ZINC000853676614	GH	On-Demand	Anodyne	SLC18A3	15	42
CO[C@@H](COc1ccc([C@](C)(O)C(F)(F)F)cc1)C1CCC1	ZINC000853676619	DH	On-Demand	Anodyne	HSD11B1	25	42
CO[C@@H](COc1ccc([C@@](C)(O)C(F)(F)F)cc1)C1CCC1	ZINC000853676621	DH	On-Demand	Anodyne	HSD11B1	25	42
C[C@@](O)(c1ccc(OCCOCc2ccccc2)cc1)C(F)(F)F	ZINC000853676661	EI	On-Demand	Anodyne	HSD11B1	19	43
C#Cc1cccnc1N1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000853676662	GH	On-Demand	Mild	HTR1A	16	41
C#Cc1cccnc1N1CCC(N2CCN(c3cccc(Cl)c3)CC2)CC1	ZINC000853676662	GH	On-Demand	Mild	L3MBTL3	24	40
C#CCCCOc1cccnc1N1CCC2(CC1)OCCc1ccccc12	ZINC000853676708	FH	On-Demand	Mild	SIGMAR1	15	46
CON(C)CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853676740	DC	On-Demand	Anodyne	HRH2	29	46
CON(C)CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853676740	DC	On-Demand	Anodyne	MTNR1A	51	53
CON(C)CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853676740	DC	On-Demand	Anodyne	MTNR1B	46	53
CON(C)CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853676740	DC	On-Demand	Anodyne	EPHX2	20	41
CON(C)CCNC(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853676740	DC	On-Demand	Anodyne	KCNK3	40	36
CC(=O)c1ccc(N(C)C)cc1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853676746	FG	On-Demand	Anodyne	SMO	30	42
CC(=O)c1ccc(N(C)C)cc1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853676747	FG	On-Demand	Anodyne	SMO	30	42
COC(=O)c1nccc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)n1	ZINC000853676847	ED	On-Demand	Anodyne	GPR119	41	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(=O)OC)nc2C2CC2)CC1	ZINC000853676849	GD	On-Demand	Anodyne	P2RY12	139	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(=O)OC)nc2C2CC2)CC1	ZINC000853676850	GD	On-Demand	Anodyne	P2RY12	139	41
CC(C)(C)OC(=O)N1C[C@@H]2CCN(c3cnc(N4CCCC4=O)cn3)[C@@H]2C1	ZINC000853676853	FE	On-Demand	Anodyne	GPR119	32	42
O=C(c1ccccc1)N1CC[C@@H](COc2cccnc2F)C1	ZINC000853676857	DF	On-Demand	Anodyne	GRIN2B	44	39
O=C(c1ccccc1)N1CC[C@@H](COc2cccnc2F)C1	ZINC000853676857	DF	On-Demand	Anodyne	SLC18A3	16	41
O=C(c1ccccc1)N1CC[C@@H](COc2cccnc2F)C1	ZINC000853676857	DF	On-Demand	Anodyne	SMO	37	40
O=C(c1ccccc1)N1CC[C@H](COc2cccnc2F)C1	ZINC000853676858	DF	On-Demand	Anodyne	GRIN2B	44	39
O=C(c1ccccc1)N1CC[C@H](COc2cccnc2F)C1	ZINC000853676858	DF	On-Demand	Anodyne	SLC18A3	16	41
O=C(c1ccccc1)N1CC[C@H](COc2cccnc2F)C1	ZINC000853676858	DF	On-Demand	Anodyne	SMO	37	40
C#CCOCCOc1ccc(NC(=O)C(C)C)cc1	ZINC000853676865	CE	On-Demand	Mild	SCN2A	15	42
CC(=O)c1ccnc(N2CC[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)c1	ZINC000853676875	EF	On-Demand	Anodyne	GPR119	44	50
Cc1ccccc1CN1CCC(NC(=O)COc2cccnc2F)CC1	ZINC000853676879	FF	On-Demand	Anodyne	DRD4	27	51
Cc1ccccc1CN1CCC(NC(=O)COc2cccnc2F)CC1	ZINC000853676879	FF	On-Demand	Anodyne	SIGMAR1	21	50
Cc1ccccc1CN1CCC(NC(=O)COc2cccnc2F)CC1	ZINC000853676879	FF	On-Demand	Anodyne	SSTR5	57	39
Cc1ccccc1CN1CCC(NC(=O)COc2cccnc2F)CC1	ZINC000853676879	FF	On-Demand	Anodyne	CCR3	34	44
Cc1ccccc1CN1CCC(NC(=O)COc2cccnc2F)CC1	ZINC000853676879	FF	On-Demand	Anodyne	C3AR1	21	41
Cc1ccccc1CN1CCC(NC(=O)COc2cccnc2F)CC1	ZINC000853676879	FF	On-Demand	Anodyne	MCHR1	39	45
Cc1ccccc1CN1CCC(NC(=O)COc2cccnc2F)CC1	ZINC000853676879	FF	On-Demand	Anodyne	CCR8	27	42
C[C@@](O)(c1ccc(OCc2cccnc2N)cc1)C(F)(F)F	ZINC000853676891	DG	On-Demand	Anodyne	HSD11B1	16	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C)c(C#N)c2)CC1	ZINC000853676906	DD	On-Demand	Mild	P2RY12	53	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C)c(C#N)c2)CC1	ZINC000853676907	DD	On-Demand	Mild	P2RY12	53	40
C[C@@](O)(c1ccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)cc1)C(F)(F)F	ZINC000853676908	FE	On-Demand	Anodyne	HSD11B1	38	45
C[C@@](O)(c1ccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)cc1)C(F)(F)F	ZINC000853676908	FE	On-Demand	Anodyne	GCKR	72	42
C[C@@](O)(c1ccc(OC[C@H]2CCN(S(C)(=O)=O)C2)cc1)C(F)(F)F	ZINC000853676911	FE	On-Demand	Anodyne	HSD11B1	38	45
C[C@@](O)(c1ccc(OC[C@H]2CCN(S(C)(=O)=O)C2)cc1)C(F)(F)F	ZINC000853676911	FE	On-Demand	Anodyne	GCKR	72	42
C[C@@](O)(c1ccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1)C(F)(F)F	ZINC000853676922	DH	On-Demand	Anodyne	HSD11B1	28	43
COC(=O)c1cn(CCOCc2ccccc2)c(C2CC2)n1	ZINC000853676936	DF	On-Demand	Anodyne	GBA2	49	39
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2cnccn2)C1	ZINC000853676945	EC	On-Demand	Anodyne	GPR119	19	42
C#CCOCCOc1ccc([C@@](C)(O)C(F)(F)F)cc1	ZINC000853676946	CE	On-Demand	Mild	HSD11B1	17	46
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2cnccn2)C1	ZINC000853676947	EC	On-Demand	Anodyne	GPR119	19	42
C#CCOCCOc1ccc([C@](C)(O)C(F)(F)F)cc1	ZINC000853676948	CE	On-Demand	Mild	HSD11B1	17	46
O=c1cccc(Cl)n1CCCC1CCC1	ZINC000853676956	BG	On-Demand	Anodyne	CEL	38	41
CCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nn(C[C@H]2C[C@@H]3C[C@@H]3C2)c1=O	ZINC000853676986	GG	On-Demand	Anodyne	GPR119	29	41
CCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nn(CC2C[C@@H]3C[C@H]3C2)c1=O	ZINC000853676987	GG	On-Demand	Anodyne	GPR119	29	41
CCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nn(CC2C[C@H]3C[C@@H]3C2)c1=O	ZINC000853676988	GG	On-Demand	Anodyne	GPR119	29	41
O=[N+]([O-])c1ccc(N2CCC(CO)(NCC3CC3)CC2)cc1	ZINC000853677011	DD	On-Demand	Bother	SSTR1	38	41
COC(=O)c1cccc(NNC(=O)NCCCOc2ccccc2OC)c1C	ZINC000853677015	GF	On-Demand	Reactive	ADRA1D	17	40
N=C(COc1ccc(F)cc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853677018	FF	On-Demand	Anodyne	SLC18A3	16	42
N=C(COc1ccc(F)cc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853677019	FF	On-Demand	Anodyne	SLC18A3	16	42
C#Cc1cccnc1N1CCN(C(=O)c2cscn2)[C@@H](C)C1	ZINC000853677029	DD	On-Demand	Mild	LIMK2	54	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2CC(N)=O)CC1	ZINC000853677088	FC	On-Demand	Anodyne	P2RY12	84	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2CC(N)=O)CC1	ZINC000853677089	FC	On-Demand	Anodyne	P2RY12	84	41
CCCOc1cccc(Cn2c(Cl)cccc2=O)c1	ZINC000853677109	CG	On-Demand	Anodyne	HRH2	25	40
CCCOc1cccc(Cn2c(Cl)cccc2=O)c1	ZINC000853677109	CG	On-Demand	Anodyne	UPP1	45	40
C[C@@H](CCNC(=O)NCCN(C)C(=O)OC(C)(C)C)N(C)C	ZINC000853677119	DD	On-Demand	Anodyne	CHRNA3	15	40
C[C@@H](CCNC(=O)NCCN(C)C(=O)OC(C)(C)C)N(C)C	ZINC000853677119	DD	On-Demand	Anodyne	CHRNA4	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC000853677120	GE	On-Demand	Bother	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(Cl)cccc2[N+](=O)[O-])CC1	ZINC000853677121	GE	On-Demand	Bother	P2RY12	40	36
C[C@@](O)(c1ccc(OC[C@H]2COCCO2)cc1)C(F)(F)F	ZINC000853677122	DE	On-Demand	Anodyne	HSD11B1	20	40
C[C@@](O)(c1ccc(OC[C@@H]2COCCO2)cc1)C(F)(F)F	ZINC000853677124	DE	On-Demand	Anodyne	HSD11B1	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(Cl)cccc2=O)CC1	ZINC000853677147	ED	On-Demand	Anodyne	P2RY12	156	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(Cl)cccc2=O)CC1	ZINC000853677147	ED	On-Demand	Anodyne	MC4R	49	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(Cl)cccc2=O)CC1	ZINC000853677148	ED	On-Demand	Anodyne	P2RY12	156	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(Cl)cccc2=O)CC1	ZINC000853677148	ED	On-Demand	Anodyne	MC4R	49	37
C[C@@](O)(c1ccc(OCc2csc(Cl)n2)cc1)C(F)(F)F	ZINC000853677150	EI	On-Demand	Anodyne	HSD11B1	19	43
O=C(Cn1c(Cl)cccc1=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853677202	GE	On-Demand	Anodyne	EPHX2	26	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)CC)cc2F)CC1	ZINC000853677230	GE	On-Demand	Anodyne	P2RY12	40	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)CC)cc2F)CC1	ZINC000853677231	GE	On-Demand	Anodyne	P2RY12	40	39
Cn1cncc1CCOc1ccc(Cl)nc1	ZINC000853677238	BE	On-Demand	Anodyne	CHRNA4	21	40
C#CCCN(CCOC)C(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000853677252	DG	On-Demand	Mild	AMY2	42	29
C#CCCN(CCOC)C(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000853677253	DG	On-Demand	Mild	AMY2	42	29
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnnc2/C=C/c2ccccc2)CC1	ZINC000853677277	GD	On-Demand	Anodyne	P2RY12	140	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnnc2/C=C/c2ccccc2)CC1	ZINC000853677278	GD	On-Demand	Anodyne	P2RY12	140	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnnc2/C=C\c2ccccc2)CC1	ZINC000853677279	GD	On-Demand	Anodyne	P2RY12	140	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnnc2/C=C\c2ccccc2)CC1	ZINC000853677280	GD	On-Demand	Anodyne	P2RY12	140	40
O=[N+]([O-])c1cc(N2CCN(c3ncccc3[N+](=O)[O-])CC2)ccc1C(F)(F)F	ZINC000853677293	GG	On-Demand	Bother	TRPV1	26	52
O=[N+]([O-])c1cc(N2CCN(c3ncccc3[N+](=O)[O-])CC2)ccc1C(F)(F)F	ZINC000853677293	GG	On-Demand	Bother	SERPINE1	15	42
C#CCCCOc1cccnc1N1CCN(c2ccc(C(=O)OC)s2)CC1	ZINC000853677301	GG	On-Demand	Mild	DRD2	26	41
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C#N)c2ccccc2)CC1	ZINC000853677318	ED	On-Demand	Anodyne	P2RY12	158	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C#N)c2ccccc2)CC1	ZINC000853677319	ED	On-Demand	Anodyne	P2RY12	158	41
O=C(N[C@@H](c1ccccc1)c1nccs1)N1CCC(N2CCOC2=O)CC1	ZINC000853677363	GF	On-Demand	Anodyne	BIRC8	55	34
O=C(N[C@H](c1ccccc1)c1nccs1)N1CCC(N2CCOC2=O)CC1	ZINC000853677364	GF	On-Demand	Anodyne	BIRC8	55	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2-c2nc[nH]n2)CC1	ZINC000853677384	FD	On-Demand	Anodyne	P2RY12	170	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2-c2nc[nH]n2)CC1	ZINC000853677385	FD	On-Demand	Anodyne	P2RY12	170	41
C#CCCN(CCOC)C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853677430	ED	On-Demand	Mild	HRH2	24	41
C#CCCN(CCOC)C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853677430	ED	On-Demand	Mild	MTNR1A	26	46
C#CCCN(CCOC)C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853677430	ED	On-Demand	Mild	MTNR1B	26	46
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677431	FF	On-Demand	Anodyne	HRH2	41	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677431	FF	On-Demand	Anodyne	MTNR1A	29	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677431	FF	On-Demand	Anodyne	MTNR1B	26	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677431	FF	On-Demand	Anodyne	EPHX2	25	41
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677432	FF	On-Demand	Anodyne	HRH2	41	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677432	FF	On-Demand	Anodyne	MTNR1A	29	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677432	FF	On-Demand	Anodyne	MTNR1B	26	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853677432	FF	On-Demand	Anodyne	EPHX2	25	41
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677433	FF	On-Demand	Anodyne	HRH2	41	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677433	FF	On-Demand	Anodyne	MTNR1A	29	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677433	FF	On-Demand	Anodyne	MTNR1B	26	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677433	FF	On-Demand	Anodyne	EPHX2	25	41
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677434	FF	On-Demand	Anodyne	HRH2	41	42
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677434	FF	On-Demand	Anodyne	MTNR1A	29	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677434	FF	On-Demand	Anodyne	MTNR1B	26	45
CC(=O)Nc1cccc(OCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853677434	FF	On-Demand	Anodyne	EPHX2	25	41
CC(=O)c1ccc(N(C)C)cc1OCCOCc1ccccc1	ZINC000853677436	DH	On-Demand	Anodyne	MAOB	15	46
CO[C@@H](COc1ccc(Cl)nc1)C1CCCC1	ZINC000853677452	CG	On-Demand	Anodyne	CHRNA4	19	46
COC(=O)c1sc(N2CCC(CO)(NCC3CC3)CC2)nc1Cl	ZINC000853677458	FD	On-Demand	Anodyne	PARE	58	32
Fc1cc(N2CCC(N3CCN(c4cccc(Cl)c4)CC3)CC2)ncn1	ZINC000853677475	GG	On-Demand	Anodyne	HTR1A	18	44
Fc1cc(N2CCC(N3CCN(c4cccc(Cl)c4)CC3)CC2)ncn1	ZINC000853677475	GG	On-Demand	Anodyne	DCK	32	40
Cc1nonc1COc1ccccc1CC(N)=O	ZINC000853677489	BC	On-Demand	Anodyne	CACNA1D	17	51
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853677492	GE	On-Demand	Mild	MTNR1A	18	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCOc1cccc(NC(C)=O)c1	ZINC000853677492	GE	On-Demand	Mild	MTNR1B	15	42
CN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677530	FE	On-Demand	Anodyne	MME	40	38
CN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677530	FE	On-Demand	Anodyne	PAPA1_CARPA	40	41
CN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677530	FE	On-Demand	Anodyne	TACR3	15	41
CN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677530	FE	On-Demand	Anodyne	NPY5R	15	41
CN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677530	FE	On-Demand	Anodyne	FPR1	46	36
CN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677531	FE	On-Demand	Anodyne	MME	40	38
CN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677531	FE	On-Demand	Anodyne	PAPA1_CARPA	40	41
CN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677531	FE	On-Demand	Anodyne	TACR3	15	41
CN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677531	FE	On-Demand	Anodyne	NPY5R	15	41
CN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853677531	FE	On-Demand	Anodyne	FPR1	46	36
CN(CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000853677550	FF	On-Demand	Anodyne	EPHX2	20	43
COC(=O)C1(COc2ccc([C@@](C)(O)C(F)(F)F)cc2)CC1	ZINC000853677562	DF	On-Demand	Anodyne	HSD11B1	34	45
COC(=O)C1(COc2ccc([C@](C)(O)C(F)(F)F)cc2)CC1	ZINC000853677563	DF	On-Demand	Anodyne	HSD11B1	34	45
CCn1c(C2CCN(C(=O)OC(C)(C)C)CC2)nn(CC2CC=CC2)c1=O	ZINC000853677578	GG	On-Demand	Anodyne	GPR119	38	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)c(C)c2)CC1	ZINC000853677637	EE	On-Demand	Anodyne	P2RY12	71	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)c(C)c2)CC1	ZINC000853677638	EE	On-Demand	Anodyne	P2RY12	71	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2C)CC1	ZINC000853677645	DD	On-Demand	Anodyne	P2RY12	97	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2C)CC1	ZINC000853677645	DD	On-Demand	Anodyne	GPR119	34	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2C)CC1	ZINC000853677646	DD	On-Demand	Anodyne	P2RY12	97	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2C)CC1	ZINC000853677646	DD	On-Demand	Anodyne	GPR119	34	48
C[C@@](O)(c1ccc(OCCOC(F)F)cc1)C(F)(F)F	ZINC000853677695	DG	On-Demand	Anodyne	HSD11B1	21	45
Fc1cnc(N2CCC(N3CCN(c4cccc(Cl)c4)CC3)CC2)cn1	ZINC000853677711	GG	On-Demand	Anodyne	HTR1A	16	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Br)nc2)CC1	ZINC000853677721	GD	On-Demand	Anodyne	P2RY12	84	37
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	HTR1A	80	57
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	DRD2	70	47
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	DRD1	15	42
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	DRD4	52	46
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	ADRA1D	37	43
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	HTR2A	48	47
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	HTR2C	32	47
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	ADRA1A	44	43
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	ADRA1B	20	40
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	DRD3	90	43
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	HTR7	54	40
CON(C)CCNC(=O)NCCCCN1CCN(c2ncccn2)CC1	ZINC000853677722	FC	On-Demand	Anodyne	ATP6V0A1	15	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Br)nc2)CC1	ZINC000853677723	GD	On-Demand	Anodyne	P2RY12	84	37
C[C@@](O)(c1ccc(OCCC2SCCS2)cc1)C(F)(F)F	ZINC000853677735	EI	On-Demand	Anodyne	HSD11B1	25	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C#N)ccc2C)CC1	ZINC000853677753	ED	On-Demand	Mild	P2RY12	44	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C#N)ccc2C)CC1	ZINC000853677754	ED	On-Demand	Mild	P2RY12	44	37
C[C@@](O)(c1ccc(OCCC2(O)CCC2)cc1)C(F)(F)F	ZINC000853677758	DG	On-Demand	Anodyne	HSD11B1	29	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C(F)(F)F)n2)CC1	ZINC000853677778	GE	On-Demand	Anodyne	P2RY12	113	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C(F)(F)F)n2)CC1	ZINC000853677779	GE	On-Demand	Anodyne	P2RY12	113	40
C[C@@](O)(c1ccc(OCC2CC=CC2)cc1)C(F)(F)F	ZINC000853677783	CH	On-Demand	Anodyne	HSD11B1	29	44
C[C@@](O)(c1ccc(OCc2cc(C3CC3)no2)cc1)C(F)(F)F	ZINC000853677835	EH	On-Demand	Anodyne	HSD11B1	25	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C)c3cc([N+](=O)[O-])ccc32)CC1	ZINC000853677840	GE	On-Demand	Bother	P2RY12	44	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C)c3cc([N+](=O)[O-])ccc32)CC1	ZINC000853677840	GE	On-Demand	Bother	CTRB1	29	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C)c3cc([N+](=O)[O-])ccc32)CC1	ZINC000853677840	GE	On-Demand	Bother	F2RL3	46	32
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C)c3cc([N+](=O)[O-])ccc32)CC1	ZINC000853677844	GE	On-Demand	Bother	P2RY12	44	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C)c3cc([N+](=O)[O-])ccc32)CC1	ZINC000853677844	GE	On-Demand	Bother	CTRB1	29	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C)c3cc([N+](=O)[O-])ccc32)CC1	ZINC000853677844	GE	On-Demand	Bother	F2RL3	46	32
O=C(N[C@@H](c1ccccc1)c1nccs1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853677850	FE	On-Demand	Anodyne	BIRC8	48	35
O=C(N[C@@H](c1ccccc1)c1nccs1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853677851	FE	On-Demand	Anodyne	BIRC8	48	35
O=C(N[C@H](c1ccccc1)c1nccs1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853677853	FE	On-Demand	Anodyne	BIRC8	48	35
O=C(N[C@H](c1ccccc1)c1nccs1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853677854	FE	On-Demand	Anodyne	BIRC8	48	35
C[C@@](O)(c1ccc(OCc2c(F)cc([N+](=O)[O-])cc2F)cc1)C(F)(F)F	ZINC000853677890	GI	On-Demand	Bother	HSD11B1	16	50
N#CCCCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853677895	DG	On-Demand	Reactive	CSNK1D	38	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(N(C)C)ccc2C(C)=O)CC1	ZINC000853677929	GE	On-Demand	Anodyne	P2RY12	43	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(N(C)C)ccc2C(C)=O)CC1	ZINC000853677931	GE	On-Demand	Anodyne	P2RY12	43	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)COc2ccc(F)cc2)CC1	ZINC000853677932	GD	On-Demand	Anodyne	P2RY12	75	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)COc2ccc(F)cc2)CC1	ZINC000853677934	GD	On-Demand	Anodyne	P2RY12	75	37
CON(C)CCNC(=O)N[C@@H](c1ccccc1)C1CCC1	ZINC000853677967	CE	On-Demand	Anodyne	AMY2	44	31
CON(C)CCNC(=O)N[C@H](c1ccccc1)C1CCC1	ZINC000853677968	CE	On-Demand	Anodyne	AMY2	44	31
C#Cc1cccnc1N1CCN(c2ccc(C(=O)OC)s2)CC1	ZINC000853677984	EE	On-Demand	Mild	TRPV1	15	41
Fc1cc(N2CCC3(CC2)OCCc2ccccc23)ncn1	ZINC000853678000	CF	On-Demand	Anodyne	SIGMAR1	17	49
Fc1ncnc(N2CCC3(CC2)OCCc2ccccc23)c1Br	ZINC000853678006	GG	On-Demand	Anodyne	SIGMAR1	15	48
NC(=O)c1cn(CCCOc2cccc(C(F)(F)F)c2)nn1	ZINC000853678025	DD	On-Demand	Anodyne	GALR3	67	37
NC(=O)c1cn(CCCOc2cccc(C(F)(F)F)c2)nn1	ZINC000853678025	DD	On-Demand	Anodyne	PDS	43	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(CO)nc2)CC1	ZINC000853678057	EC	On-Demand	Anodyne	P2RY12	78	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(CO)nc2)CC1	ZINC000853678060	EC	On-Demand	Anodyne	P2RY12	78	37
C[C@@H]1Cc2ccccc2N1C(=O)Cn1cc(C(N)=O)nn1	ZINC000853678065	CC	On-Demand	Anodyne	DRD4	29	52
C[C@@H]1Cc2ccccc2N1C(=O)Cn1cc(C(N)=O)nn1	ZINC000853678065	CC	On-Demand	Anodyne	TPP2	77	40
COC(=O)c1ncccc1OC[C@H]1CCCCN1C(C)C	ZINC000853678067	CF	On-Demand	Anodyne	SCD	18	43
COC(=O)c1ncccc1OC[C@@H]1CCCCN1C(C)C	ZINC000853678069	CF	On-Demand	Anodyne	SCD	18	43
COCCOc1ccc(CNC(=O)Cn2cc(C(N)=O)nn2)cc1	ZINC000853678075	EB	On-Demand	Anodyne	CA9	15	41
COCCOc1ccc(CNC(=O)Cn2cc(C(N)=O)nn2)cc1	ZINC000853678075	EB	On-Demand	Anodyne	PROKR1	41	30
COC(=O)c1nccc(N2CC[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853678078	FE	On-Demand	Anodyne	ACACB	15	41
COC(=O)c1nccc(N2CC[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853678081	FE	On-Demand	Anodyne	ACACB	15	41
COC(=O)c1nccc(N2CC[C@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853678083	FE	On-Demand	Anodyne	ACACB	15	41
COC(=O)c1nccc(N2CC[C@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853678086	FE	On-Demand	Anodyne	ACACB	15	41
COc1ccc([C@@H]2CCCCCN2C(=O)Cn2cc(C(N)=O)nn2)cc1	ZINC000853678091	FD	On-Demand	Anodyne	CPT1A	104	45
CCOc1ccc([C@@H]2CCCN2C(=O)Cn2cc(C(N)=O)nn2)cc1	ZINC000853678111	ED	On-Demand	Anodyne	CPT1A	81	39
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCCC1	ZINC000853678134	EH	On-Demand	Anodyne	SLC6A1	50	34
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCCC1	ZINC000853678134	EH	On-Demand	Anodyne	GRIN2B	42	37
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCCC1	ZINC000853678134	EH	On-Demand	Anodyne	L3MBTL3	78	38
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCCC1	ZINC000853678136	EH	On-Demand	Anodyne	SLC6A1	50	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCCC1	ZINC000853678136	EH	On-Demand	Anodyne	GRIN2B	42	37
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCCCCC1	ZINC000853678136	EH	On-Demand	Anodyne	L3MBTL3	78	38
C[C@H]1CCc2ccccc2N1C(=O)Cn1cc(C(N)=O)nn1	ZINC000853678139	CC	On-Demand	Anodyne	DRD4	24	41
C[C@H]1CCc2ccccc2N1C(=O)Cn1cc(C(N)=O)nn1	ZINC000853678139	CC	On-Demand	Anodyne	TPP2	57	39
CN(C)S(=O)(=O)c1ccccc1NC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853678146	GD	On-Demand	Anodyne	GPR119	32	40
NC(=O)c1cn(CCCOc2ccc(Cl)cc2)nn1	ZINC000853678147	CD	On-Demand	Anodyne	HRH3	21	42
CN(C)S(=O)(=O)c1ccccc1NC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853678148	GD	On-Demand	Anodyne	GPR119	32	40
NC(=O)c1cn(CC[C@H]2CCCCO2)nn1	ZINC000853678152	BC	On-Demand	Anodyne	PDE8B	53	40
NC(=O)c1cn(CC[C@@H]2CCCCO2)nn1	ZINC000853678154	BC	On-Demand	Anodyne	PDE8B	53	40
NC(=O)c1cn(CC(=O)NCCCC2CCCCC2)nn1	ZINC000853678155	CC	On-Demand	Anodyne	BMP1	23	40
C[C@@H](Nc1ncnc(F)c1Br)C(=O)NCCc1ccccc1	ZINC000853678161	FF	On-Demand	Anodyne	AMP1_PLAFQ	39	45
CC(C)(C)OC(=O)N1CCO[C@H](CNc2cc(C#N)cnn2)C1	ZINC000853678194	DD	On-Demand	Mild	GPR119	28	42
CCOc1ccccc1OCCn1cc(C(N)=O)nn1	ZINC000853678197	CC	On-Demand	Anodyne	HCN1	47	33
CC(C)(C)OC(=O)N1CCO[C@@H](CNc2cc(C#N)cnn2)C1	ZINC000853678198	DD	On-Demand	Mild	GPR119	28	42
NC(=O)c1cn(Cc2cc(Cl)ccc2OCC2CC2)nn1	ZINC000853678202	DD	On-Demand	Anodyne	PTGER1	52	51
COC(=O)c1ncccc1OCCOC(F)F	ZINC000853678208	BD	On-Demand	Anodyne	MAP1	27	41
NC(=O)c1cn(Cc2ccc(C3CCCCC3)cc2)nn1	ZINC000853678214	CE	On-Demand	Anodyne	S1PR5	20	42
CCCOc1cccc(CNC(=O)Cn2cc(C(N)=O)nn2)c1	ZINC000853678243	DC	On-Demand	Anodyne	PDS	50	35
CC(C)(C)OC(=O)N1CCO[C@H](CNc2cc(C(C)(C)C)ncn2)C1	ZINC000853678244	FF	On-Demand	Anodyne	GPR119	44	36
CC(C)(C)OC(=O)N1CCO[C@@H](CNc2cc(C(C)(C)C)ncn2)C1	ZINC000853678246	FF	On-Demand	Anodyne	GPR119	44	36
COC(=O)c1ncccc1OCCC=C(C)C	ZINC000853678260	BF	On-Demand	Anodyne	MAP1	34	40
Cc1ccccc1CN1CCC(NC(=O)Cn2cc(C(N)=O)nn2)CC1	ZINC000853678261	FC	On-Demand	Anodyne	DRD4	20	52
Cc1ccccc1CN1CCC(NC(=O)Cn2cc(C(N)=O)nn2)CC1	ZINC000853678261	FC	On-Demand	Anodyne	SIGMAR1	20	50
Cc1ccccc1CN1CCC(NC(=O)Cn2cc(C(N)=O)nn2)CC1	ZINC000853678261	FC	On-Demand	Anodyne	SSTR5	41	39
Cc1ccccc1CN1CCC(NC(=O)Cn2cc(C(N)=O)nn2)CC1	ZINC000853678261	FC	On-Demand	Anodyne	MCHR1	26	40
NC(=O)c1cn(CCOC[C@H]2CCCO2)nn1	ZINC000853678280	BB	On-Demand	Anodyne	PDE8B	42	34
NC(=O)c1cn(CCOC[C@@H]2CCCO2)nn1	ZINC000853678282	BB	On-Demand	Anodyne	PDE8B	42	34
N=C(Cc1cccnc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678285	EE	On-Demand	Anodyne	GRIN2B	45	47
N=C(Cc1cccnc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678285	EE	On-Demand	Anodyne	CHRNA7	45	40
N=C(Cc1cccnc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678285	EE	On-Demand	Anodyne	ACHP_LYMST	26	40
N=C(Cc1cccnc1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678285	EE	On-Demand	Anodyne	NAMPT	28	43
N=C(Cc1cccnc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678287	EE	On-Demand	Anodyne	GRIN2B	45	47
N=C(Cc1cccnc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678287	EE	On-Demand	Anodyne	CHRNA7	45	40
N=C(Cc1cccnc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678287	EE	On-Demand	Anodyne	ACHP_LYMST	26	40
N=C(Cc1cccnc1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853678287	EE	On-Demand	Anodyne	NAMPT	28	43
C[C@@H](Nc1cc(F)ncn1)C(=O)NCCc1ccccc1	ZINC000853678346	CD	On-Demand	Anodyne	AMP1_PLAFQ	33	43
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(Cc3ccccc3C)n2)CC1	ZINC000853678375	GD	On-Demand	Anodyne	P2RY12	71	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(Cc3ccccc3C)n2)CC1	ZINC000853678378	GD	On-Demand	Anodyne	P2RY12	71	37
COc1ccc([C@@H]2CCCN2C(=O)Cn2cc(C(N)=O)nn2)c(OC)c1	ZINC000853678387	FC	On-Demand	Anodyne	FKBP1A	41	37
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2cccnc2)CC1	ZINC000853678397	GE	On-Demand	Anodyne	DRD4	21	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2cccnc2)CC1	ZINC000853678397	GE	On-Demand	Anodyne	SIGMAR1	22	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2cccnc2)CC1	ZINC000853678397	GE	On-Demand	Anodyne	SSTR5	47	39
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2cccnc2)CC1	ZINC000853678397	GE	On-Demand	Anodyne	CHRNA7	43	36
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2cccnc2)CC1	ZINC000853678397	GE	On-Demand	Anodyne	C3AR1	42	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2cccnc2)CC1	ZINC000853678397	GE	On-Demand	Anodyne	MCHR1	26	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)Cc2cccnc2)CC1	ZINC000853678397	GE	On-Demand	Anodyne	CCR8	18	41
NC(=O)c1cn(CC(=O)NCC2(c3ccccc3)CCOCC2)nn1	ZINC000853678402	EC	On-Demand	Anodyne	NPFFR1	35	44
NC(=O)c1cn(CCOc2ccccc2C(F)(F)F)nn1	ZINC000853678404	DD	On-Demand	Anodyne	PLK1	43	34
NC(=O)c1cn(CCOc2ccccc2C(F)(F)F)nn1	ZINC000853678404	DD	On-Demand	Anodyne	SCD1	15	43
C#CCCCOc1cccnc1N[C@H](C)C(=O)NCCc1ccccc1	ZINC000853678406	FG	On-Demand	Mild	PPIA	38	40
CS(=O)(=O)c1cccc(OCCn2cc(C(N)=O)nn2)c1	ZINC000853678419	DB	On-Demand	Anodyne	NR1H3	40	36
C[C@@H](Nc1cnc(F)cn1)C(=O)NCCc1ccccc1	ZINC000853678421	CD	On-Demand	Anodyne	AMP1_PLAFQ	29	44
CCCCCCn1cc(C(N)=O)nn1	ZINC000853678422	AC	On-Demand	Anodyne	ADA	29	43
CCCCCCn1cc(C(N)=O)nn1	ZINC000853678422	AC	On-Demand	Anodyne	GBA	15	48
CCC(CC)COc1cccnc1C(=O)OC	ZINC000853678445	BF	On-Demand	Anodyne	MAP1	28	43
CC(C)(C)OC(=O)N1CCC(CCn2cc(C(N)=O)nn2)CC1	ZINC000853678472	DD	On-Demand	Anodyne	GPR119	49	47
COC(=O)c1ncccc1OCc1cccc(C(C)C)c1	ZINC000853678497	CH	On-Demand	Anodyne	PPIA	43	46
COC(=O)c1ncccc1OCc1cccc(C(C)C)c1	ZINC000853678497	CH	On-Demand	Anodyne	MAP1	22	43
NC(=O)c1cn(CC[C@H]2CCCO2)nn1	ZINC000853678503	BB	On-Demand	Anodyne	PDE8B	48	36
NC(=O)c1cn(CC[C@@H]2CCCO2)nn1	ZINC000853678505	BB	On-Demand	Anodyne	PDE8B	48	36
C[C@@H](OCCCNC(=O)Cn1cc(C(N)=O)nn1)c1ccccc1	ZINC000853678530	EC	On-Demand	Anodyne	C3AR1	46	32
CCCCCCCCn1cc(C(N)=O)nn1	ZINC000853678539	BD	On-Demand	Mild	ADA	29	43
CCCCCCCCn1cc(C(N)=O)nn1	ZINC000853678539	BD	On-Demand	Mild	GBA	15	48
CCOc1ccc([C@@H](C)NC(=O)Cn2cc(C(N)=O)nn2)cc1OC	ZINC000853678609	EC	On-Demand	Anodyne	ENPP1	56	34
NC(=O)c1cn(CCCCOc2cccc(C(F)(F)F)c2)nn1	ZINC000853678623	EE	On-Demand	Anodyne	DRTS_LEIMA	15	46
NC(=O)c1cn(CCCCOc2cccc(C(F)(F)F)c2)nn1	ZINC000853678623	EE	On-Demand	Anodyne	GALR3	67	36
NC(=O)c1cn(CCCCOc2cccc(C(F)(F)F)c2)nn1	ZINC000853678623	EE	On-Demand	Anodyne	PDS	43	45
C[C@@H]1CCN(c2cc(F)ncn2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678626	DF	On-Demand	Anodyne	SIRT3	33	41
C[C@@H]1CCN(c2cc(F)ncn2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678626	DF	On-Demand	Anodyne	SIRT2	29	41
C[C@@H]1CCN(c2cc(F)ncn2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678626	DF	On-Demand	Anodyne	SIRT1	28	41
C[C@H]1CCN(c2cc(F)ncn2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678627	DF	On-Demand	Anodyne	SIRT3	33	41
C[C@H]1CCN(c2cc(F)ncn2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678627	DF	On-Demand	Anodyne	SIRT2	29	41
C[C@H]1CCN(c2cc(F)ncn2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678627	DF	On-Demand	Anodyne	SIRT1	28	41
C[C@H]1CCN(c2cc(F)ncn2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678628	DF	On-Demand	Anodyne	SIRT3	33	41
C[C@H]1CCN(c2cc(F)ncn2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678628	DF	On-Demand	Anodyne	SIRT2	29	41
C[C@H]1CCN(c2cc(F)ncn2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678628	DF	On-Demand	Anodyne	SIRT1	28	41
C[C@@H]1CCN(c2cc(F)ncn2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678629	DF	On-Demand	Anodyne	SIRT3	33	41
C[C@@H]1CCN(c2cc(F)ncn2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678629	DF	On-Demand	Anodyne	SIRT2	29	41
C[C@@H]1CCN(c2cc(F)ncn2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678629	DF	On-Demand	Anodyne	SIRT1	28	41
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	CHRM2	15	41
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	CHRM1	15	50
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	DRD2	21	45
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	DRD4	47	44
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	ACHE	41	45
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	KCNH2	18	41
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	HTR4	16	41
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	CHRM3	19	50
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	SIGMAR1	45	52
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	SSTR5	58	41
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	CCR3	29	41
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	CHRNA7	46	39
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	C3AR1	47	44
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	MCHR1	52	45
C[C@@H](ONC(=N)Cc1cccnc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853678637	GE	On-Demand	Anodyne	CCR8	18	43
COC(=O)c1ncccc1OCCO[Si](C)(C)C(C)(C)C	ZINC000853678641	DG	On-Demand	Reactive	MAP1	27	40
COC(=O)c1ncccc1OCCSc1cccc(OC)c1	ZINC000853678660	DG	On-Demand	Anodyne	LTB4R	15	40
COC(=O)c1ncccc1OCCSc1cccc(OC)c1	ZINC000853678660	DG	On-Demand	Anodyne	MTNR1A	29	52
COC(=O)c1ncccc1OCCSc1cccc(OC)c1	ZINC000853678660	DG	On-Demand	Anodyne	MTNR1B	36	52
COC(=O)c1ncccc1OCCSc1cccc(OC)c1	ZINC000853678660	DG	On-Demand	Anodyne	FAS	42	44
NC(=O)c1cn(Cc2ccc(CN3CCCCC3)cc2)nn1	ZINC000853678665	CD	On-Demand	Anodyne	HRH3	26	47
NC(=O)c1cn(Cc2ccc(CN3CCCCC3)cc2)nn1	ZINC000853678665	CD	On-Demand	Anodyne	SIGMAR1	15	46
NC(=O)c1cn(CCSCc2ccccc2)nn1	ZINC000853678672	CD	On-Demand	Anodyne	CACNA2D1	20	43
C[C@@H]1CCN(c2nc(C#N)c(Cl)s2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678678	FH	On-Demand	Mild	PARE	46	33
C[C@@H]1CCN(c2nc(C#N)c(Cl)s2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678679	FH	On-Demand	Mild	PARE	46	33
C[C@H]1CCN(c2nc(C#N)c(Cl)s2)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678680	FH	On-Demand	Mild	PARE	46	33
C[C@H]1CCN(c2nc(C#N)c(Cl)s2)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678681	FH	On-Demand	Mild	PARE	46	33
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)Cc2cccnc2)C1	ZINC000853678701	FD	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)Cc2cccnc2)C1	ZINC000853678702	FD	On-Demand	Anodyne	GPR119	24	41
CCCOc1cccc(COc2cccnc2C(=O)OC)c1	ZINC000853678703	DG	On-Demand	Anodyne	PPIA	41	44
CCCOc1cccc(COc2cccnc2C(=O)OC)c1	ZINC000853678703	DG	On-Demand	Anodyne	MTNR1B	15	40
Cc1ccn(CCCCC2(C)OCCO2)c(=O)c1C#N	ZINC000853678708	CD	On-Demand	Mild	GRM2	15	40
NC(=O)c1cn(CC(=O)NCCOc2ccc3c(c2)OCO3)nn1	ZINC000853678726	EB	On-Demand	Anodyne	EDNRA	32	41
NC(=O)c1cn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)nn1	ZINC000853678728	FB	On-Demand	Clean	STAT6	45	33
NC(=O)c1cn(CC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)nn1	ZINC000853678740	FE	On-Demand	Anodyne	KCNA5	17	40
NC(=O)c1cn(CC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)nn1	ZINC000853678741	FE	On-Demand	Anodyne	KCNA5	17	40
NC(=O)c1cn(CCCCc2ccccc2)nn1	ZINC000853678776	BD	On-Demand	Anodyne	SIGMAR1	24	40
NC(=O)c1cn(CCCCc2ccccc2)nn1	ZINC000853678776	BD	On-Demand	Anodyne	FAAH	79	46
NC(=O)c1cn(CCCCc2ccccc2)nn1	ZINC000853678776	BD	On-Demand	Anodyne	CES1	73	39
NC(=O)c1cn(CCCCc2ccccc2)nn1	ZINC000853678776	BD	On-Demand	Anodyne	CES1D	44	32
CCCCCCCCCn1cc(C(N)=O)nn1	ZINC000853678790	BE	On-Demand	Mild	ADA	29	43
CCCCCCCCCn1cc(C(N)=O)nn1	ZINC000853678790	BE	On-Demand	Mild	GBA	15	48
NC(=O)c1cn(C[C@H]2CCCCO2)nn1	ZINC000853678797	BB	On-Demand	Anodyne	PDE8B	63	46
NC(=O)c1cn(C[C@@H]2CCCCO2)nn1	ZINC000853678798	BB	On-Demand	Anodyne	PDE8B	63	46
NC(=O)c1cn(CC(=O)N[C@@H]2CCCc3ccccc32)nn1	ZINC000853678823	CC	On-Demand	Anodyne	BDKRB1	53	39
NC(=O)c1cn(CC(=O)N[C@H]2CCCc3ccccc32)nn1	ZINC000853678824	CC	On-Demand	Anodyne	BDKRB1	53	39
COC(=O)c1ncccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853678831	GE	On-Demand	Anodyne	DRD4	24	49
COC(=O)c1ncccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853678831	GE	On-Demand	Anodyne	SIGMAR1	18	50
COC(=O)c1ncccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853678831	GE	On-Demand	Anodyne	SSTR5	55	40
COC(=O)c1ncccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853678831	GE	On-Demand	Anodyne	MCHR1	24	44
COC(=O)c1ncccc1OCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853678831	GE	On-Demand	Anodyne	CCR8	30	43
CC(C)(C)OC(=O)N1CCC(CCCn2cc(C(N)=O)nn2)CC1	ZINC000853678843	ED	On-Demand	Anodyne	GPR119	47	45
C[C@H]1CCN(c2cc(O)nc3cccnc23)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678848	FG	On-Demand	Anodyne	ACACB	15	42
C[C@@H]1CCN(c2cc(O)nc3cccnc23)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853678849	FG	On-Demand	Anodyne	ACACB	15	42
C[C@H]1CCN(c2cc(O)nc3cccnc23)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678850	FG	On-Demand	Anodyne	ACACB	15	42
C[C@@H]1CCN(c2cc(O)nc3cccnc23)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853678851	FG	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)N1CCc2ccc(Cn3cc(C(N)=O)nn3)cc2C1	ZINC000853678857	FD	On-Demand	Anodyne	KDM1A	17	44
COC(=O)[C@@H]1CN(c2cc(F)ncn2)C[C@@H]1c1ccccc1	ZINC000853678865	DE	On-Demand	Anodyne	SLC6A3	35	41
C#Cc1cccnc1N1C[C@@H](C(=O)OC)[C@@H](c2ccccc2)C1	ZINC000853678867	DE	On-Demand	Mild	SLC6A3	17	46
NC(=O)c1cn(Cc2ccc(C3CCCC3)cc2)nn1	ZINC000853678874	CE	On-Demand	Anodyne	S1PR5	20	41
COc1cccc(SCCn2cc(C(N)=O)nn2)c1	ZINC000853678895	CD	On-Demand	Anodyne	MTNR1A	21	50
COc1cccc(SCCn2cc(C(N)=O)nn2)c1	ZINC000853678895	CD	On-Demand	Anodyne	MTNR1B	23	50
CC(C)c1cccc(Cn2cc(C(N)=O)nn2)c1	ZINC000853678905	BD	On-Demand	Anodyne	ESRRA	19	44
COC(=O)c1ncccc1OCC[C@@H](C)O	ZINC000853678908	BD	On-Demand	Anodyne	MAP1	29	40
COC(=O)c1ncccc1OCC[C@H](C)O	ZINC000853678909	BD	On-Demand	Anodyne	MAP1	29	40
CCCOc1cccc(Cn2cc(C(N)=O)nn2)c1	ZINC000853678911	CD	On-Demand	Anodyne	HRH2	30	44
CCCOc1cccc(Cn2cc(C(N)=O)nn2)c1	ZINC000853678911	CD	On-Demand	Anodyne	PLA2G2A	25	40
CCCOc1cccc(Cn2cc(C(N)=O)nn2)c1	ZINC000853678911	CD	On-Demand	Anodyne	UPP1	44	39
NC(=O)c1cn(CC(=O)NCC2(c3ccccc3)CCCCC2)nn1	ZINC000853678927	ED	On-Demand	Anodyne	NMBR	57	36
NC(=O)c1cn(CC(=O)NCC2(c3ccccc3)CCCCC2)nn1	ZINC000853678927	ED	On-Demand	Anodyne	NPFFR1	37	45
CCCN(CCC)C(=O)Cn1cc(C(N)=O)nn1	ZINC000853678940	CC	On-Demand	Anodyne	TSPO	21	40
COc1cccc(OCCn2cc(C(N)=O)nn2)c1	ZINC000853678944	CC	On-Demand	Anodyne	MTNR1A	31	47
COc1cccc(OCCn2cc(C(N)=O)nn2)c1	ZINC000853678944	CC	On-Demand	Anodyne	MTNR1B	32	47
COc1cccc(OCCn2cc(C(N)=O)nn2)c1	ZINC000853678944	CC	On-Demand	Anodyne	ROCK2	40	33
NC(=O)c1cn(CC(=O)NCCOc2cccc(C(F)(F)F)c2)nn1	ZINC000853678968	FC	On-Demand	Anodyne	HRH2	20	41
NC(=O)c1cn(CC(=O)NCCOc2cccc(C(F)(F)F)c2)nn1	ZINC000853678968	FC	On-Demand	Anodyne	PDS	44	45
NC(=O)c1cn(CC(=O)NCc2cccc(OCC(F)(F)F)c2)nn1	ZINC000853678989	FC	On-Demand	Anodyne	PDS	43	39
COC(=O)c1ncccc1OC[C@H](OC)C1CCCCC1	ZINC000853679034	CF	On-Demand	Anodyne	MAP1	16	41
COC(=O)c1ncccc1OC[C@@H](OC)C1CCCCC1	ZINC000853679035	CF	On-Demand	Anodyne	MAP1	16	41
Cc1cc(CO)cc(N2CC[C@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853679077	EF	On-Demand	Anodyne	ACACB	15	43
Cc1cc(CO)cc(N2CC[C@@H](C)[C@@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853679078	EF	On-Demand	Anodyne	ACACB	15	43
Cc1cc(CO)cc(N2CC[C@@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853679079	EF	On-Demand	Anodyne	ACACB	15	43
Cc1cc(CO)cc(N2CC[C@H](C)[C@H](CNC(=O)OC(C)(C)C)C2)n1	ZINC000853679080	EF	On-Demand	Anodyne	ACACB	15	43
NC(=O)c1cn(Cc2cccc(CN3CCCCC3)c2)nn1	ZINC000853679115	CD	On-Demand	Anodyne	HRH2	32	40
NC(=O)c1cn(Cc2cccc(CN3CCCCC3)c2)nn1	ZINC000853679115	CD	On-Demand	Anodyne	HRH3	15	43
NC(=O)c1cn(Cc2cccc(CN3CCCCC3)c2)nn1	ZINC000853679115	CD	On-Demand	Anodyne	SIGMAR1	19	47
NC(=O)c1cn(Cc2cccc(CN3CCCCC3)c2)nn1	ZINC000853679115	CD	On-Demand	Anodyne	FAAH	17	43
CCC[C@H](NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2)c1ccccn1	ZINC000853679122	GH	On-Demand	Anodyne	GPR119	35	42
COc1ccc(OC)c([C@H]2CCCN2C(=O)Cn2cc(C(N)=O)nn2)c1	ZINC000853679135	FC	On-Demand	Anodyne	FKBP1A	40	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)nc2)CC1	ZINC000853679147	ED	On-Demand	Anodyne	P2RY12	89	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)nc2)CC1	ZINC000853679148	ED	On-Demand	Anodyne	P2RY12	89	37
CCCOc1ccc(OCCn2cc(C(N)=O)nn2)cc1	ZINC000853679194	CD	On-Demand	Anodyne	PLA2G4B	51	32
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853679204	FD	On-Demand	Anodyne	SIRT3	64	46
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853679204	FD	On-Demand	Anodyne	SIRT2	59	46
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853679204	FD	On-Demand	Anodyne	SIRT1	54	46
C[C@H]1CCN(c2ncnc3c2nnn3C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853679206	FD	On-Demand	Anodyne	SIRT3	64	46
C[C@H]1CCN(c2ncnc3c2nnn3C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853679206	FD	On-Demand	Anodyne	SIRT2	59	46
C[C@H]1CCN(c2ncnc3c2nnn3C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853679206	FD	On-Demand	Anodyne	SIRT1	54	46
C[C@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853679207	FD	On-Demand	Anodyne	SIRT3	64	46
C[C@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853679207	FD	On-Demand	Anodyne	SIRT2	59	46
C[C@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000853679207	FD	On-Demand	Anodyne	SIRT1	54	46
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853679209	FD	On-Demand	Anodyne	SIRT3	64	46
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853679209	FD	On-Demand	Anodyne	SIRT2	59	46
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853679209	FD	On-Demand	Anodyne	SIRT1	54	46
CC(C)(C)OC(=O)N1CCO[C@@H](CN(c2ccccc2F)S(C)(=O)=O)C1	ZINC000853679220	GE	On-Demand	Anodyne	GPR119	42	40
CC(C)(C)OC(=O)N1CCO[C@H](CN(c2ccccc2F)S(C)(=O)=O)C1	ZINC000853679222	GE	On-Demand	Anodyne	GPR119	42	40
CCN1CC[C@H](ONC(=N)Cc2cccnc2)C1=O	ZINC000853679232	CC	On-Demand	Anodyne	CHRNA7	45	37
Cn1ncc(C#N)c1NC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853679238	DD	On-Demand	Mild	GPR119	30	41
Cn1ncc(C#N)c1NC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853679244	DD	On-Demand	Mild	GPR119	30	41
COC(=O)[C@@H]1CN(c2cc(Cl)nc3cc(C)nn23)C[C@@H]1c1ccccc1	ZINC000853679276	FG	On-Demand	Anodyne	SLC6A3	15	43
NC(=O)c1cn(Cc2cccc(CN3CCOCC3)c2)nn1	ZINC000853679283	DC	On-Demand	Anodyne	SIGMAR1	15	48
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc(C(N)=O)nn2)C1	ZINC000853679288	DD	On-Demand	Anodyne	GPR119	38	43
CC(C)(C)OC(=O)N1CC[C@H](CCn2cc(C(N)=O)nn2)C1	ZINC000853679289	DD	On-Demand	Anodyne	GPR119	38	43
COC(=O)[C@@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])C[C@@H]1c1ccccc1	ZINC000853679300	GH	On-Demand	Bother	SLC6A3	26	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccnc2)CC1	ZINC000853679305	FC	On-Demand	Anodyne	P2RY12	60	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccnc2)CC1	ZINC000853679305	FC	On-Demand	Anodyne	GRIN2B	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccnc2)CC1	ZINC000853679305	FC	On-Demand	Anodyne	PTAFR	31	41
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccnc2)CC1	ZINC000853679306	FC	On-Demand	Anodyne	P2RY12	60	37
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccnc2)CC1	ZINC000853679306	FC	On-Demand	Anodyne	GRIN2B	15	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccnc2)CC1	ZINC000853679306	FC	On-Demand	Anodyne	PTAFR	31	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2cc(C(N)=O)nn2)CC1	ZINC000853679319	ED	On-Demand	Anodyne	ACACB	15	40
NC(=O)c1cn(CC(=O)NCCCc2ccccc2)nn1	ZINC000853679331	CC	On-Demand	Anodyne	HRH2	18	42
NC(=O)c1cn(CC(=O)NCCCc2ccccc2)nn1	ZINC000853679331	CC	On-Demand	Anodyne	AMP1_PLAFQ	21	40
NC(=O)c1cn(CC(=O)NCCCc2ccccc2)nn1	ZINC000853679331	CC	On-Demand	Anodyne	CRTM	34	41
COC(=O)[C@@H]1CN(c2cnc(F)cn2)C[C@@H]1c1ccccc1	ZINC000853679413	DE	On-Demand	Anodyne	SLC6A3	33	49
Cn1nnc2c(NC[C@H]3CN(C(=O)OC(C)(C)C)CCO3)ncnc21	ZINC000853679421	EC	On-Demand	Anodyne	GPR119	21	41
Cn1nnc2c(NC[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)ncnc21	ZINC000853679422	EC	On-Demand	Anodyne	GPR119	21	41
COC(=O)c1ncccc1OCc1nonc1C	ZINC000853679433	BD	On-Demand	Anodyne	CACNA1D	29	56
CS(=O)(=O)N1CC[C@@H](CONC(=N)Cc2cccnc2)C1	ZINC000853679450	DC	On-Demand	Anodyne	CHRNA7	44	37
CS(=O)(=O)N1CC[C@@H](CONC(=N)Cc2cccnc2)C1	ZINC000853679450	DC	On-Demand	Anodyne	NAMPT	38	42
CS(=O)(=O)N1CC[C@H](CONC(=N)Cc2cccnc2)C1	ZINC000853679451	DC	On-Demand	Anodyne	CHRNA7	44	37
CS(=O)(=O)N1CC[C@H](CONC(=N)Cc2cccnc2)C1	ZINC000853679451	DC	On-Demand	Anodyne	NAMPT	38	42
CC(C)(C)OC(=O)N1CCC(Cn2cc(C(N)=O)nn2)CC1	ZINC000853679452	DD	On-Demand	Anodyne	GPR119	48	46
COC(=O)c1ncccc1OCCOCc1ccccc1	ZINC000853679460	CE	On-Demand	Anodyne	PPIA	45	45
COC(=O)c1ncccc1OCCOCc1ccccc1	ZINC000853679460	CE	On-Demand	Anodyne	MAP1	27	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2C(=O)OC)CC1	ZINC000853679463	FC	On-Demand	Anodyne	P2RY12	99	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2C(=O)OC)CC1	ZINC000853679464	FC	On-Demand	Anodyne	P2RY12	99	38
COC(=O)c1ncccc1OC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853679472	FD	On-Demand	Anodyne	GPR119	36	41
COC(=O)c1ncccc1OC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853679473	FD	On-Demand	Anodyne	GPR119	36	41
COC(=O)c1ncccc1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853679475	EE	On-Demand	Anodyne	SCD	17	42
COC(=O)c1ncccc1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853679475	EE	On-Demand	Anodyne	SMO	38	42
COC(=O)c1ncccc1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853679476	EE	On-Demand	Anodyne	SCD	17	42
COC(=O)c1ncccc1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853679476	EE	On-Demand	Anodyne	SMO	38	42
CC(C)(C)OC(=O)NC[C@H]1CN(c2cc(Nc3ccccc3)ncn2)CCCO1	ZINC000853679508	GG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NC[C@@H]1CN(c2cc(Nc3ccccc3)ncn2)CCCO1	ZINC000853679509	GG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc(CCO)cc2)C1	ZINC000853679529	EE	On-Demand	Anodyne	GPR119	31	42
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc(CCO)cc2)C1	ZINC000853679530	EE	On-Demand	Anodyne	GPR119	31	42
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	CHRM2	22	49
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	CHRM1	22	49
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	DRD2	33	50
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	DRD4	61	48
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	ACHE	50	48
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	DRD3	19	50
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	SLC6A3	18	40
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	KCNH2	19	46
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	HTR4	25	42
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	CHRM3	33	49
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	LTA4H	26	42
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	SIGMAR1	56	58
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	SSTR5	62	37
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	CCR3	37	44
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	CCR2	21	40
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	SLC6A5	30	48
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	EPHX2	20	45
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	MCHR1	69	49
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	CACNA1G	44	43
C[C@@H](ONC(=N)C(F)(F)F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853679556	FE	On-Demand	Anodyne	CCR8	20	43
CC(C)(C)OC(=O)N1CCc2ccc(OCC3(CC#N)CC3)cc2C1	ZINC000853679569	EI	On-Demand	Mild	TRPV4	41	32
Fc1cc(N2CCCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)ncn1	ZINC000853679617	EH	On-Demand	Anodyne	PRCP	45	61
Fc1cc(N2CCCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)ncn1	ZINC000853679618	EH	On-Demand	Anodyne	PRCP	45	61
COc1cccc(SCCONC(=N)C(F)(F)F)c1	ZINC000853679674	CF	On-Demand	Anodyne	MTNR1A	15	51
COc1cccc(SCCONC(=N)C(F)(F)F)c1	ZINC000853679674	CF	On-Demand	Anodyne	MTNR1B	17	51
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853679682	GF	On-Demand	Anodyne	LTA4H	26	42
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853679682	GF	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(CCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853679683	GF	On-Demand	Anodyne	LTA4H	26	42
CN(C)CCOc1ccc(CCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853679683	GF	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(CCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853679684	GF	On-Demand	Anodyne	LTA4H	26	42
CN(C)CCOc1ccc(CCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853679684	GF	On-Demand	Anodyne	ESRRG	44	33
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853679685	GF	On-Demand	Anodyne	LTA4H	26	42
CN(C)CCOc1ccc(CCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853679685	GF	On-Demand	Anodyne	ESRRG	44	33
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C(F)(F)F)CC1	ZINC000853679695	FE	On-Demand	Anodyne	DRD4	26	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C(F)(F)F)CC1	ZINC000853679695	FE	On-Demand	Anodyne	SIGMAR1	21	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C(F)(F)F)CC1	ZINC000853679695	FE	On-Demand	Anodyne	SSTR5	41	38
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C(F)(F)F)CC1	ZINC000853679695	FE	On-Demand	Anodyne	CCR3	19	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C(F)(F)F)CC1	ZINC000853679695	FE	On-Demand	Anodyne	CCR2	23	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)C(F)(F)F)CC1	ZINC000853679695	FE	On-Demand	Anodyne	MCHR1	37	41
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C(F)(F)F	ZINC000853679702	DE	On-Demand	Anodyne	SFRP1	56	38
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C(F)(F)F	ZINC000853679702	DE	On-Demand	Anodyne	L3MBTL3	43	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C(F)(F)F	ZINC000853679703	DE	On-Demand	Anodyne	SFRP1	56	38
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C(F)(F)F	ZINC000853679703	DE	On-Demand	Anodyne	L3MBTL3	43	34
Fc1cnc(N2CCCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)cn1	ZINC000853679727	EH	On-Demand	Anodyne	PRCP	43	50
Fc1cnc(N2CCCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)cn1	ZINC000853679728	EH	On-Demand	Anodyne	PRCP	43	50
CC(C)(C)OC(=O)NC[C@H]1CN(c2nccc3c(N)cccc23)CCCO1	ZINC000853679732	FF	On-Demand	Anodyne	ACACB	15	40
CC(C)(C)OC(=O)NC[C@@H]1CN(c2nccc3c(N)cccc23)CCCO1	ZINC000853679733	FF	On-Demand	Anodyne	ACACB	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C3CCC3)nc2C)CC1	ZINC000853679764	ED	On-Demand	Anodyne	P2RY12	51	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C3CCC3)nc2C)CC1	ZINC000853679765	ED	On-Demand	Anodyne	P2RY12	51	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C3CC3)nc2C2CC2)CC1	ZINC000853679774	FD	On-Demand	Anodyne	P2RY12	49	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C3CC3)nc2C2CC2)CC1	ZINC000853679775	FD	On-Demand	Anodyne	P2RY12	49	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnn(C)c2)CC1	ZINC000853679780	DC	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnn(C)c2)CC1	ZINC000853679781	DC	On-Demand	Anodyne	P2RY12	47	36
Cc1ncsc1CNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853679789	DE	On-Demand	Anodyne	VHL	40	32
Cc1ncsc1CNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853679790	DE	On-Demand	Anodyne	VHL	40	32
Cc1ncsc1CNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853679791	DE	On-Demand	Anodyne	VHL	40	32
Cc1ncsc1CNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853679792	DE	On-Demand	Anodyne	VHL	40	32
CC(C)(C)OC(=O)N1CCc2ccc(OC[C@@H]3COCCO3)cc2C1	ZINC000853679800	EF	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1CCc2ccc(OC[C@H]3COCCO3)cc2C1	ZINC000853679801	EF	On-Demand	Anodyne	GPR119	33	42
C#CCOCCOc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	ZINC000853679816	EG	On-Demand	Mild	GPR119	30	44
CN(CCNC(=O)OC(C)(C)C)c1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853679817	FD	On-Demand	Anodyne	CA2	18	47
CN(CCNC(=O)OC(C)(C)C)c1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853679817	FD	On-Demand	Anodyne	CA1	17	47
CN(CCNC(=O)OC(C)(C)C)c1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853679817	FD	On-Demand	Anodyne	CA9	16	47
N=C(NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1)C(F)(F)F	ZINC000853679842	GD	On-Demand	Anodyne	EPHX2	22	41
CC(C)(C)OC(=O)NC[C@@H]1CN(c2cc(Cl)c3ncccc3n2)CCCO1	ZINC000853679870	GG	On-Demand	Anodyne	ACACB	15	43
CC(C)(C)OC(=O)NC[C@H]1CN(c2cc(Cl)c3ncccc3n2)CCCO1	ZINC000853679871	GG	On-Demand	Anodyne	ACACB	15	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(CCO)cc2)CC1	ZINC000853679894	FD	On-Demand	Anodyne	P2RY12	51	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(CCO)cc2)CC1	ZINC000853679895	FD	On-Demand	Anodyne	P2RY12	51	37
C=C(Cl)CN(C1CC1)S(=O)(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853679908	FF	On-Demand	Mild	DRD4	32	43
C=C(Cl)CN(C1CC1)S(=O)(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853679908	FF	On-Demand	Mild	SIGMAR1	42	41
C=C(Cl)CN(C1CC1)S(=O)(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853679909	FF	On-Demand	Mild	DRD4	32	43
C=C(Cl)CN(C1CC1)S(=O)(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853679909	FF	On-Demand	Mild	SIGMAR1	42	41
CC(C)(C)OC(=O)NC[C@H]1CN(c2nccnc2-c2ccccc2)CCCO1	ZINC000853679918	GG	On-Demand	Anodyne	BCHE	24	40
CC(C)(C)OC(=O)NC[C@H]1CN(c2nccnc2-c2ccccc2)CCCO1	ZINC000853679918	GG	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@H]1CN(c2nccnc2-c2ccccc2)CCCO1	ZINC000853679918	GG	On-Demand	Anodyne	PDE8B	18	40
CC(C)(C)OC(=O)NC[C@@H]1CN(c2nccnc2-c2ccccc2)CCCO1	ZINC000853679919	GG	On-Demand	Anodyne	BCHE	24	40
CC(C)(C)OC(=O)NC[C@@H]1CN(c2nccnc2-c2ccccc2)CCCO1	ZINC000853679919	GG	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)NC[C@@H]1CN(c2nccnc2-c2ccccc2)CCCO1	ZINC000853679919	GG	On-Demand	Anodyne	PDE8B	18	40
CCCOc1cccc(CONC(=N)C(F)(F)F)c1	ZINC000853679921	CG	On-Demand	Anodyne	PDS	41	37
CON(C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)C1CCC1	ZINC000853679926	EF	On-Demand	Anodyne	UTS2	43	34
CON(C)CCNC(=O)N[C@@H](c1ccc(Cl)cc1)C1CCC1	ZINC000853679927	EF	On-Demand	Anodyne	UTS2	43	34
Cc1nocc1COc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	ZINC000853679930	EH	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2nc(C(F)(F)F)c3cnccc32)C1	ZINC000853679943	GG	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2nc(C(F)(F)F)c3cnccc32)C1	ZINC000853679944	GG	On-Demand	Anodyne	GPR119	21	41
CN(CCNC(=O)OC(C)(C)C)c1noc2ccc(S(N)(=O)=O)cc12	ZINC000853679951	FD	On-Demand	Anodyne	CA2	20	47
CN(CCNC(=O)OC(C)(C)C)c1noc2ccc(S(N)(=O)=O)cc12	ZINC000853679951	FD	On-Demand	Anodyne	CA1	18	47
CC(C)(C)OC(=O)N1CCc2ccc(OCc3cccnc3N)cc2C1	ZINC000853679984	FH	On-Demand	Anodyne	GPR119	36	40
Cn1nnc2c(N3CCCO[C@H](CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853680013	FC	On-Demand	Anodyne	SIRT3	58	42
Cn1nnc2c(N3CCCO[C@H](CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853680013	FC	On-Demand	Anodyne	SIRT2	53	42
Cn1nnc2c(N3CCCO[C@H](CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853680013	FC	On-Demand	Anodyne	SIRT1	47	42
Cn1nnc2c(N3CCCO[C@@H](CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853680014	FC	On-Demand	Anodyne	SIRT3	58	42
Cn1nnc2c(N3CCCO[C@@H](CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853680014	FC	On-Demand	Anodyne	SIRT2	53	42
Cn1nnc2c(N3CCCO[C@@H](CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853680014	FC	On-Demand	Anodyne	SIRT1	47	42
COC[C@@H](COc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2)OC	ZINC000853680015	FG	On-Demand	Anodyne	GPR119	35	42
CO[C@@H](COc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2)[C@@H]1CCOC1	ZINC000853680026	GG	On-Demand	Anodyne	GPR119	40	40
CO[C@@H](COc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2)[C@H]1CCOC1	ZINC000853680027	GG	On-Demand	Anodyne	GPR119	40	40
CC(C)n1ncnc1CON=C(N)c1ccc2c(c1)CCO2	ZINC000853680044	DD	On-Demand	Mild	PIK3CA	20	43
CC(C)(C)OC(=O)N1CCc2ccc(OCCOC(F)F)cc2C1	ZINC000853680055	EH	On-Demand	Anodyne	GPR119	35	45
Cn1cncc1CCOc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	ZINC000853680088	FG	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCc2ccc(OCc3cncs3)cc2C1	ZINC000853680120	EI	On-Demand	Anodyne	GPR119	38	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C(F)(F)F)c3cnccc32)CC1	ZINC000853680138	GE	On-Demand	Anodyne	P2RY12	55	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C(F)(F)F)c3cnccc32)CC1	ZINC000853680139	GE	On-Demand	Anodyne	P2RY12	55	36
COC(OC)[C@@H](C)Nc1ncnc2ccc(I)cc12	ZINC000853680159	FF	On-Demand	Anodyne	EGFR	22	42
COC(OC)[C@@H](C)Nc1ncnc2ccc(I)cc12	ZINC000853680159	FF	On-Demand	Anodyne	CD38	58	44
COC(OC)[C@H](C)Nc1ncnc2ccc(I)cc12	ZINC000853680160	FF	On-Demand	Anodyne	EGFR	22	42
COC(OC)[C@H](C)Nc1ncnc2ccc(I)cc12	ZINC000853680160	FF	On-Demand	Anodyne	CD38	58	44
COc1cc(NC[C@H](CO)Cc2cccnc2)c([N+](=O)[O-])cc1OC	ZINC000853680203	EE	On-Demand	Bother	PTAFR	17	44
COc1cc(NC[C@@H](CO)Cc2cccnc2)c([N+](=O)[O-])cc1OC	ZINC000853680205	EE	On-Demand	Bother	PTAFR	17	44
COC(OC)[C@@H](C)Nc1ncnc2ccc(C(C)C)cc12	ZINC000853680216	CG	On-Demand	Anodyne	CD38	26	42
COC(OC)[C@H](C)Nc1ncnc2ccc(C(C)C)cc12	ZINC000853680217	CG	On-Demand	Anodyne	CD38	26	42
Cc1nonc1COc1cccc(O[C@H](C)C(N)=O)c1	ZINC000853680244	CD	On-Demand	Anodyne	CACNA1D	15	49
Cc1nonc1COc1cccc(O[C@@H](C)C(N)=O)c1	ZINC000853680247	CD	On-Demand	Anodyne	CACNA1D	15	49
COC(OC)[C@@H](C)Nc1ncnc2ccccc12	ZINC000853680252	BE	On-Demand	Anodyne	EGFR	27	49
COC(OC)[C@H](C)Nc1ncnc2ccccc12	ZINC000853680253	BE	On-Demand	Anodyne	EGFR	27	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2C(=O)CC[C@@H](CC(C)C)C2=O)CC1	ZINC000853680274	GD	On-Demand	Anodyne	P2RY12	49	34
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H](C)C(OC)OC)c1	ZINC000853680275	CD	On-Demand	Bother	TAAR1	18	42
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H](C)C(OC)OC)c1	ZINC000853680276	CD	On-Demand	Bother	TAAR1	18	42
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C(=O)CC[C@@H](CC(C)C)C2=O)CC1	ZINC000853680279	GD	On-Demand	Anodyne	P2RY12	49	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2C(=O)CC[C@H](CC(C)C)C2=O)CC1	ZINC000853680281	GD	On-Demand	Anodyne	P2RY12	49	34
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C(=O)CC[C@H](CC(C)C)C2=O)CC1	ZINC000853680282	GD	On-Demand	Anodyne	P2RY12	49	34
O=C(c1ccccc1)N1CC[C@H](COc2ccccc2SC(F)(F)F)C1	ZINC000853680283	GJ	On-Demand	Anodyne	ITGAL	35	40
O=C(c1ccccc1)N1CC[C@@H](COc2ccccc2SC(F)(F)F)C1	ZINC000853680284	GJ	On-Demand	Anodyne	ITGAL	35	40
CCN1CCC[C@H](CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)C1	ZINC000853680334	FE	On-Demand	Clean	CCR3	75	38
COC(OC)[C@@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680355	EF	On-Demand	Anodyne	EGFR	79	47
COC(OC)[C@@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680355	EF	On-Demand	Anodyne	ERBB2	15	43
COC(OC)[C@@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680355	EF	On-Demand	Anodyne	ERBB4	19	42
COC(OC)[C@@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680355	EF	On-Demand	Anodyne	CD38	34	42
COC(OC)[C@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680356	EF	On-Demand	Anodyne	EGFR	79	47
COC(OC)[C@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680356	EF	On-Demand	Anodyne	ERBB2	15	43
COC(OC)[C@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680356	EF	On-Demand	Anodyne	ERBB4	19	42
COC(OC)[C@H](C)Nc1ncnc2ccc(Br)cc12	ZINC000853680356	EF	On-Demand	Anodyne	CD38	34	42
COC(OC)[C@H](C)Nc1cc(-c2cccnc2)nc(C)n1	ZINC000853680363	CE	On-Demand	Anodyne	ROS1	54	36
COC(OC)[C@@H](C)Nc1cc(-c2cccnc2)nc(C)n1	ZINC000853680364	CE	On-Demand	Anodyne	ROS1	54	36
COC(OC)[C@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-]	ZINC000853680370	ED	On-Demand	Bother	TAAR1	15	43
COC(OC)[C@@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-]	ZINC000853680371	ED	On-Demand	Bother	TAAR1	15	43
Cc1nonc1COc1cccc(OCC(N)=O)c1	ZINC000853680408	CC	On-Demand	Anodyne	CACNA1D	17	52
COC(OC)[C@@H](C)Nc1c(Br)cccc1[N+](=O)[O-]	ZINC000853680412	DF	On-Demand	Bother	COLA	46	31
COC(OC)[C@H](C)Nc1c(Br)cccc1[N+](=O)[O-]	ZINC000853680413	DF	On-Demand	Bother	COLA	46	31
COC(OC)[C@@H](C)Nc1ncnc2c(C)csc12	ZINC000853680430	CE	On-Demand	Anodyne	LPAR2	20	47
COC(OC)[C@H](C)Nc1ncnc2c(C)csc12	ZINC000853680431	CE	On-Demand	Anodyne	LPAR2	20	47
COC(OC)[C@@H](C)Nc1ncnc2cc(Cl)ccc12	ZINC000853680440	CF	On-Demand	Anodyne	EGFR	42	42
COC(OC)[C@H](C)Nc1ncnc2cc(Cl)ccc12	ZINC000853680441	CF	On-Demand	Anodyne	EGFR	42	42
COC(OC)[C@@H](C)Nc1cc(C)nc(-c2cccnc2)n1	ZINC000853680442	CE	On-Demand	Anodyne	ROS1	63	38
COC(OC)[C@H](C)Nc1cc(C)nc(-c2cccnc2)n1	ZINC000853680443	CE	On-Demand	Anodyne	ROS1	63	38
CC(C)c1ccc2ncnc(NCc3ncccn3)c2c1	ZINC000853680458	CG	On-Demand	Anodyne	EGFR	34	47
CC(C)c1ccc2ncnc(NCc3ncccn3)c2c1	ZINC000853680458	CG	On-Demand	Anodyne	CLK4	72	41
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	CHRM1	15	41
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	DRD2	28	46
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	DRD4	55	47
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	ACHE	42	44
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	DRD3	15	45
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	KCNH2	17	44
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	HTR4	21	41
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	CHRM3	20	41
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	LTA4H	17	40
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	SIGMAR1	46	52
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	SSTR5	71	39
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	CCR3	51	45
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	MCHR1	50	47
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	CACNA1G	33	42
C[C@@H](Oc1ccc(C=O)cc1F)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853680460	GG	On-Demand	Anodyne	CCR8	16	43
C#Cc1cccnc1NCc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000853680463	EF	On-Demand	Mild	STAT6	50	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2SCC)CC1	ZINC000853680465	FF	On-Demand	Anodyne	P2RY12	84	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2SCC)CC1	ZINC000853680466	FF	On-Demand	Anodyne	P2RY12	84	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OC(C)C)c2)CC1	ZINC000853680500	FF	On-Demand	Anodyne	P2RY12	123	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OC(C)C)c2)CC1	ZINC000853680500	FF	On-Demand	Anodyne	TRY2_BOVIN	28	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OC(C)C)c2)CC1	ZINC000853680501	FF	On-Demand	Anodyne	P2RY12	123	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OC(C)C)c2)CC1	ZINC000853680501	FF	On-Demand	Anodyne	TRY2_BOVIN	28	40
Oc1cc(NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ncccc2n1	ZINC000853680517	FG	On-Demand	Clean	PIK3CA	24	45
Oc1cc(NCc2cc(F)c(N3CCOCC3)c(F)c2)c2ncccc2n1	ZINC000853680517	FG	On-Demand	Clean	STAT6	46	35
C#CCCCOc1cccnc1NCc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000853680529	GH	On-Demand	Mild	STAT6	47	33
NC(=O)c1cc(NCc2cc(F)c(N3CCOCC3)c(F)c2)ccc1[N+](=O)[O-]	ZINC000853680546	GE	On-Demand	Clean	STAT6	74	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(O[C@@H](C)C(N)=O)c2)CC1	ZINC000853680547	GD	On-Demand	Anodyne	P2RY12	168	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(O[C@@H](C)C(N)=O)c2)CC1	ZINC000853680547	GD	On-Demand	Anodyne	TRY2_BOVIN	51	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(O[C@@H](C)C(N)=O)c2)CC1	ZINC000853680547	GD	On-Demand	Anodyne	ST14	19	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(O[C@H](C)C(N)=O)c2)CC1	ZINC000853680548	GD	On-Demand	Anodyne	P2RY12	168	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(O[C@H](C)C(N)=O)c2)CC1	ZINC000853680548	GD	On-Demand	Anodyne	TRY2_BOVIN	51	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(O[C@H](C)C(N)=O)c2)CC1	ZINC000853680548	GD	On-Demand	Anodyne	ST14	19	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(O[C@@H](C)C(N)=O)c2)CC1	ZINC000853680549	GD	On-Demand	Anodyne	P2RY12	168	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(O[C@@H](C)C(N)=O)c2)CC1	ZINC000853680549	GD	On-Demand	Anodyne	TRY2_BOVIN	51	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(O[C@@H](C)C(N)=O)c2)CC1	ZINC000853680549	GD	On-Demand	Anodyne	ST14	19	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(O[C@H](C)C(N)=O)c2)CC1	ZINC000853680550	GD	On-Demand	Anodyne	P2RY12	168	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(O[C@H](C)C(N)=O)c2)CC1	ZINC000853680550	GD	On-Demand	Anodyne	TRY2_BOVIN	51	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(O[C@H](C)C(N)=O)c2)CC1	ZINC000853680550	GD	On-Demand	Anodyne	ST14	19	43
CCCc1ccc(NCc2cc(F)c(N3CCOCC3)c(F)c2)nn1	ZINC000853680553	EG	On-Demand	Clean	STAT6	43	34
CCn1c(=O)c(N[C@@H](C)C(OC)OC)nc2ccccc21	ZINC000853680602	CD	On-Demand	Anodyne	PYGM	20	43
CCn1c(=O)c(N[C@H](C)C(OC)OC)nc2ccccc21	ZINC000853680603	CD	On-Demand	Anodyne	PYGM	20	43
Cc1ccccc1CN1CCC(NC(=O)COc2cnc(Cl)cc2C)CC1	ZINC000853680627	GH	On-Demand	Anodyne	DRD4	34	52
Cc1ccccc1CN1CCC(NC(=O)COc2cnc(Cl)cc2C)CC1	ZINC000853680627	GH	On-Demand	Anodyne	HTR4	29	41
Cc1ccccc1CN1CCC(NC(=O)COc2cnc(Cl)cc2C)CC1	ZINC000853680627	GH	On-Demand	Anodyne	SIGMAR1	21	48
Cc1ccccc1CN1CCC(NC(=O)COc2cnc(Cl)cc2C)CC1	ZINC000853680627	GH	On-Demand	Anodyne	SSTR5	66	42
Cc1ccccc1CN1CCC(NC(=O)COc2cnc(Cl)cc2C)CC1	ZINC000853680627	GH	On-Demand	Anodyne	MCHR1	35	47
Cc1ccccc1CN1CCC(NC(=O)COc2cnc(Cl)cc2C)CC1	ZINC000853680627	GH	On-Demand	Anodyne	CCR8	18	42
COC(OC)[C@@H](C)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000853680638	EF	On-Demand	Anodyne	ROS1	41	37
COC(OC)[C@H](C)Nc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000853680639	EF	On-Demand	Anodyne	ROS1	41	37
CCNc1nccnc1NCc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000853680676	EF	On-Demand	Clean	STAT6	45	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C#N)c2)CC1	ZINC000853680685	DD	On-Demand	Mild	P2RY12	48	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C#N)c2)CC1	ZINC000853680686	DD	On-Demand	Mild	P2RY12	48	38
Fc1cnc(NCc2cc(F)c(N3CCOCC3)c(F)c2)cn1	ZINC000853680695	DE	On-Demand	Clean	STAT6	43	35
O=S(=O)(c1ccc(NC[C@H](CO)Cc2cccnc2)cc1)C(F)F	ZINC000853680714	FE	On-Demand	Anodyne	NAMPT	45	39
O=S(=O)(c1ccc(NC[C@@H](CO)Cc2cccnc2)cc1)C(F)F	ZINC000853680715	FE	On-Demand	Anodyne	NAMPT	45	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C(C)=O)n2)CC1	ZINC000853680739	DC	On-Demand	Anodyne	P2RY12	98	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C(C)=O)n2)CC1	ZINC000853680740	DC	On-Demand	Anodyne	P2RY12	98	39
CC(=O)c1ccnc(NCc2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000853680746	EG	On-Demand	Clean	EPHB4	41	30
CC(=O)c1ccnc(NCc2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000853680746	EG	On-Demand	Clean	STAT6	46	37
COC(OC)[C@@H](C)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853680749	DC	On-Demand	Bother	CA2	29	48
COC(OC)[C@@H](C)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853680749	DC	On-Demand	Bother	CA4	27	40
COC(OC)[C@@H](C)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853680749	DC	On-Demand	Bother	CA9	18	40
COC(OC)[C@H](C)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853680750	DC	On-Demand	Bother	CA2	29	48
COC(OC)[C@H](C)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853680750	DC	On-Demand	Bother	CA4	27	40
COC(OC)[C@H](C)Nc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853680750	DC	On-Demand	Bother	CA9	18	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncn(C)c2=O)CC1	ZINC000853680751	DB	On-Demand	Anodyne	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncn(C)c2=O)CC1	ZINC000853680752	DB	On-Demand	Anodyne	P2RY12	40	36
COC(OC)[C@@H](C)Nc1ccnc(Cc2ccccc2)n1	ZINC000853680765	CE	On-Demand	Anodyne	HTR7	15	41
COC(OC)[C@H](C)Nc1ccnc(Cc2ccccc2)n1	ZINC000853680766	CE	On-Demand	Anodyne	HTR7	15	41
COC(OC)[C@@H](C)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000853680793	DE	On-Demand	Anodyne	LRRK2	19	45
COC(OC)[C@H](C)Nc1ccc2nnc(-c3ccccc3)n2n1	ZINC000853680794	DE	On-Demand	Anodyne	LRRK2	19	45
COC(OC)[C@@H](C)Nc1ncnc2ccc(S(C)(=O)=O)cc12	ZINC000853680795	ED	On-Demand	Anodyne	CD38	15	41
COC(OC)[C@H](C)Nc1ncnc2ccc(S(C)(=O)=O)cc12	ZINC000853680796	ED	On-Demand	Anodyne	CD38	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OCC(N)=O)c2)CC1	ZINC000853680799	GC	On-Demand	Anodyne	P2RY12	122	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OCC(N)=O)c2)CC1	ZINC000853680800	GC	On-Demand	Anodyne	P2RY12	122	40
COC(OC)[C@@H](C)Nc1ccc(C(=O)Nc2ccccc2)nn1	ZINC000853680827	DE	On-Demand	Anodyne	KCNK3	49	36
COC(OC)[C@H](C)Nc1ccc(C(=O)Nc2ccccc2)nn1	ZINC000853680828	DE	On-Demand	Anodyne	KCNK3	49	36
COC(OC)[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680847	CD	On-Demand	Anodyne	ADORA1	52	43
COC(OC)[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680847	CD	On-Demand	Anodyne	ADCY5	17	40
COC(OC)[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680847	CD	On-Demand	Anodyne	ADORA3	59	37
COC(OC)[C@@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680847	CD	On-Demand	Anodyne	OXGR1	47	34
COC(OC)[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680848	CD	On-Demand	Anodyne	ADORA1	52	43
COC(OC)[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680848	CD	On-Demand	Anodyne	ADCY5	17	40
COC(OC)[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680848	CD	On-Demand	Anodyne	ADORA3	59	37
COC(OC)[C@H](C)Nc1ncnc2c1ncn2C1CC1	ZINC000853680848	CD	On-Demand	Anodyne	OXGR1	47	34
COC(=O)Cc1ccnc(NCc2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000853680867	GF	On-Demand	Clean	EPHB4	50	31
COC(=O)Cc1ccnc(NCc2cc(F)c(N3CCOCC3)c(F)c2)c1	ZINC000853680867	GF	On-Demand	Clean	STAT6	50	35
Cn1nnc2c(NCc3cc(F)c(N4CCOCC4)c(F)c3)ncnc21	ZINC000853680885	FD	On-Demand	Clean	STAT6	43	35
COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccc(F)cc4)CC3)C2)cc1	ZINC000853680902	FG	On-Demand	Clean	NPBWR1	58	37
COC(OC)[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000853680915	FD	On-Demand	Bother	TBXA2R	15	40
COC(OC)[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000853680918	FD	On-Demand	Bother	TBXA2R	15	40
COC(OC)[C@@H](C)Nc1nc(-c2ccccc2)c2ccccc2n1	ZINC000853680921	DH	On-Demand	Anodyne	TSPO	15	42
COC(OC)[C@@H](C)Nc1nc(-c2ccccc2)c2ccccc2n1	ZINC000853680921	DH	On-Demand	Anodyne	TACR3	53	39
COC(OC)[C@H](C)Nc1nc(-c2ccccc2)c2ccccc2n1	ZINC000853680923	DH	On-Demand	Anodyne	TSPO	15	42
COC(OC)[C@H](C)Nc1nc(-c2ccccc2)c2ccccc2n1	ZINC000853680923	DH	On-Demand	Anodyne	TACR3	53	39
COC(OC)[C@@H](C)Nc1nc(-c2cccnc2)nc2ccccc12	ZINC000853680946	DG	On-Demand	Anodyne	ABCG2	23	42
COC(OC)[C@H](C)Nc1nc(-c2cccnc2)nc2ccccc12	ZINC000853680948	DG	On-Demand	Anodyne	ABCG2	23	42
COC(OC)[C@@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853680960	ED	On-Demand	Bother	COLA	66	35
COC(OC)[C@@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853680960	ED	On-Demand	Bother	BCL2L1	49	31
COC(OC)[C@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853680961	ED	On-Demand	Bother	COLA	66	35
COC(OC)[C@H](C)Nc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853680961	ED	On-Demand	Bother	BCL2L1	49	31
Cc1cc(Cl)ncc1OC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853680985	EH	On-Demand	Anodyne	SMO	42	39
Cc1cc(Cl)ncc1OC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853680987	EH	On-Demand	Anodyne	SMO	42	39
COC(OC)[C@@H](C)Nc1c(C#N)cnc2c(Cl)cccc12	ZINC000853680992	DG	On-Demand	Mild	SRC	63	39
COC(OC)[C@@H](C)Nc1c(C#N)cnc2c(Cl)cccc12	ZINC000853680992	DG	On-Demand	Mild	MAP3K8	80	37
COC(OC)[C@H](C)Nc1c(C#N)cnc2c(Cl)cccc12	ZINC000853680993	DG	On-Demand	Mild	SRC	63	39
COC(OC)[C@H](C)Nc1c(C#N)cnc2c(Cl)cccc12	ZINC000853680993	DG	On-Demand	Mild	MAP3K8	80	37
COC(OC)[C@@H](C)Nc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000853681044	FE	On-Demand	Bother	COLA	44	33
COC(OC)[C@H](C)Nc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000853681045	FE	On-Demand	Bother	COLA	44	33
COC(OC)[C@H](C)Nc1ncnc2ccc(C)cc12	ZINC000853681052	CE	On-Demand	Anodyne	EGFR	28	42
COC(OC)[C@H](C)Nc1ncnc2ccc(C)cc12	ZINC000853681052	CE	On-Demand	Anodyne	CD38	35	42
COC(OC)[C@@H](C)Nc1ncnc2ccc(C)cc12	ZINC000853681053	CE	On-Demand	Anodyne	EGFR	28	42
COC(OC)[C@@H](C)Nc1ncnc2ccc(C)cc12	ZINC000853681053	CE	On-Demand	Anodyne	CD38	35	42
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccc(C#N)c2)C1	ZINC000853681068	CD	On-Demand	Mild	GPR119	25	41
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccc(C#N)c2)C1	ZINC000853681069	CD	On-Demand	Mild	GPR119	25	41
N#Cc1cc2cccnc2nc1NCc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000853681083	GG	On-Demand	Mild	STAT6	45	35
CCN1CCC[C@H](CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)C1	ZINC000853681099	GF	On-Demand	Anodyne	CACNA1I	42	37
COC(OC)[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853681113	GD	On-Demand	Bother	BCL2L1	70	35
COC(OC)[C@@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853681113	GD	On-Demand	Bother	BCL2	56	36
COC(OC)[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853681114	GD	On-Demand	Bother	BCL2L1	70	35
COC(OC)[C@H](C)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853681114	GD	On-Demand	Bother	BCL2	56	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C=O)cc2F)CC1	ZINC000853681130	FD	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C=O)cc2F)CC1	ZINC000853681131	FD	On-Demand	Anodyne	P2RY12	47	36
C[C@@H](Oc1cccc(OCCOC(F)F)c1)C(N)=O	ZINC000853681148	CD	On-Demand	Anodyne	MTNR1A	18	41
C[C@@H](Oc1cccc(OCCOC(F)F)c1)C(N)=O	ZINC000853681148	CD	On-Demand	Anodyne	MTNR1B	16	41
C[C@@H](Oc1cccc(OCCOC(F)F)c1)C(N)=O	ZINC000853681148	CD	On-Demand	Anodyne	PLA2G4B	26	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3ccc(OC)cc3c2=O)CC1	ZINC000853681220	GD	On-Demand	Anodyne	P2RY12	68	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3ccc(OC)cc3c2=O)CC1	ZINC000853681220	GD	On-Demand	Anodyne	MTNR1A	43	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3ccc(OC)cc3c2=O)CC1	ZINC000853681221	GD	On-Demand	Anodyne	P2RY12	68	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3ccc(OC)cc3c2=O)CC1	ZINC000853681221	GD	On-Demand	Anodyne	MTNR1A	43	36
COC(OC)[C@@H](C)Nc1ncnc2sc(-c3ccccc3)cc12	ZINC000853681225	EH	On-Demand	Anodyne	EGFR	18	55
COC(OC)[C@H](C)Nc1ncnc2sc(-c3ccccc3)cc12	ZINC000853681226	EH	On-Demand	Anodyne	EGFR	18	55
CNC(=O)c1cc(Oc2cccc(OCCCCC3(C)OCCO3)c2)ccn1	ZINC000853681264	GH	On-Demand	Anodyne	RAF1	64	41
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C(C)C)N3CCCC3)C2)cc1	ZINC000853681314	FF	On-Demand	Clean	MTNR1A	17	45
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C(C)C)N3CCCC3)C2)cc1	ZINC000853681314	FF	On-Demand	Clean	MTNR1B	18	45
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C(C)C)N3CCCC3)C2)cc1	ZINC000853681315	FF	On-Demand	Clean	MTNR1A	17	45
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C(C)C)N3CCCC3)C2)cc1	ZINC000853681315	FF	On-Demand	Clean	MTNR1B	18	45
CS(=O)(=O)C1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853681338	DD	On-Demand	Anodyne	MMP13	23	44
CS(=O)(=O)C1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853681338	DD	On-Demand	Anodyne	TRY2_BOVIN	63	35
CS(=O)(=O)C1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853681338	DD	On-Demand	Anodyne	MMP9	15	44
CS(=O)(=O)C1CN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853681338	DD	On-Demand	Anodyne	NAMPT	30	42
O=C(NCc1ccc2ccccc2c1)N[C@H]1CCNC1=O	ZINC000853681351	CD	On-Demand	Anodyne	CXCR4	66	38
O=C(NCc1ccc2ccccc2c1)N[C@@H]1CCNC1=O	ZINC000853681352	CD	On-Demand	Anodyne	CXCR4	66	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000853681358	FD	On-Demand	Bother	P2RY12	47	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000853681359	FD	On-Demand	Bother	P2RY12	47	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(F)c2C#N)CC1	ZINC000853681368	ED	On-Demand	Mild	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(F)c2C#N)CC1	ZINC000853681369	ED	On-Demand	Mild	P2RY12	41	36
Nc1cccc2c(NCc3cc(F)c(N4CCOCC4)c(F)c3)nccc12	ZINC000853681377	FH	On-Demand	Clean	EPHB4	40	34
Nc1cccc2c(NCc3cc(F)c(N4CCOCC4)c(F)c3)nccc12	ZINC000853681377	FH	On-Demand	Clean	STAT6	47	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000853681393	FD	On-Demand	Bother	P2RY12	42	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000853681393	FD	On-Demand	Bother	CACNA1D	45	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000853681394	FD	On-Demand	Bother	P2RY12	42	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000853681394	FD	On-Demand	Bother	CACNA1D	45	35
Nc1ccc(NCc2cc(F)c(N3CCOCC3)c(F)c2)nc1[N+](=O)[O-]	ZINC000853681412	FE	On-Demand	Clean	STAT6	47	38
OCc1cc(NCc2cc(F)c(N3CCOCC3)c(F)c2)ncc1F	ZINC000853681427	FE	On-Demand	Clean	STAT6	45	36
COC(OC)[C@@H](C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000853681466	EG	On-Demand	Bother	COLA	64	34
COC(OC)[C@@H](C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000853681466	EG	On-Demand	Bother	TAAR1	21	51
COC(OC)[C@H](C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000853681468	EG	On-Demand	Bother	COLA	64	34
COC(OC)[C@H](C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000853681468	EG	On-Demand	Bother	TAAR1	21	51
O=C(NCc1ccc2ccccc2c1)NCC1CCN(C2CCOCC2)CC1	ZINC000853681473	GH	On-Demand	Anodyne	HTR4	43	38
O=C(NCc1ccc2ccccc2c1)NCC1CCN(C2CCOCC2)CC1	ZINC000853681473	GH	On-Demand	Anodyne	CCR3	46	45
O=C(NCc1ccc2ccccc2c1)NCC1CCN(C2CCOCC2)CC1	ZINC000853681473	GH	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCc1ccc2ccccc2c1)NCC1CCN(C2CCOCC2)CC1	ZINC000853681473	GH	On-Demand	Anodyne	NAMPT	20	42
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	CHRM1	19	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	DRD4	23	54
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	LTA4H	24	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	SIGMAR1	24	49
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	SSTR5	41	44
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	CCR3	17	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	CCR2	19	49
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	SLC6A5	34	46
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681508	GG	On-Demand	Anodyne	MCHR1	43	47
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CCc2cccc(Cl)c2C1	ZINC000853681554	GG	On-Demand	Anodyne	AKR1C3	18	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681555	FD	On-Demand	Anodyne	P2RY12	52	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(C)(C)O)cc2)CC1	ZINC000853681556	FD	On-Demand	Anodyne	P2RY12	52	39
COC(OC)[C@@H](C)Nc1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853681568	DD	On-Demand	Anodyne	ABCC8	45	35
COC(OC)[C@H](C)Nc1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853681570	DD	On-Demand	Anodyne	ABCC8	45	35
NC(=O)COc1cccc(OCCOC(F)F)c1	ZINC000853681582	CD	On-Demand	Anodyne	PLA2G4B	41	42
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc2ccccc2c1	ZINC000853681621	DG	On-Demand	Anodyne	CXCR4	42	32
CNC(=O)COc1cccc(OCCCCC2(C)OCCO2)c1	ZINC000853681622	DE	On-Demand	Anodyne	PLA2G4B	40	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OCC(=O)NC)c2)CC1	ZINC000853681644	GC	On-Demand	Anodyne	P2RY12	145	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OCC(=O)NC)c2)CC1	ZINC000853681644	GC	On-Demand	Anodyne	TRY2_BOVIN	37	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OCC(=O)NC)c2)CC1	ZINC000853681645	GC	On-Demand	Anodyne	P2RY12	145	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OCC(=O)NC)c2)CC1	ZINC000853681645	GC	On-Demand	Anodyne	TRY2_BOVIN	37	40
CC(C)(C)OC(=O)N1CCOC[C@H]1C(=N)NOCCOCc1ccccc1	ZINC000853681649	GE	On-Demand	Anodyne	KLK5	40	35
CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=N)NOCCOCc1ccccc1	ZINC000853681651	GE	On-Demand	Anodyne	KLK5	40	35
O=[N+]([O-])c1c(NCc2cc(F)c(N3CCOCC3)c(F)c2)ccnc1O	ZINC000853681663	FE	On-Demand	Clean	STAT6	45	35
O=S(=O)(c1ccc(NC[C@H](CO)Cc2cccnc2)cc1)C(F)(F)F	ZINC000853681664	FF	On-Demand	Anodyne	NAMPT	52	41
O=S(=O)(c1ccc(NC[C@@H](CO)Cc2cccnc2)cc1)C(F)(F)F	ZINC000853681665	FF	On-Demand	Anodyne	NAMPT	52	41
COC(=O)c1cnc(N[C@H](C)c2ncccc2F)cc1C(F)(F)F	ZINC000853681668	EH	On-Demand	Anodyne	SUCNR1	42	35
COC(=O)c1cnc(N[C@@H](C)c2ncccc2F)cc1C(F)(F)F	ZINC000853681669	EH	On-Demand	Anodyne	SUCNR1	42	35
COC(=O)/C=C\c1ccc(N[C@H](C)C(OC)OC)c([N+](=O)[O-])c1	ZINC000853681831	DE	On-Demand	Bother	NR1H4	40	38
COC(=O)/C=C\c1ccc(N[C@H](C)C(OC)OC)c([N+](=O)[O-])c1	ZINC000853681831	DE	On-Demand	Bother	TAAR1	15	44
COC(=O)/C=C\c1ccc(N[C@@H](C)C(OC)OC)c([N+](=O)[O-])c1	ZINC000853681837	DE	On-Demand	Bother	NR1H4	40	38
COC(=O)/C=C\c1ccc(N[C@@H](C)C(OC)OC)c([N+](=O)[O-])c1	ZINC000853681837	DE	On-Demand	Bother	TAAR1	15	44
O=C(NCc1ccc2ccccc2c1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853681860	GD	On-Demand	Anodyne	TRY2_BOVIN	53	35
O=C(NCc1ccc2ccccc2c1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853681860	GD	On-Demand	Anodyne	TGM2	18	42
O=C(NCc1ccc2ccccc2c1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853681860	GD	On-Demand	Anodyne	F13A1	20	42
O=C(NCc1ccc2ccccc2c1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853681860	GD	On-Demand	Anodyne	NAMPT	43	38
Cn1cncc1CCOc1ccc2c(c1)CCCC2	ZINC000853681864	CF	On-Demand	Anodyne	HRH3	18	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(C)ccnc2Cl)CC1	ZINC000853681869	FE	On-Demand	Anodyne	P2RY12	59	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(C)ccnc2Cl)CC1	ZINC000853681870	FE	On-Demand	Anodyne	P2RY12	59	36
COC(OC)[C@@H](C)Nc1ncnc2ccc(F)cc12	ZINC000853681883	CE	On-Demand	Anodyne	EGFR	36	44
COC(OC)[C@@H](C)Nc1ncnc2ccc(F)cc12	ZINC000853681883	CE	On-Demand	Anodyne	CLK4	16	40
COC(OC)[C@@H](C)Nc1ncnc2ccc(F)cc12	ZINC000853681883	CE	On-Demand	Anodyne	CD38	36	42
COC(OC)[C@H](C)Nc1ncnc2ccc(F)cc12	ZINC000853681885	CE	On-Demand	Anodyne	EGFR	36	44
COC(OC)[C@H](C)Nc1ncnc2ccc(F)cc12	ZINC000853681885	CE	On-Demand	Anodyne	CLK4	16	40
COC(OC)[C@H](C)Nc1ncnc2ccc(F)cc12	ZINC000853681885	CE	On-Demand	Anodyne	CD38	36	42
COC(OC)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000853681890	FH	On-Demand	Bother	TAAR1	33	60
COC(OC)[C@@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000853681890	FH	On-Demand	Bother	KCNK3	45	33
C[C@@H](Sc1nc2cc(Cl)cnc2[nH]1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853681891	HI	On-Demand	Anodyne	ENPP1	35	46
COC(OC)[C@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000853681892	FH	On-Demand	Bother	TAAR1	33	60
COC(OC)[C@H](C)Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000853681892	FH	On-Demand	Bother	KCNK3	45	33
C[C@H](Sc1nc2cc(Cl)cnc2[nH]1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853681893	HI	On-Demand	Anodyne	ENPP1	35	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(N(C)C)c2)CC1	ZINC000853681901	ED	On-Demand	Anodyne	P2RY12	98	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(N(C)C)c2)CC1	ZINC000853681902	ED	On-Demand	Anodyne	P2RY12	98	44
COC(OC)[C@@H](C)Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000853681909	CD	On-Demand	Bother	COLA	49	32
COC(OC)[C@H](C)Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000853681911	CD	On-Demand	Bother	COLA	49	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc(Cl)cc2C)CC1	ZINC000853681926	FE	On-Demand	Anodyne	P2RY12	58	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc(Cl)cc2C)CC1	ZINC000853681928	FE	On-Demand	Anodyne	P2RY12	58	36
C#CCOCCOc1cccc(OCC(N)=O)c1	ZINC000853681936	BC	On-Demand	Mild	PLA2G4B	36	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)cc2C)CC1	ZINC000853681946	EE	On-Demand	Anodyne	P2RY12	51	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)cc2C)CC1	ZINC000853681948	EE	On-Demand	Anodyne	P2RY12	51	38
Cc1cc(Cl)ncc1OC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853681960	EG	On-Demand	Anodyne	GPR119	31	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3[nH]ccc3c2)CC1	ZINC000853681961	EE	On-Demand	Anodyne	P2RY12	80	39
Cc1cc(Cl)ncc1OC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853681962	EG	On-Demand	Anodyne	GPR119	31	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3[nH]ccc3c2)CC1	ZINC000853681963	EE	On-Demand	Anodyne	P2RY12	80	39
COC(OC)[C@@H](C)Nc1nc2ccccc2s1	ZINC000853681980	CF	On-Demand	Anodyne	CSNK1D	18	41
COC(OC)[C@@H](C)Nc1nc2ccccc2s1	ZINC000853681980	CF	On-Demand	Anodyne	LUCI_PHOPE	15	42
COC(OC)[C@H](C)Nc1nc2ccccc2s1	ZINC000853681981	CF	On-Demand	Anodyne	CSNK1D	18	41
COC(OC)[C@H](C)Nc1nc2ccccc2s1	ZINC000853681981	CF	On-Demand	Anodyne	LUCI_PHOPE	15	42
COC(OC)[C@@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000853682002	CF	On-Demand	Anodyne	UL26	74	33
COC(OC)[C@@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000853682002	CF	On-Demand	Anodyne	SCAF_EBVB9	62	31
COC(OC)[C@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000853682003	CF	On-Demand	Anodyne	UL26	74	33
COC(OC)[C@H](C)Nc1nc(C)nc2scc(C)c12	ZINC000853682003	CF	On-Demand	Anodyne	SCAF_EBVB9	62	31
COC(OC)[C@@H](C)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000853682018	DD	On-Demand	Bother	PKM	32	41
COC(OC)[C@H](C)Nc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000853682019	DD	On-Demand	Bother	PKM	32	41
CC(C)c1ccc2ncnc(NCC(C)(C)[C@H]3COCC34OCCO4)c2c1	ZINC000853682060	FH	On-Demand	Anodyne	DYRK1A	16	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@H]3COCC34OCCO4)c2c1	ZINC000853682060	FH	On-Demand	Anodyne	CLK1	16	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@H]3COCC34OCCO4)c2c1	ZINC000853682060	FH	On-Demand	Anodyne	CLK2	20	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@H]3COCC34OCCO4)c2c1	ZINC000853682060	FH	On-Demand	Anodyne	CLK4	41	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@H]3COCC34OCCO4)c2c1	ZINC000853682060	FH	On-Demand	Anodyne	DYRK1B	16	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@@H]3COCC34OCCO4)c2c1	ZINC000853682061	FH	On-Demand	Anodyne	DYRK1A	16	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@@H]3COCC34OCCO4)c2c1	ZINC000853682061	FH	On-Demand	Anodyne	CLK1	16	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@@H]3COCC34OCCO4)c2c1	ZINC000853682061	FH	On-Demand	Anodyne	CLK2	20	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@@H]3COCC34OCCO4)c2c1	ZINC000853682061	FH	On-Demand	Anodyne	CLK4	41	40
CC(C)c1ccc2ncnc(NCC(C)(C)[C@@H]3COCC34OCCO4)c2c1	ZINC000853682061	FH	On-Demand	Anodyne	DYRK1B	16	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(Cl)c3ccccc32)CC1	ZINC000853682105	FF	On-Demand	Anodyne	P2RY12	135	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(Cl)c3ccccc32)CC1	ZINC000853682106	FF	On-Demand	Anodyne	P2RY12	135	40
CNC(=O)c1cc(Oc2cccc(OCCOC(F)F)c2)ccn1	ZINC000853682107	EF	On-Demand	Anodyne	RAF1	71	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)CN(C)C3=O)CC1	ZINC000853682120	GD	On-Demand	Anodyne	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)CN(C)C3=O)CC1	ZINC000853682121	GD	On-Demand	Anodyne	P2RY12	42	36
CNC(=O)c1cc(Oc2cccc(OCCC3SCCS3)c2)ccn1	ZINC000853682131	GH	On-Demand	Anodyne	RAF1	70	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3c(c2=O)CCCC3)CC1	ZINC000853682144	FC	On-Demand	Anodyne	P2RY12	41	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3c(c2=O)CCCC3)CC1	ZINC000853682145	FC	On-Demand	Anodyne	P2RY12	41	35
Cn1cncc1CCOc1ccc(C(C)(C)O)cc1	ZINC000853682184	CE	On-Demand	Anodyne	PGGT1B	40	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)CCCNC3=O)CC1	ZINC000853682186	GD	On-Demand	Anodyne	P2RY12	52	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)CCCNC3=O)CC1	ZINC000853682187	GD	On-Demand	Anodyne	P2RY12	52	35
COC[C@@H](CCNC(=O)NCc1ccc2ccccc2c1)OC	ZINC000853682200	DF	On-Demand	Anodyne	PDS	52	34
O=C(NCc1ccc2ccccc2c1)N1CC[C@H](Cn2ccnn2)C1	ZINC000853682211	EF	On-Demand	Anodyne	CCR3	31	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853682212	EF	On-Demand	Anodyne	CCR3	31	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3nccnc3c2)C1	ZINC000853682223	EF	On-Demand	Anodyne	GPR119	38	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3nccnc3c2)C1	ZINC000853682224	EF	On-Demand	Anodyne	GPR119	38	41
CNC(=O)c1cc(Oc2cccc(OC[C@H](OC)C3CCC3)c2)ccn1	ZINC000853682231	FG	On-Demand	Anodyne	RAF1	66	42
O=C(NCc1ccc2ccccc2c1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853682306	CH	On-Demand	Anodyne	NMT1	36	40
O=C(NCc1ccc2ccccc2c1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853682306	CH	On-Demand	Anodyne	CXCR4	51	35
CNC(=O)c1cc(Oc2cccc(OC[C@@H](OC)[C@@H]3CCOC3)c2)ccn1	ZINC000853682406	FF	On-Demand	Anodyne	RAF1	64	40
CNC(=O)c1cc(Oc2cccc(OC[C@@H](OC)[C@H]3CCOC3)c2)ccn1	ZINC000853682408	FF	On-Demand	Anodyne	RAF1	64	40
CNC(=O)c1cc(Oc2cccc(OC[C@H](OC)[C@@H]3CCOC3)c2)ccn1	ZINC000853682410	FF	On-Demand	Anodyne	RAF1	64	40
CNC(=O)c1cc(Oc2cccc(OC[C@H](OC)[C@H]3CCOC3)c2)ccn1	ZINC000853682412	FF	On-Demand	Anodyne	RAF1	64	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnn(C)c2=O)CC1	ZINC000853682430	DB	On-Demand	Anodyne	P2RY12	48	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnn(C)c2=O)CC1	ZINC000853682432	DB	On-Demand	Anodyne	P2RY12	48	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(C(=O)OC)cc2C(=O)OC)CC1	ZINC000853682533	GC	On-Demand	Anodyne	P2RY12	144	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(C(=O)OC)cc2C(=O)OC)CC1	ZINC000853682535	GC	On-Demand	Anodyne	P2RY12	144	41
CNC(=O)COc1cccc(OCc2nonc2C)c1	ZINC000853682536	CD	On-Demand	Anodyne	CACNA1D	17	50
C[C@@H](CCCc1cccnc1)Nc1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853682553	FH	On-Demand	Anodyne	PTAFR	26	48
CON(C)CCNC(=O)NCc1ccc2ccccc2c1	ZINC000853682564	CE	On-Demand	Anodyne	MTNR1A	42	42
N#CC[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853682571	DH	On-Demand	Mild	F2	15	44
N#CC[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853682571	DH	On-Demand	Mild	CCR3	41	40
N#CC[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853682571	DH	On-Demand	Mild	DPP7	26	44
N#CC[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853682572	DH	On-Demand	Mild	F2	15	44
N#CC[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853682572	DH	On-Demand	Mild	CCR3	41	40
N#CC[C@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853682572	DH	On-Demand	Mild	DPP7	26	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)c(F)c2)CC1	ZINC000853682656	FF	On-Demand	Anodyne	P2RY12	69	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)c(F)c2)CC1	ZINC000853682656	FF	On-Demand	Anodyne	MC4R	40	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)c(F)c2)CC1	ZINC000853682658	FF	On-Demand	Anodyne	P2RY12	69	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)c(F)c2)CC1	ZINC000853682658	FF	On-Demand	Anodyne	MC4R	40	36
NC(=O)c1cc(Oc2cccc(OCCC3SCCS3)c2)ccn1	ZINC000853682661	FH	On-Demand	Anodyne	RAF1	43	40
CC(=O)c1ccnc(N2CCC(c3cccc(NC(=O)OC(C)(C)C)c3)CC2)c1	ZINC000853682679	GK	On-Demand	Anodyne	MCHR1	28	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(Oc3cccnc3)c2)CC1	ZINC000853682685	GF	On-Demand	Anodyne	P2RY12	89	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(Oc3cccnc3)c2)CC1	ZINC000853682687	GF	On-Demand	Anodyne	P2RY12	89	40
CNC(=O)COc1cccc(OCc2oc(C)nc2C)c1	ZINC000853682699	CD	On-Demand	Anodyne	MAOA	39	40
CNC(=O)COc1cccc(OCCOC(F)F)c1	ZINC000853682736	CD	On-Demand	Anodyne	UPP1	40	31
CNC(=O)COc1cccc(OCCOC(F)F)c1	ZINC000853682736	CD	On-Demand	Anodyne	MTNR1A	21	41
CNC(=O)COc1cccc(OCCOC(F)F)c1	ZINC000853682736	CD	On-Demand	Anodyne	MTNR1B	19	41
CNC(=O)COc1cccc(OCCOC(F)F)c1	ZINC000853682736	CD	On-Demand	Anodyne	PLA2G4B	45	42
CNC(=O)COc1cccc(OCCOC(F)F)c1	ZINC000853682736	CD	On-Demand	Anodyne	PDS	59	34
CCN(CCNC(=O)N[C@@H](c1ccccc1)[C@@H](C)O)C(=O)OC(C)(C)C	ZINC000853682773	FF	On-Demand	Anodyne	FPR1	41	34
CCN(CCNC(=O)N[C@@H](c1ccccc1)[C@H](C)O)C(=O)OC(C)(C)C	ZINC000853682774	FF	On-Demand	Anodyne	FPR1	41	34
CCN(CCNC(=O)N[C@H](c1ccccc1)[C@H](C)O)C(=O)OC(C)(C)C	ZINC000853682775	FF	On-Demand	Anodyne	FPR1	41	34
CCN(CCNC(=O)N[C@H](c1ccccc1)[C@@H](C)O)C(=O)OC(C)(C)C	ZINC000853682776	FF	On-Demand	Anodyne	FPR1	41	34
O=C(NC[C@@H]1CN2CCC[C@H]2CO1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853682828	ED	On-Demand	Anodyne	EPHX2	19	43
O=C(NC[C@H]1CN2CCC[C@H]2CO1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853682829	ED	On-Demand	Anodyne	EPHX2	19	43
O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853682830	ED	On-Demand	Anodyne	EPHX2	19	43
O=C(NC[C@H]1CN2CCC[C@@H]2CO1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853682831	ED	On-Demand	Anodyne	EPHX2	19	43
C#CCOCCOc1cccc(OCC(=O)NC)c1	ZINC000853682911	CC	On-Demand	Mild	PLA2G4B	47	41
Cc1ccc(N2CCC(c3cccc(NC(=O)OC(C)(C)C)c3)CC2)nn1	ZINC000853683053	FJ	On-Demand	Anodyne	MCHR1	28	40
Cn1ncc(C#N)c1N1CCC(c2cccc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000853683054	GI	On-Demand	Mild	MCHR1	26	40
COC(=O)c1nccc(N2CCC([C@@H](O)c3cc(F)ccc3F)CC2)n1	ZINC000853683091	FE	On-Demand	Anodyne	SORD	57	34
CC(=O)c1ccc(N2CCC[C@@](O)(CO)C2)c(S(N)(=O)=O)c1	ZINC000853683157	EB	On-Demand	Anodyne	SLC12A5	57	35
CC(=O)c1ccc(N2CCC[C@](O)(CO)C2)c(S(N)(=O)=O)c1	ZINC000853683158	EB	On-Demand	Anodyne	SLC12A5	57	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(CC)cc2OC)CC1	ZINC000853683181	FE	On-Demand	Anodyne	P2RY12	44	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(CC)cc2OC)CC1	ZINC000853683182	FE	On-Demand	Anodyne	P2RY12	44	37
CCOC(=O)c1nccc(N2CCC([C@H](O)c3cc(F)ccc3F)CC2)n1	ZINC000853683281	GF	On-Demand	Anodyne	SORD	59	34
CCOC(=O)c1nccc(N2CCC([C@@H](O)c3cc(F)ccc3F)CC2)n1	ZINC000853683282	GF	On-Demand	Anodyne	SORD	59	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3nccnc3c2)CC1	ZINC000853683296	FD	On-Demand	Anodyne	P2RY12	99	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3nccnc3c2)CC1	ZINC000853683297	FD	On-Demand	Anodyne	P2RY12	99	39
Cc1ccc(N2CCC([C@H](O)c3cc(F)ccc3F)CC2)nn1	ZINC000853683323	DG	On-Demand	Anodyne	SCD1	55	41
Cc1ccc(N2CCC([C@H](O)c3cc(F)ccc3F)CC2)nn1	ZINC000853683323	DG	On-Demand	Anodyne	SCD	39	41
Cc1ccc(N2CCC([C@@H](O)c3cc(F)ccc3F)CC2)nn1	ZINC000853683324	DG	On-Demand	Anodyne	SCD1	55	41
Cc1ccc(N2CCC([C@@H](O)c3cc(F)ccc3F)CC2)nn1	ZINC000853683324	DG	On-Demand	Anodyne	SCD	39	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2CC)CC1	ZINC000853683369	DD	On-Demand	Anodyne	P2RY12	52	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2CC)CC1	ZINC000853683370	DD	On-Demand	Anodyne	P2RY12	52	36
CCN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853683380	GE	On-Demand	Anodyne	NPY5R	19	41
CCN(CCNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853683380	GE	On-Demand	Anodyne	FPR1	44	35
CCN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853683381	GE	On-Demand	Anodyne	NPY5R	19	41
CCN(CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(=O)OC(C)(C)C	ZINC000853683381	GE	On-Demand	Anodyne	FPR1	44	35
O=C(NC[C@@H]1CN2CCC[C@H]2CO1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853683404	FC	On-Demand	Anodyne	L3MBTL3	45	37
O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853683405	FC	On-Demand	Anodyne	L3MBTL3	45	37
O=C(NC[C@@H]1CN2CCC[C@H]2CO1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853683406	FC	On-Demand	Anodyne	L3MBTL3	45	37
O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853683407	FC	On-Demand	Anodyne	L3MBTL3	45	37
CCN1CCC[C@H](CNC(=O)NCc2ccc(N=c3cc[nH]cc3)cc2)C1	ZINC000853683444	FF	On-Demand	Anodyne	CCR3	78	40
C[C@@H](CCCc1cccnc1)Nc1cnc(F)cn1	ZINC000853683447	CF	On-Demand	Anodyne	PTAFR	31	46
O=C(NCc1ccc2ccccc2c1)NCC(O)(C1CC1)C1CC1	ZINC000853683462	DG	On-Demand	Anodyne	KCNJ11	51	35
Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)NCc1ccc2ccccc2c1	ZINC000853683470	GH	On-Demand	Anodyne	CXCR4	41	33
C[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)[C@H]1CCO	ZINC000853683478	EH	On-Demand	Anodyne	CXCR4	56	35
C[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)[C@H]1CCO	ZINC000853683478	EH	On-Demand	Anodyne	PREP	24	44
C[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)[C@@H]1CCO	ZINC000853683479	EH	On-Demand	Anodyne	CXCR4	56	35
C[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3c2)[C@@H]1CCO	ZINC000853683479	EH	On-Demand	Anodyne	PREP	24	44
O=C(NCc1ccc2ccccc2c1)NCc1cccnc1N1CCCC1	ZINC000853683493	FH	On-Demand	Anodyne	TRPV1	25	45
O=C(NCc1ccc2ccccc2c1)NCc1cccnc1N1CCCC1	ZINC000853683493	FH	On-Demand	Anodyne	SCN2A	20	48
O=C(NCc1ccc2ccccc2c1)NCc1cccnc1N1CCCC1	ZINC000853683493	FH	On-Demand	Anodyne	SCN10A	24	48
O=C(NCc1ccc2ccccc2c1)NCc1cccnc1N1CCCC1	ZINC000853683493	FH	On-Demand	Anodyne	NAMPT	46	40
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCCN2c2cc(C#N)cnn2)C1	ZINC000853683552	FG	On-Demand	Mild	GPR119	22	43
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCCN2c2cc(C#N)cnn2)C1	ZINC000853683553	FG	On-Demand	Mild	GPR119	22	43
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCCN2c2cc(C#N)cnn2)C1	ZINC000853683554	FG	On-Demand	Mild	GPR119	22	43
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCCN2c2cc(C#N)cnn2)C1	ZINC000853683555	FG	On-Demand	Mild	GPR119	22	43
CC(C)(CO)[C@H](NC(=O)NCc1ccc2ccccc2c1)C1CC1	ZINC000853683556	EG	On-Demand	Anodyne	FCER2	29	41
CC(C)(CO)[C@H](NC(=O)NCc1ccc2ccccc2c1)C1CC1	ZINC000853683556	EG	On-Demand	Anodyne	TPH1	37	41
CC(=O)c1ccc(N2CCC[C@@](O)(CO)C2)c(I)c1	ZINC000853683617	GD	On-Demand	Anodyne	SLC12A5	51	35
CC(=O)c1ccc(N2CCC[C@](O)(CO)C2)c(I)c1	ZINC000853683618	GD	On-Demand	Anodyne	SLC12A5	51	35
O=C(NCc1ccc2ccccc2c1)N1CCC(c2ccon2)CC1	ZINC000853683690	EH	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccc2ccccc2c1)N1CCC(c2ccon2)CC1	ZINC000853683690	EH	On-Demand	Anodyne	SMO	45	44
O=C(NCc1ccc2ccccc2c1)N(CCN1CCOCC1)CC1CC1	ZINC000853683719	FG	On-Demand	Anodyne	CASR	61	41
CN1CCC(CNC(=O)NCC[S@](=O)CC(F)(F)F)CC1	ZINC000853683722	EC	On-Demand	Anodyne	CACNA1I	44	38
CN1CCC(CNC(=O)NCC[S@@](=O)CC(F)(F)F)CC1	ZINC000853683723	EC	On-Demand	Anodyne	CACNA1I	44	38
O=C1CC[C@@H]2CN(C(=O)NCc3ccc4ccccc4c3)CC[C@@H]2N1	ZINC000853683726	EF	On-Demand	Anodyne	CXCR4	45	34
O=C1CC[C@@H]2CN(C(=O)NCc3ccc4ccccc4c3)CC[C@H]2N1	ZINC000853683727	EF	On-Demand	Anodyne	CXCR4	45	34
O=C1CC[C@H]2CN(C(=O)NCc3ccc4ccccc4c3)CC[C@@H]2N1	ZINC000853683728	EF	On-Demand	Anodyne	CXCR4	45	34
O=C1CC[C@H]2CN(C(=O)NCc3ccc4ccccc4c3)CC[C@H]2N1	ZINC000853683729	EF	On-Demand	Anodyne	CXCR4	45	34
COC(=O)[C@H](F)CNc1c(Br)cccc1[N+](=O)[O-]	ZINC000853683733	DE	On-Demand	Bother	COLA	104	34
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(OC)cc2Br)CC1	ZINC000853683809	GD	On-Demand	Anodyne	P2RY12	79	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(OC)cc2Br)CC1	ZINC000853683810	GD	On-Demand	Anodyne	P2RY12	79	39
CC(C)(C)OC(=O)N(CCCNC(=O)N1CC[C@@H]2C[C@H]2C1)Cc1cccnc1	ZINC000853683910	GG	On-Demand	Anodyne	CHRNA7	45	34
CC(C)(C)OC(=O)N(CCCNC(=O)N1CC[C@@H]2C[C@@H]2C1)Cc1cccnc1	ZINC000853683911	GG	On-Demand	Anodyne	CHRNA7	45	34
CC(C)(C)OC(=O)N(CCCNC(=O)N1CC[C@H]2C[C@H]2C1)Cc1cccnc1	ZINC000853683912	GG	On-Demand	Anodyne	CHRNA7	45	34
CC(C)(C)OC(=O)N(CCCNC(=O)N1CC[C@H]2C[C@@H]2C1)Cc1cccnc1	ZINC000853683913	GG	On-Demand	Anodyne	CHRNA7	45	34
C[C@@H]1CN(C(=O)NCc2ccc3ccccc3c2)CCN1S(C)(=O)=O	ZINC000853683931	FE	On-Demand	Anodyne	MMP13	16	47
C[C@@H]1CN(C(=O)NCc2ccc3ccccc3c2)CCN1S(C)(=O)=O	ZINC000853683931	FE	On-Demand	Anodyne	TRY2_BOVIN	69	36
C[C@@H]1CN(C(=O)NCc2ccc3ccccc3c2)CCN1S(C)(=O)=O	ZINC000853683931	FE	On-Demand	Anodyne	MMP7	15	47
Cc1ccc(N2CCCC[C@@H]2[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000853683952	FH	On-Demand	Anodyne	GPR119	28	43
Cc1ccc(N2CCCC[C@@H]2[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000853683953	FH	On-Demand	Anodyne	GPR119	28	43
Cc1ccc(N2CCCC[C@H]2[C@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000853683954	FH	On-Demand	Anodyne	GPR119	28	43
Cc1ccc(N2CCCC[C@H]2[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)nn1	ZINC000853683955	FH	On-Demand	Anodyne	GPR119	28	43
O=C(NCc1ccc2ccccc2c1)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853683972	FI	On-Demand	Anodyne	EPHX2	21	41
O=C(NCc1ccc2ccccc2c1)N1CCC([C@H]2CCCCO2)CC1	ZINC000853683973	FI	On-Demand	Anodyne	EPHX2	21	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2c3ccccc3CS2(=O)=O)CC1	ZINC000853683975	GD	On-Demand	Anodyne	P2RY12	84	40
CCOC(=O)N1CCN(C(=O)[C@H](C)N2c3ccccc3CS2(=O)=O)CC1	ZINC000853683976	GD	On-Demand	Anodyne	P2RY12	84	40
C[C@@H](CCCc1cccnc1)Nc1cc(F)ncn1	ZINC000853684000	CF	On-Demand	Anodyne	PTAFR	32	45
COc1cc(Br)n(C[C@@H]2CCN(C(=O)c3ccccc3)C2)n1	ZINC000853684017	FF	On-Demand	Anodyne	SLC18A3	15	42
COc1cc(Br)n(C[C@H]2CCN(C(=O)c3ccccc3)C2)n1	ZINC000853684018	FF	On-Demand	Anodyne	SLC18A3	15	42
C[C@@H](CCCc1cccnc1)Nc1ncnc(F)c1Br	ZINC000853684070	EH	On-Demand	Anodyne	PTAFR	26	44
C#CCOCCN(c1nccs1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853684090	FD	On-Demand	Mild	MMP13	15	42
C#CCOCCN(c1nccs1)S(=O)(=O)c1ccc(OC)cc1	ZINC000853684090	FD	On-Demand	Mild	MMP9	16	42
CN1CCC(CNC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000853684105	GG	On-Demand	Anodyne	CCR3	58	40
CN1CCC(CNC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000853684105	GG	On-Demand	Anodyne	EPHX2	24	40
CN1CCC(CNC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)CC1	ZINC000853684105	GG	On-Demand	Anodyne	CACNA1I	62	39
CN1CCC(CNC(=O)NCc2ccc(N3CCS(=O)(=O)CC3)cc2)CC1	ZINC000853684115	GD	On-Demand	Clean	CACNA1I	44	39
C=CCOCCCNC(=O)NCc1ccc2ccccc2c1	ZINC000853684122	CG	On-Demand	Mild	HRH2	17	41
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853684150	FF	On-Demand	Anodyne	CCR3	59	44
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853684150	FF	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853684150	FF	On-Demand	Anodyne	L3MBTL3	53	38
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853684151	FF	On-Demand	Anodyne	CCR3	59	44
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853684151	FF	On-Demand	Anodyne	EPHX2	18	40
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853684151	FF	On-Demand	Anodyne	L3MBTL3	53	38
CCn1c(=O)cc(Cl)n(Cc2ccc(OC)cc2)c1=O	ZINC000853684155	CD	On-Demand	Anodyne	PDE5A	15	44
CCn1c(=O)cc(Cl)n(Cc2ccc(OC)cc2)c1=O	ZINC000853684155	CD	On-Demand	Anodyne	PROKR1	88	46
CCn1c(=O)cc(Cl)n(Cc2ccc(OC)cc2)c1=O	ZINC000853684155	CD	On-Demand	Anodyne	NPBWR1	48	38
O=C(NCc1ccc2ccccc2c1)N[C@@H](c1ccncc1)C1(CO)CCC1	ZINC000853684156	GH	On-Demand	Anodyne	TPH1	37	41
O=C(NCc1ccc2ccccc2c1)N[C@H](c1ccncc1)C1(CO)CCC1	ZINC000853684157	GH	On-Demand	Anodyne	TPH1	37	41
CN1CCC(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)CC1	ZINC000853684164	EC	On-Demand	Anodyne	CACNA1I	42	35
COC(=O)[C@H](F)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853684165	CF	On-Demand	Anodyne	EGFR	48	38
COC(=O)[C@H](F)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853684165	CF	On-Demand	Anodyne	CLK4	49	38
CC[C@@H](O)CNC(=O)NCc1ccc2ccccc2c1	ZINC000853684181	CE	On-Demand	Anodyne	TPH1	42	39
CC[C@@H](O)CNC(=O)NCc1ccc2ccccc2c1	ZINC000853684181	CE	On-Demand	Anodyne	ACE2	16	41
CC[C@@H](O)CNC(=O)NCc1ccc2ccccc2c1	ZINC000853684181	CE	On-Demand	Anodyne	PDS	56	35
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853684185	FI	On-Demand	Anodyne	NMT1	29	40
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853684186	FI	On-Demand	Anodyne	NMT1	29	40
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853684187	FI	On-Demand	Anodyne	NMT1	29	40
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853684188	FI	On-Demand	Anodyne	NMT1	29	40
O=C(NCc1ccc2ccccc2c1)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853684211	DG	On-Demand	Anodyne	CXCR4	48	32
O=C(NCc1ccc2ccccc2c1)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853684212	DG	On-Demand	Anodyne	CXCR4	48	32
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H](CCF)C1	ZINC000853684242	DI	On-Demand	Anodyne	F2	20	46
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H](CCF)C1	ZINC000853684242	DI	On-Demand	Anodyne	CCR3	56	42
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H](CCF)C1	ZINC000853684242	DI	On-Demand	Anodyne	DPP7	24	46
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H](CCF)C1	ZINC000853684243	DI	On-Demand	Anodyne	F2	20	46
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H](CCF)C1	ZINC000853684243	DI	On-Demand	Anodyne	CCR3	56	42
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H](CCF)C1	ZINC000853684243	DI	On-Demand	Anodyne	DPP7	24	46
CCn1c(=O)cc(Cl)n(C[C@@H]2CCN(C(=O)c3ccccc3)C2)c1=O	ZINC000853684255	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	33
CCn1c(=O)cc(Cl)n(C[C@H]2CCN(C(=O)c3ccccc3)C2)c1=O	ZINC000853684256	FD	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	33
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCCN2c2cnccn2)C1	ZINC000853684268	EG	On-Demand	Anodyne	GPR119	30	58
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCCN2c2cnccn2)C1	ZINC000853684269	EG	On-Demand	Anodyne	GPR119	30	58
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCCN2c2cnccn2)C1	ZINC000853684270	EG	On-Demand	Anodyne	GPR119	30	58
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCCN2c2cnccn2)C1	ZINC000853684271	EG	On-Demand	Anodyne	GPR119	30	58
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccc2ccccc2c1	ZINC000853684282	GH	On-Demand	Clean	STAT6	23	42
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCCN2c2cc(F)ncn2)C1	ZINC000853684292	FH	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCCN2c2cc(F)ncn2)C1	ZINC000853684293	FH	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCCN2c2cc(F)ncn2)C1	ZINC000853684294	FH	On-Demand	Anodyne	GPR119	34	43
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCCN2c2cc(F)ncn2)C1	ZINC000853684295	FH	On-Demand	Anodyne	GPR119	34	43
O=C(NCc1ccc2ccccc2c1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853684302	FI	On-Demand	Anodyne	EPHX2	29	44
O=C(NCCC1SCCS1)NCc1ccc2ccccc2c1	ZINC000853684305	EH	On-Demand	Anodyne	CXCR4	43	33
COC(=O)N(C)CCNC(=O)NCc1ccc2ccccc2c1	ZINC000853684306	DE	On-Demand	Anodyne	MTNR1A	30	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2C[C@@H]2C1	ZINC000853684314	CG	On-Demand	Anodyne	CCR3	48	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2C[C@@H]2C1	ZINC000853684314	CG	On-Demand	Anodyne	CHRNA7	15	47
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2C[C@@H]2C1	ZINC000853684314	CG	On-Demand	Anodyne	EPHX2	29	44
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853684315	CG	On-Demand	Anodyne	CCR3	48	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853684315	CG	On-Demand	Anodyne	CHRNA7	15	47
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853684315	CG	On-Demand	Anodyne	EPHX2	29	44
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2C[C@H]2C1	ZINC000853684316	CG	On-Demand	Anodyne	CCR3	48	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2C[C@H]2C1	ZINC000853684316	CG	On-Demand	Anodyne	CHRNA7	15	47
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2C[C@H]2C1	ZINC000853684316	CG	On-Demand	Anodyne	EPHX2	29	44
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2C[C@H]2C1	ZINC000853684317	CG	On-Demand	Anodyne	CCR3	48	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2C[C@H]2C1	ZINC000853684317	CG	On-Demand	Anodyne	CHRNA7	15	47
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2C[C@H]2C1	ZINC000853684317	CG	On-Demand	Anodyne	EPHX2	29	44
O=C(NCc1ccc2ccccc2c1)NCC1CCC(O)CC1	ZINC000853684320	DG	On-Demand	Anodyne	VCP	56	33
O=C1CCCN1C[C@@H]1CCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684337	FF	On-Demand	Anodyne	NMT1	29	40
O=C1CCCN1C[C@H]1CCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684338	FF	On-Demand	Anodyne	NMT1	29	40
O=C(NCc1ccc2ccccc2c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853684339	EG	On-Demand	Anodyne	CXCR4	38	40
O=C(NCc1ccc2ccccc2c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853684339	EG	On-Demand	Anodyne	CPT1A	126	46
O=C(NCc1ccc2ccccc2c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853684339	EG	On-Demand	Anodyne	MC3R	41	34
O=C(NCc1ccc2ccccc2c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853684340	EG	On-Demand	Anodyne	CXCR4	38	40
O=C(NCc1ccc2ccccc2c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853684340	EG	On-Demand	Anodyne	CPT1A	126	46
O=C(NCc1ccc2ccccc2c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853684340	EG	On-Demand	Anodyne	MC3R	41	34
CO[C@]1(CO)CCCN(C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684342	EF	On-Demand	Anodyne	SLC12A5	54	35
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3cncnc3c2)C1	ZINC000853684355	EF	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3cncnc3c2)C1	ZINC000853684356	EF	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC[C@@H]([C@@H]2CCCCN2c2cnc(F)cn2)C1	ZINC000853684358	FH	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC[C@H]([C@@H]2CCCCN2c2cnc(F)cn2)C1	ZINC000853684359	FH	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC[C@@H]([C@H]2CCCCN2c2cnc(F)cn2)C1	ZINC000853684360	FH	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1CCC[C@H]([C@H]2CCCCN2c2cnc(F)cn2)C1	ZINC000853684361	FH	On-Demand	Anodyne	GPR119	36	40
O=C(NCc1ccc2ccccc2c1)N1CCC(CO)(CO)C1	ZINC000853684369	DD	On-Demand	Anodyne	NPFFR2	19	45
O=C(NCc1ccc2ccccc2c1)N1CCC(CO)(CO)C1	ZINC000853684369	DD	On-Demand	Anodyne	NPFFR1	23	45
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CCOC2=O)CC1	ZINC000853684374	FF	On-Demand	Anodyne	CXCR4	46	32
O=C(NCc1ccc2ccccc2c1)N1CCC(N2CCOC2=O)CC1	ZINC000853684374	FF	On-Demand	Anodyne	LUXR	18	44
O=C(NCc1ccc2ccccc2c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853684376	EF	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853684377	EF	On-Demand	Anodyne	NPSR1	26	40
O=C(NCc1ccc2ccccc2c1)N1CCN([C@H]2CCOC2)CC1	ZINC000853684378	EE	On-Demand	Anodyne	NAMPT	18	42
O=C(NCc1ccc2ccccc2c1)N1CCN([C@@H]2CCOC2)CC1	ZINC000853684379	EE	On-Demand	Anodyne	NAMPT	18	42
CCCOc1cccc(CONC(=N)C(C)C)c1	ZINC000853684406	CG	On-Demand	Anodyne	UPP1	54	41
Cc1ccc(N2CCC(Oc3ccc(Cl)cn3)CC2)nn1	ZINC000853684479	DF	On-Demand	Anodyne	SCD1	52	47
CCO[C@@H]1C[C@@H](NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684507	CG	On-Demand	Anodyne	TIMP3	72	39
CN1CCC(CNC(=O)NCCCc2nc[nH]n2)CC1	ZINC000853684515	CC	On-Demand	Anodyne	CACNA1I	42	35
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684528	DF	On-Demand	Anodyne	MTNR1A	33	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684528	DF	On-Demand	Anodyne	MTNR1B	26	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684528	DF	On-Demand	Anodyne	EPHX2	21	42
CCN1CC[C@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684548	EG	On-Demand	Anodyne	DRD4	17	42
CCN1CC[C@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684548	EG	On-Demand	Anodyne	CCR3	29	42
CCN1CC[C@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684548	EG	On-Demand	Anodyne	CCR5	68	57
CCN1CC[C@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684548	EG	On-Demand	Anodyne	MCHR1	22	45
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684549	EG	On-Demand	Anodyne	DRD4	17	42
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684549	EG	On-Demand	Anodyne	CCR3	29	42
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684549	EG	On-Demand	Anodyne	CCR5	68	57
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc3ccccc3c2)C1	ZINC000853684549	EG	On-Demand	Anodyne	MCHR1	22	45
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	DRD4	23	44
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	HRH1	18	40
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	OPRK1	19	41
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	SLC6A3	16	41
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	HTR4	53	39
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	SIGMAR1	37	52
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	NMT1	31	41
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	CCR3	89	43
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	MCHR1	21	44
O=C(NCc1ccc2ccccc2c1)NCC1CCN(CC2CC2)CC1	ZINC000853684554	FH	On-Demand	Anodyne	CACNA1I	63	39
O=C(NCc1ccc2ccccc2c1)NC1CCN([C@H]2CCOC2)CC1	ZINC000853684559	FF	On-Demand	Anodyne	SIGMAR1	18	48
O=C(NCc1ccc2ccccc2c1)NC1CCN([C@H]2CCOC2)CC1	ZINC000853684559	FF	On-Demand	Anodyne	CCR3	42	42
O=C(NCc1ccc2ccccc2c1)NC1CCN([C@H]2CCOC2)CC1	ZINC000853684559	FF	On-Demand	Anodyne	MCHR1	20	48
O=C(NCc1ccc2ccccc2c1)NC1CCN([C@@H]2CCOC2)CC1	ZINC000853684560	FF	On-Demand	Anodyne	SIGMAR1	18	48
O=C(NCc1ccc2ccccc2c1)NC1CCN([C@@H]2CCOC2)CC1	ZINC000853684560	FF	On-Demand	Anodyne	CCR3	42	42
O=C(NCc1ccc2ccccc2c1)NC1CCN([C@@H]2CCOC2)CC1	ZINC000853684560	FF	On-Demand	Anodyne	MCHR1	20	48
COc1ccc(N2CC[C@H](NC(=O)NCC3CCN(C)CC3)C2)cc1	ZINC000853684561	ED	On-Demand	Clean	MTNR1A	23	48
COc1ccc(N2CC[C@H](NC(=O)NCC3CCN(C)CC3)C2)cc1	ZINC000853684561	ED	On-Demand	Clean	MTNR1B	21	48
COc1ccc(N2CC[C@H](NC(=O)NCC3CCN(C)CC3)C2)cc1	ZINC000853684561	ED	On-Demand	Clean	EPHX2	16	43
COc1ccc(N2CC[C@H](NC(=O)NCC3CCN(C)CC3)C2)cc1	ZINC000853684561	ED	On-Demand	Clean	MCHR1	15	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3cncnc3c2)CC1	ZINC000853684563	FD	On-Demand	Anodyne	P2RY12	103	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3cncnc3c2)CC1	ZINC000853684564	FD	On-Demand	Anodyne	P2RY12	103	38
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853684567	DG	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc2ccccc2c1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853684568	DG	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853684569	DG	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc2ccccc2c1)N1CC[C@H]2COC[C@H]2C1	ZINC000853684570	DG	On-Demand	Anodyne	EPHX2	18	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	CHRM2	15	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	DRD2	15	44
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	DRD4	45	47
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	HRH2	17	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	CHRM3	26	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	SIGMAR1	42	53
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	CCR3	60	48
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	BDKRB1	16	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	NPFFR2	30	44
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	MCHR1	44	52
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	MCHR2	46	33
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684574	GG	On-Demand	Anodyne	NPFFR1	44	44
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	CHRM2	15	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	DRD2	15	44
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	DRD4	45	47
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	HRH2	17	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	CHRM3	26	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	SIGMAR1	42	53
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	CCR3	60	48
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	BDKRB1	16	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	NPFFR2	30	44
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	MCHR1	44	52
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	MCHR2	46	33
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccc2ccccc2c1	ZINC000853684575	GG	On-Demand	Anodyne	NPFFR1	44	44
CN(CC(=O)N1CCCC1)C(=O)NCc1ccc2ccccc2c1	ZINC000853684581	EF	On-Demand	Anodyne	DPP7	45	51
FC(F)(F)COc1ccc(N2CCC(Oc3ccc(Cl)cn3)CC2)nn1	ZINC000853684617	GH	On-Demand	Anodyne	SCD1	62	39
C[C@H](O)c1ccn(C[C@H]2CCN(C(=O)c3ccccc3)C2)n1	ZINC000853684633	CE	On-Demand	Anodyne	L3MBTL3	54	35
C[C@H](O)c1ccn(C[C@@H]2CCN(C(=O)c3ccccc3)C2)n1	ZINC000853684635	CE	On-Demand	Anodyne	L3MBTL3	54	35
CC(=O)c1ccc(C(F)(F)F)nc1N1CCC(Oc2ccc(Cl)cn2)CC1	ZINC000853684652	GI	On-Demand	Anodyne	LIPG	28	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(OC)c(OC)c(OC)c2)CC1	ZINC000853684657	GD	On-Demand	Anodyne	P2RY12	40	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(OC)c(OC)c(OC)c2)CC1	ZINC000853684658	GD	On-Demand	Anodyne	P2RY12	40	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2OC(C)C)CC1	ZINC000853684678	FD	On-Demand	Anodyne	P2RY12	65	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2OC(C)C)CC1	ZINC000853684678	FD	On-Demand	Anodyne	GPR119	20	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2OC(C)C)CC1	ZINC000853684679	FD	On-Demand	Anodyne	P2RY12	65	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2OC(C)C)CC1	ZINC000853684679	FD	On-Demand	Anodyne	GPR119	20	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cc(F)ccc1F	ZINC000853684681	GG	On-Demand	Anodyne	P2RX7	55	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cc(F)ccc1F	ZINC000853684681	GG	On-Demand	Anodyne	GPR119	42	57
C#C[C@H](NC(=O)NCc1ccc2ccccc2c1)C1CCOCC1	ZINC000853684689	DG	On-Demand	Mild	NMT1	30	41
C#C[C@@H](NC(=O)NCc1ccc2ccccc2c1)C1CCOCC1	ZINC000853684690	DG	On-Demand	Mild	NMT1	30	41
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853684691	FG	On-Demand	Anodyne	CCR3	49	43
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853684691	FG	On-Demand	Anodyne	EPHX2	19	45
O=C(NCc1ccc2ccccc2c1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853684691	FG	On-Demand	Anodyne	L3MBTL3	99	41
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853684692	FG	On-Demand	Anodyne	CCR3	49	43
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853684692	FG	On-Demand	Anodyne	EPHX2	19	45
O=C(NCc1ccc2ccccc2c1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853684692	FG	On-Demand	Anodyne	L3MBTL3	99	41
O=C(NCc1ccc2ccccc2c1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853684700	FH	On-Demand	Anodyne	F2	15	44
O=C(NCc1ccc2ccccc2c1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853684700	FH	On-Demand	Anodyne	CCR3	97	46
O=C(NCc1ccc2ccccc2c1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853684701	FH	On-Demand	Anodyne	F2	15	44
O=C(NCc1ccc2ccccc2c1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853684701	FH	On-Demand	Anodyne	CCR3	97	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnn(C(C)(C)C)c2=O)CC1	ZINC000853684725	FC	On-Demand	Anodyne	P2RY12	54	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnn(C(C)(C)C)c2=O)CC1	ZINC000853684726	FC	On-Demand	Anodyne	P2RY12	54	37
N#C[C@H]1CCCC[C@@H]1NC(=O)NCc1ccc2ccccc2c1	ZINC000853684744	DH	On-Demand	Mild	SSTR3	24	46
N#C[C@H]1CCCC[C@H]1NC(=O)NCc1ccc2ccccc2c1	ZINC000853684745	DH	On-Demand	Mild	SSTR3	24	46
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccc2ccccc2c1	ZINC000853684746	DH	On-Demand	Mild	SSTR3	24	46
N#C[C@@H]1CCCC[C@H]1NC(=O)NCc1ccc2ccccc2c1	ZINC000853684747	DH	On-Demand	Mild	SSTR3	24	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)c(C(C)=O)c2)CC1	ZINC000853684767	GD	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)c(C(C)=O)c2)CC1	ZINC000853684768	GD	On-Demand	Anodyne	P2RY12	48	38
COc1ccc(OCc2oc(C)nc2C)cc1C(C)=O	ZINC000853684781	CG	On-Demand	Anodyne	MAOB	22	45
COc1ccc(OCc2oc(C)nc2C)cc1C(C)=O	ZINC000853684781	CG	On-Demand	Anodyne	PPARD	33	42
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	DRD2	16	50
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	DRD4	44	50
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	ACHE	53	48
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	HTR4	56	43
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	LTA4H	31	40
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	HRH3	18	46
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	SIGMAR1	47	51
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	SSTR5	59	35
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	BCHE	17	43
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	CCR3	93	49
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	NPFFR2	30	41
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	FAAH	22	43
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	MCHR1	54	48
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	CACNA1I	63	44
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	NPFFR1	39	41
O=C(NCc1ccc2ccccc2c1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853684811	GH	On-Demand	Anodyne	NAMPT	42	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2OC)CC1	ZINC000853684832	ED	On-Demand	Anodyne	P2RY12	75	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2OC)CC1	ZINC000853684832	ED	On-Demand	Anodyne	GPR119	17	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2OC)CC1	ZINC000853684833	ED	On-Demand	Anodyne	P2RY12	75	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2OC)CC1	ZINC000853684833	ED	On-Demand	Anodyne	GPR119	17	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C)c2F)CC1	ZINC000853684837	EE	On-Demand	Anodyne	P2RY12	58	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C)c2F)CC1	ZINC000853684838	EE	On-Demand	Anodyne	P2RY12	58	39
CC(C)c1ccc2ncnc(NCc3cnc(Cl)cn3)c2c1	ZINC000853684845	DH	On-Demand	Anodyne	CLK4	61	38
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2cc(F)ccc2F)C1	ZINC000853684862	FG	On-Demand	Anodyne	GPR119	28	55
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2cc(F)ccc2F)C1	ZINC000853684863	FG	On-Demand	Anodyne	GPR119	28	55
CCCc1ccc(N2CCC(Oc3ccc(Cl)cn3)CC2)nn1	ZINC000853684883	EH	On-Demand	Anodyne	SCD1	45	42
Cn1nnc2c(N3CCC(Oc4ccc(Cl)cn4)CC3)ncnc21	ZINC000853684887	ED	On-Demand	Anodyne	PDE3B	42	38
Cc1cc(CO)cc(N2CCC(Oc3ccc(Cl)cn3)CC2)n1	ZINC000853684893	EF	On-Demand	Anodyne	DCK	37	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000853684895	FE	On-Demand	Anodyne	P2RX7	41	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2cc(F)ccc2F)C1	ZINC000853684896	FE	On-Demand	Anodyne	P2RX7	41	37
CCCOc1cccc(Cn2ccc([C@@H](C)O)n2)c1	ZINC000853684899	CF	On-Demand	Anodyne	HRH2	26	42
CCCOc1cccc(Cn2ccc([C@H](C)O)n2)c1	ZINC000853684900	CF	On-Demand	Anodyne	HRH2	26	42
C=C(Cl)COc1cc(OC)c(OC)c(OC)c1	ZINC000853684919	CF	On-Demand	Mild	TUBB1	47	35
Cc1cccc2c1CC[C@@H]2NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1	ZINC000853684920	GF	On-Demand	Anodyne	P2RY14	42	31
Cc1cccc2c1CC[C@H]2NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1	ZINC000853684921	GF	On-Demand	Anodyne	P2RY14	42	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000853684923	GD	On-Demand	Bother	P2RY12	46	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2nc(C)cc(C)c2[N+](=O)[O-])CC1	ZINC000853684924	GD	On-Demand	Bother	P2RY12	46	36
COc1ccc(Cn2cc(CCO)cn2)cc1	ZINC000853684943	BD	On-Demand	Anodyne	PROKR1	63	35
COc1ccc(Cn2cc(CCO)cn2)cc1	ZINC000853684943	BD	On-Demand	Anodyne	NPBWR1	41	38
COc1cc(OCc2oc(C)nc2C)cc(OC)c1OC	ZINC000853684953	CF	On-Demand	Anodyne	DRTS_PLAFK	15	40
Fc1cnc(N2CCC(Oc3ccc(Cl)cn3)CC2)cn1	ZINC000853684995	DF	On-Demand	Anodyne	DCK	40	42
CN1CCC(CNC(=O)NCc2ncccn2)CC1	ZINC000853685009	CC	On-Demand	Anodyne	CACNA1I	64	37
CN1CCC(CNC(=O)NCC2SCCS2)CC1	ZINC000853685044	CD	On-Demand	Anodyne	CACNA1I	53	35
N=C(NOCc1ccc(F)cc1[N+](=O)[O-])[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685077	GF	On-Demand	Bother	DRD4	19	41
N=C(NOCc1ccc(F)cc1[N+](=O)[O-])[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685078	GF	On-Demand	Bother	DRD4	19	41
N#Cc1ccc(CCONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)cc1	ZINC000853685096	FF	On-Demand	Mild	DRD4	19	45
N#Cc1ccc(CCONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)cc1	ZINC000853685097	FF	On-Demand	Mild	DRD4	19	45
N#Cc1cc2cccnc2nc1N1CCC(Oc2ccc(Cl)cn2)CC1	ZINC000853685103	FH	On-Demand	Mild	DCK	41	37
N#Cc1cnnc(N2CCC(Oc3ccc(Cl)cn3)CC2)c1	ZINC000853685133	DE	On-Demand	Mild	DCK	48	41
Fc1ncnc(N2CCC(Oc3ccc(Cl)cn3)CC2)c1Br	ZINC000853685134	GG	On-Demand	Anodyne	DCK	50	41
CC(=O)c1ccnc(N2CCC(Oc3ccc(Cl)cn3)CC2)c1	ZINC000853685167	EG	On-Demand	Anodyne	DCK	35	40
CC(=O)c1ccnc(N2CCC(Oc3ccc(Cl)cn3)CC2)c1	ZINC000853685167	EG	On-Demand	Anodyne	SCD1	38	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2-c2nccs2)CC1	ZINC000853685169	GF	On-Demand	Anodyne	P2RY12	66	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2-c2nccs2)CC1	ZINC000853685170	GF	On-Demand	Anodyne	P2RY12	66	36
CCN1CC[C@H](ONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)C1=O	ZINC000853685181	ED	On-Demand	Anodyne	DRD4	33	41
C#CCOCCOc1ccc(OC)c(C(C)=O)c1	ZINC000853685184	BD	On-Demand	Mild	MAOB	15	45
CCN1CC[C@H](ONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)C1=O	ZINC000853685185	ED	On-Demand	Anodyne	DRD4	33	41
CS(=O)(=O)N1CC[C@H](CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685187	GC	On-Demand	Anodyne	DRD4	29	42
CS(=O)(=O)N1CC[C@H](CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685187	GC	On-Demand	Anodyne	ACHE	42	39
CS(=O)(=O)N1CC[C@@H](CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685189	GC	On-Demand	Anodyne	DRD4	29	42
CS(=O)(=O)N1CC[C@@H](CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685189	GC	On-Demand	Anodyne	ACHE	42	39
CS(=O)(=O)N1CC[C@H](CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685191	GC	On-Demand	Anodyne	DRD4	29	42
CS(=O)(=O)N1CC[C@H](CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685191	GC	On-Demand	Anodyne	ACHE	42	39
CS(=O)(=O)N1CC[C@@H](CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685193	GC	On-Demand	Anodyne	DRD4	29	42
CS(=O)(=O)N1CC[C@@H](CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)C1	ZINC000853685193	GC	On-Demand	Anodyne	ACHE	42	39
COCCN(CCF)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000853685209	FD	On-Demand	Anodyne	SIGMAR1	26	43
COCCN(CCF)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000853685209	FD	On-Demand	Anodyne	MCHR1	33	42
COc1cccc(SCCONC(=N)C(C)C)c1	ZINC000853685218	CF	On-Demand	Anodyne	MTNR1A	26	52
COc1cccc(SCCONC(=N)C(C)C)c1	ZINC000853685218	CF	On-Demand	Anodyne	MTNR1B	26	52
COC(=O)C1(CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685238	ED	On-Demand	Anodyne	DRD4	30	42
COC(=O)C1(CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685238	ED	On-Demand	Anodyne	SIGMAR1	55	44
COC(=O)C1(CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685238	ED	On-Demand	Anodyne	NPFFR1	42	36
COC(=O)C1(CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685238	ED	On-Demand	Anodyne	SLC12A5	57	37
COC(=O)C1(CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685239	ED	On-Demand	Anodyne	DRD4	30	42
COC(=O)C1(CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685239	ED	On-Demand	Anodyne	SIGMAR1	55	44
COC(=O)C1(CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685239	ED	On-Demand	Anodyne	NPFFR1	42	36
COC(=O)C1(CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685239	ED	On-Demand	Anodyne	SLC12A5	57	37
Cc1ccccc1CN1CCC(NC(=O)CON=C2CCCOCC2)CC1	ZINC000853685277	FF	On-Demand	Mild	SIGMAR1	16	43
Cc1ccccc1CN1CCC(NC(=O)CON=C2CCCOCC2)CC1	ZINC000853685277	FF	On-Demand	Mild	MCHR1	19	40
CN1CCC(CNC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)CC1	ZINC000853685280	FE	On-Demand	Anodyne	CACNA1I	54	36
N=C(NOCC1C[C@@H]2C[C@H]2C1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685281	EE	On-Demand	Anodyne	DRD4	24	44
N=C(NOCC1C[C@@H]2C[C@H]2C1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685282	EE	On-Demand	Anodyne	DRD4	24	44
N=C(NOC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685283	EE	On-Demand	Anodyne	DRD4	24	44
N=C(NOC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685284	EE	On-Demand	Anodyne	DRD4	24	44
Fc1cc(N2CCC(Oc3ccc(Cl)cn3)CC2)ncn1	ZINC000853685313	DF	On-Demand	Anodyne	DCK	64	52
Cn1c(S)nnc1CCNC(=O)NCc1cc(F)ccc1F	ZINC000853685314	ED	On-Demand	Anodyne	P2RX7	49	37
N=C(NOCc1cccnc1N)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685361	ED	On-Demand	Anodyne	DRD4	24	41
N=C(NOCc1cccnc1N)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685363	ED	On-Demand	Anodyne	DRD4	24	41
N=C(NOCCC1SCCS1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685404	FF	On-Demand	Anodyne	DRD4	20	45
N=C(NOCCC1SCCS1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685407	FF	On-Demand	Anodyne	DRD4	20	45
N=C(NOCCC1(O)CCC1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685447	ED	On-Demand	Anodyne	DRD4	19	44
N=C(NOCCC1(O)CCC1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685449	ED	On-Demand	Anodyne	DRD4	19	44
CN1CCC(CNC(=O)NCc2ccc(N=c3cc[nH]cc3)cc2)CC1	ZINC000853685455	FE	On-Demand	Anodyne	CACNA1I	43	39
N=C(NOCCO[C@H]1CC1(F)F)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685456	FD	On-Demand	Anodyne	DRD4	19	41
N=C(NOCCO[C@H]1CC1(F)F)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685457	FD	On-Demand	Anodyne	DRD4	19	41
N=C(NOCCO[C@@H]1CC1(F)F)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685458	FD	On-Demand	Anodyne	DRD4	19	41
N=C(NOCCO[C@@H]1CC1(F)F)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685459	FD	On-Demand	Anodyne	DRD4	19	41
N=C(NOCc1cncs1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685480	EE	On-Demand	Anodyne	DRD4	19	41
N=C(NOCc1cncs1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685481	EE	On-Demand	Anodyne	DRD4	19	41
CN1CCC(CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)CC1	ZINC000853685507	FE	On-Demand	Anodyne	CACNA1I	54	40
Nc1cccc2c(N3CCC(Oc4ccc(Cl)cn4)CC3)nccc12	ZINC000853685579	FH	On-Demand	Anodyne	DCK	40	36
COc1ncccc1OC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853685597	DE	On-Demand	Anodyne	GPR119	38	42
COc1ncccc1OC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853685600	DE	On-Demand	Anodyne	GPR119	38	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc(CO)c1	ZINC000853685605	GE	On-Demand	Anodyne	GPR119	29	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@H](O)c2ccccc2)CC1	ZINC000853685609	GD	On-Demand	Anodyne	P2RY12	187	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@H](O)c2ccccc2)CC1	ZINC000853685611	GD	On-Demand	Anodyne	P2RY12	187	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@@H](O)c2ccccc2)CC1	ZINC000853685614	GD	On-Demand	Anodyne	P2RY12	187	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@@H](O)c2ccccc2)CC1	ZINC000853685615	GD	On-Demand	Anodyne	P2RY12	187	41
Cn1cncc1CCONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685642	ED	On-Demand	Anodyne	DRD4	21	40
Cn1cncc1CCONC(=N)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685643	ED	On-Demand	Anodyne	DRD4	21	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(CO)cc(OC)cc2CO)CC1	ZINC000853685647	GC	On-Demand	Anodyne	P2RY12	43	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(CO)cc(OC)cc2CO)CC1	ZINC000853685648	GC	On-Demand	Anodyne	P2RY12	43	41
N=C(NOC[C@H]1COCCO1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685652	EC	On-Demand	Anodyne	DRD4	25	47
N=C(NOC[C@@H]1COCCO1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685653	EC	On-Demand	Anodyne	DRD4	25	47
N=C(NOC[C@H]1COCCO1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685654	EC	On-Demand	Anodyne	DRD4	25	47
N=C(NOC[C@@H]1COCCO1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685655	EC	On-Demand	Anodyne	DRD4	25	47
O=C1CCC2=C(CCN(C(=O)NCc3ccc(CN4CCC(O)CC4)cc3)C2)N1	ZINC000853685704	GD	On-Demand	Anodyne	NAMPT	18	40
CN1CCC(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1	ZINC000853685722	FD	On-Demand	Clean	CACNA1I	58	41
COC(=O)c1nn(Cc2ccc(OC)cc2)c(C)c1Cl	ZINC000853685729	CF	On-Demand	Anodyne	PTGS2	17	42
COC(=O)c1nn(Cc2ccc(OC)cc2)c(C)c1Cl	ZINC000853685729	CF	On-Demand	Anodyne	PROKR1	67	36
COC(=O)c1nn(Cc2ccc(OC)cc2)c(C)c1Cl	ZINC000853685729	CF	On-Demand	Anodyne	NPBWR1	39	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C)n2)CC1	ZINC000853685736	DD	On-Demand	Anodyne	P2RY12	155	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C)n2)CC1	ZINC000853685737	DD	On-Demand	Anodyne	P2RY12	155	40
C#CCOCCONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685766	DD	On-Demand	Mild	DRD4	19	41
C#CCOCCONC(=N)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685767	DD	On-Demand	Mild	DRD4	19	41
N#CCC1(CONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685781	EE	On-Demand	Mild	DRD4	15	41
N#CCC1(CONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)CC1	ZINC000853685782	EE	On-Demand	Mild	DRD4	15	41
c1ccc2c(NC[C@@H]3COCO3)ncnc2c1	ZINC000853685826	BD	On-Demand	Anodyne	DYRK1A	18	43
c1ccc2c(NC[C@@H]3COCO3)ncnc2c1	ZINC000853685826	BD	On-Demand	Anodyne	CLK1	17	43
c1ccc2c(NC[C@@H]3COCO3)ncnc2c1	ZINC000853685826	BD	On-Demand	Anodyne	CLK2	21	40
c1ccc2c(NC[C@@H]3COCO3)ncnc2c1	ZINC000853685826	BD	On-Demand	Anodyne	TNK2	46	35
c1ccc2c(NC[C@@H]3COCO3)ncnc2c1	ZINC000853685826	BD	On-Demand	Anodyne	CLK4	50	43
c1ccc2c(NC[C@@H]3COCO3)ncnc2c1	ZINC000853685826	BD	On-Demand	Anodyne	DYRK1B	17	43
c1ccc2c(NC[C@H]3COCO3)ncnc2c1	ZINC000853685827	BD	On-Demand	Anodyne	DYRK1A	18	43
c1ccc2c(NC[C@H]3COCO3)ncnc2c1	ZINC000853685827	BD	On-Demand	Anodyne	CLK1	17	43
c1ccc2c(NC[C@H]3COCO3)ncnc2c1	ZINC000853685827	BD	On-Demand	Anodyne	CLK2	21	40
c1ccc2c(NC[C@H]3COCO3)ncnc2c1	ZINC000853685827	BD	On-Demand	Anodyne	TNK2	46	35
c1ccc2c(NC[C@H]3COCO3)ncnc2c1	ZINC000853685827	BD	On-Demand	Anodyne	CLK4	50	43
c1ccc2c(NC[C@H]3COCO3)ncnc2c1	ZINC000853685827	BD	On-Demand	Anodyne	DYRK1B	17	43
N=C(NOCc1csc(Cl)n1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685905	FF	On-Demand	Anodyne	DRD4	27	42
N=C(NOCc1csc(Cl)n1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685906	FF	On-Demand	Anodyne	DRD4	27	42
CN1CCC(CNC(=O)NCc2ccc(N3CCCNC3=O)cc2)CC1	ZINC000853685912	FD	On-Demand	Anodyne	CACNA1I	48	37
N=C(NOCc1cc(C2CC2)no1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853685935	FE	On-Demand	Anodyne	DRD4	31	41
N=C(NOCc1cc(C2CC2)no1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853685936	FE	On-Demand	Anodyne	DRD4	31	41
CO[C@@H](CONC(=N)[C@H]1CN(Cc2ccccc2)CCO1)C1CCCC1	ZINC000853685986	FF	On-Demand	Anodyne	DRD4	29	41
CO[C@@H](CONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1)C1CCCC1	ZINC000853685987	FF	On-Demand	Anodyne	DRD4	29	41
CN1CCO[C@@H](CNC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853685990	FD	On-Demand	Reactive	CSNK1D	29	40
CN1CCO[C@H](CNC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853685991	FD	On-Demand	Reactive	CSNK1D	29	40
Cn1cnc2c(NC[C@@H]3COCO3)ncnc21	ZINC000853686055	BC	On-Demand	Anodyne	ADORA1	23	50
Cn1cnc2c(NC[C@H]3COCO3)ncnc21	ZINC000853686056	BC	On-Demand	Anodyne	ADORA1	23	50
c1nc(NC[C@@H]2COCO2)c2c3c(sc2n1)CCC3	ZINC000853686063	CD	On-Demand	Anodyne	TNK2	50	34
c1nc(NC[C@H]2COCO2)c2c3c(sc2n1)CCC3	ZINC000853686064	CD	On-Demand	Anodyne	TNK2	50	34
Cc1nc(NC[C@@H]2COCO2)c2c3c(sc2n1)CCC3	ZINC000853686087	CE	On-Demand	Anodyne	CEL	19	40
Cc1nc(NC[C@H]2COCO2)c2c3c(sc2n1)CCC3	ZINC000853686089	CE	On-Demand	Anodyne	CEL	19	40
CC1(C)C[C@@H](ONC(=N)[C@@H]2CN(Cc3ccccc3)CCO2)CO1	ZINC000853686094	ED	On-Demand	Anodyne	DRD4	20	41
CC1(C)C[C@@H](ONC(=N)[C@H]2CN(Cc3ccccc3)CCO2)CO1	ZINC000853686098	ED	On-Demand	Anodyne	DRD4	20	41
N=C(NOCCOCc1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686108	FF	On-Demand	Anodyne	DRD4	26	45
N=C(NOCCOCc1ccccc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686108	FF	On-Demand	Anodyne	SIGMAR1	33	42
N=C(NOCCOCc1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686109	FF	On-Demand	Anodyne	DRD4	26	45
N=C(NOCCOCc1ccccc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686109	FF	On-Demand	Anodyne	SIGMAR1	33	42
CN1CCC(CNC(=O)N[C@@H]2C=CCC2)CC1	ZINC000853686112	BD	On-Demand	Anodyne	CACNA1I	54	35
CN1CCC(CNC(=O)N[C@H]2C=CCC2)CC1	ZINC000853686113	BD	On-Demand	Anodyne	CACNA1I	54	35
CO[C@@H](CONC(=N)[C@H]1CN(Cc2ccccc2)CCO1)C1CCC1	ZINC000853686130	EE	On-Demand	Anodyne	DRD4	29	41
CO[C@@H](CONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1)C1CCC1	ZINC000853686132	EE	On-Demand	Anodyne	DRD4	29	41
C#CCCN(CCOC)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000853686151	FD	On-Demand	Mild	SIGMAR1	19	42
CCn1ncnc1CONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686154	ED	On-Demand	Anodyne	DRD4	16	40
CCn1ncnc1CONC(=N)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686155	ED	On-Demand	Anodyne	DRD4	16	40
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	CHRM2	15	43
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	CHRM1	15	43
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	DRD2	18	46
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	DRD4	40	46
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	ACHE	39	45
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	CHRM3	20	43
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	SIGMAR1	46	49
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	SSTR5	50	35
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	MCHR1	43	45
C[C@@H](ON=C1CCCOCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853686179	FF	On-Demand	Mild	CACNA1G	15	40
CON(C)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000853686183	FC	On-Demand	Anodyne	ACHE	21	40
CON(C)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000853686183	FC	On-Demand	Anodyne	SIGMAR1	27	44
CON(C)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000853686183	FC	On-Demand	Anodyne	CCR3	19	40
CON(C)CCNC(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000853686183	FC	On-Demand	Anodyne	MCHR1	37	45
c1ccc(-n2ncc3c(NC[C@@H]4COCO4)ncnc32)cc1	ZINC000853686200	CD	On-Demand	Anodyne	TNK2	47	34
c1ccc(-n2ncc3c(NC[C@H]4COCO4)ncnc32)cc1	ZINC000853686202	CD	On-Demand	Anodyne	TNK2	47	34
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853686229	GF	On-Demand	Anodyne	DRD4	38	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853686229	GF	On-Demand	Anodyne	ACHE	24	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853686229	GF	On-Demand	Anodyne	SIGMAR1	42	49
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853686229	GF	On-Demand	Anodyne	MCHR1	28	48
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853686229	GF	On-Demand	Anodyne	MCHR2	42	36
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853686231	GF	On-Demand	Anodyne	DRD4	38	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853686231	GF	On-Demand	Anodyne	ACHE	24	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853686231	GF	On-Demand	Anodyne	SIGMAR1	42	49
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853686231	GF	On-Demand	Anodyne	MCHR1	28	48
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853686231	GF	On-Demand	Anodyne	MCHR2	42	36
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853686232	GF	On-Demand	Anodyne	DRD4	38	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853686232	GF	On-Demand	Anodyne	ACHE	24	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853686232	GF	On-Demand	Anodyne	SIGMAR1	42	49
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853686232	GF	On-Demand	Anodyne	MCHR1	28	48
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853686232	GF	On-Demand	Anodyne	MCHR2	42	36
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853686233	GF	On-Demand	Anodyne	DRD4	38	43
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853686233	GF	On-Demand	Anodyne	ACHE	24	40
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853686233	GF	On-Demand	Anodyne	SIGMAR1	42	49
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853686233	GF	On-Demand	Anodyne	MCHR1	28	48
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853686233	GF	On-Demand	Anodyne	MCHR2	42	36
C=C(Cl)CONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686239	DE	On-Demand	Mild	DRD4	26	45
C=C(Cl)CONC(=N)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686240	DE	On-Demand	Mild	DRD4	26	45
Cc1nc(NC[C@@H]2COCO2)cc(-c2cccnc2)n1	ZINC000853686272	CD	On-Demand	Anodyne	CYP2E1	44	31
Cc1nc(NC[C@@H]2COCO2)cc(-c2cccnc2)n1	ZINC000853686272	CD	On-Demand	Anodyne	ROS1	60	35
Cc1nc(NC[C@H]2COCO2)cc(-c2cccnc2)n1	ZINC000853686274	CD	On-Demand	Anodyne	CYP2E1	44	31
Cc1nc(NC[C@H]2COCO2)cc(-c2cccnc2)n1	ZINC000853686274	CD	On-Demand	Anodyne	ROS1	60	35
COC[C@@H](CONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1)OC	ZINC000853686297	ED	On-Demand	Anodyne	DRD4	27	43
COC[C@@H](CONC(=N)[C@H]1CN(Cc2ccccc2)CCO1)OC	ZINC000853686301	ED	On-Demand	Anodyne	DRD4	27	43
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc([C@H](C)O)n2)CC1	ZINC000853686314	FE	On-Demand	Anodyne	DRD4	18	51
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc([C@H](C)O)n2)CC1	ZINC000853686314	FE	On-Demand	Anodyne	SIGMAR1	19	49
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc([C@@H](C)O)n2)CC1	ZINC000853686316	FE	On-Demand	Anodyne	DRD4	18	51
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc([C@@H](C)O)n2)CC1	ZINC000853686316	FE	On-Demand	Anodyne	SIGMAR1	19	49
N=C(NOCC1CC=CC1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686325	DE	On-Demand	Anodyne	DRD4	26	44
N=C(NOCC1CC=CC1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686341	DE	On-Demand	Anodyne	DRD4	26	44
N=C(NOCCOC(F)F)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686342	ED	On-Demand	Anodyne	DRD4	20	43
N=C(NOCCOC(F)F)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686343	ED	On-Demand	Anodyne	DRD4	20	43
CN1CCO[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853686344	DD	On-Demand	Reactive	CACNA1I	56	34
CN1CCO[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853686345	DD	On-Demand	Reactive	CACNA1I	56	34
Cc1nonc1CONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686360	ED	On-Demand	Anodyne	DRD4	21	41
Cc1nonc1CONC(=N)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686361	ED	On-Demand	Anodyne	DRD4	21	41
Cc1nocc1CONC(=N)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853686439	ED	On-Demand	Anodyne	DRD4	23	40
Cc1nocc1CONC(=N)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853686440	ED	On-Demand	Anodyne	DRD4	23	40
Brc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686466	DE	On-Demand	Anodyne	EGFR	58	38
Brc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686466	DE	On-Demand	Anodyne	DYRK1A	20	48
Brc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686466	DE	On-Demand	Anodyne	CLK1	21	48
Brc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686466	DE	On-Demand	Anodyne	CLK2	24	45
Brc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686466	DE	On-Demand	Anodyne	CLK4	67	48
Brc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686466	DE	On-Demand	Anodyne	DYRK1B	19	48
Brc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686467	DE	On-Demand	Anodyne	EGFR	58	38
Brc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686467	DE	On-Demand	Anodyne	DYRK1A	20	48
Brc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686467	DE	On-Demand	Anodyne	CLK1	21	48
Brc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686467	DE	On-Demand	Anodyne	CLK2	24	45
Brc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686467	DE	On-Demand	Anodyne	CLK4	67	48
Brc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686467	DE	On-Demand	Anodyne	DYRK1B	19	48
Fc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686484	BD	On-Demand	Anodyne	DYRK1A	21	47
Fc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686484	BD	On-Demand	Anodyne	CLK1	20	47
Fc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686484	BD	On-Demand	Anodyne	CLK2	24	44
Fc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686484	BD	On-Demand	Anodyne	CLK4	67	47
Fc1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686484	BD	On-Demand	Anodyne	DYRK1B	20	47
Fc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686485	BD	On-Demand	Anodyne	DYRK1A	21	47
Fc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686485	BD	On-Demand	Anodyne	CLK1	20	47
Fc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686485	BD	On-Demand	Anodyne	CLK2	24	44
Fc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686485	BD	On-Demand	Anodyne	CLK4	67	47
Fc1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686485	BD	On-Demand	Anodyne	DYRK1B	20	47
C#CCOCCON=C(C)c1ccc(OCC(=O)OC)cc1	ZINC000853686514	DD	On-Demand	Mild	PLA2G4B	40	33
Cc1ccc(OCc2cccc(C(C)(C)C)c2)c[n+]1[O-]	ZINC000853686559	CH	On-Demand	Anodyne	MAOB	29	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3ccnn3)c2)CC1	ZINC000853686562	FD	On-Demand	Anodyne	P2RY12	97	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3ccnn3)c2)CC1	ZINC000853686563	FD	On-Demand	Anodyne	P2RY12	97	38
Ic1cccc2ncnc(NC[C@@H]3COCO3)c12	ZINC000853686607	FE	On-Demand	Anodyne	TNK2	59	37
Ic1cccc2ncnc(NC[C@H]3COCO3)c12	ZINC000853686608	FE	On-Demand	Anodyne	TNK2	59	37
COc1ccc(-c2csc3ncnc(NC[C@@H]4COCO4)c23)cc1	ZINC000853686672	EG	On-Demand	Anodyne	TNK2	72	44
COc1ccc(-c2csc3ncnc(NC[C@H]4COCO4)c23)cc1	ZINC000853686673	EG	On-Demand	Anodyne	TNK2	72	44
Ic1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686690	FE	On-Demand	Anodyne	DYRK1A	20	47
Ic1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686690	FE	On-Demand	Anodyne	CLK1	20	47
Ic1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686690	FE	On-Demand	Anodyne	CLK2	24	44
Ic1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686690	FE	On-Demand	Anodyne	CLK4	66	47
Ic1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686690	FE	On-Demand	Anodyne	CD38	43	35
Ic1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853686690	FE	On-Demand	Anodyne	DYRK1B	19	47
Ic1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686691	FE	On-Demand	Anodyne	DYRK1A	20	47
Ic1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686691	FE	On-Demand	Anodyne	CLK1	20	47
Ic1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686691	FE	On-Demand	Anodyne	CLK2	24	44
Ic1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686691	FE	On-Demand	Anodyne	CLK4	66	47
Ic1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686691	FE	On-Demand	Anodyne	CD38	43	35
Ic1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853686691	FE	On-Demand	Anodyne	DYRK1B	19	47
N#Cc1cnc2c(Cl)cccc2c1NC[C@H]1COCO1	ZINC000853686718	CF	On-Demand	Mild	MAP3K8	94	36
N#Cc1cnc2c(Cl)cccc2c1NC[C@@H]1COCO1	ZINC000853686719	CF	On-Demand	Mild	MAP3K8	94	36
O=C(NCC1(N2CCCC2)CCOCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853686777	FE	On-Demand	Anodyne	HCN1	61	40
O=C(NCC1(N2CCCC2)CCOCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853686777	FE	On-Demand	Anodyne	HCN4	52	33
O=C(NCC1(N2CCCC2)CCOCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853686780	FE	On-Demand	Anodyne	HCN1	61	40
O=C(NCC1(N2CCCC2)CCOCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853686780	FE	On-Demand	Anodyne	HCN4	52	33
O=C(NCC1(N2CCCC2)CCOCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853686783	FE	On-Demand	Anodyne	HCN1	61	40
O=C(NCC1(N2CCCC2)CCOCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853686783	FE	On-Demand	Anodyne	HCN4	52	33
O=C(NCC1(N2CCCC2)CCOCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853686785	FE	On-Demand	Anodyne	HCN1	61	40
O=C(NCC1(N2CCCC2)CCOCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853686785	FE	On-Demand	Anodyne	HCN4	52	33
c1ccc(-n2cnc3c(NC[C@@H]4COCO4)ncnc32)cc1	ZINC000853686822	CD	On-Demand	Anodyne	TNK2	51	35
c1ccc(-n2cnc3c(NC[C@H]4COCO4)ncnc32)cc1	ZINC000853686823	CD	On-Demand	Anodyne	TNK2	51	35
CN(CCNC(=O)NNc1ccc([N+](=O)[O-])cc1F)C1CCCC1	ZINC000853686948	EE	On-Demand	Reactive	TBXA2R	17	41
CN(CCNC(=O)NNc1ccc([N+](=O)[O-])cc1F)C1CCCC1	ZINC000853686948	EE	On-Demand	Reactive	SLC27A4	43	33
C#CCCN(CCOC)C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000853686997	ED	On-Demand	Mild	HCN1	52	37
C#CCCN(CCOC)C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000853686997	ED	On-Demand	Mild	HCN4	46	30
Cc1noc(C)c1COc1ccccc1C(=O)OCC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853687015	JG	On-Demand	Anodyne	BDKRB2	16	40
COc1ccc(-c2nnc(NC[C@H]3COCO3)c3ccccc23)cc1	ZINC000853687034	EG	On-Demand	Anodyne	TNK2	25	40
COc1ccc(-c2nnc(NC[C@@H]3COCO3)c3ccccc23)cc1	ZINC000853687035	EG	On-Demand	Anodyne	TNK2	25	40
CCn1c(=O)c(NC[C@H]2COCO2)nc2ccccc21	ZINC000853687159	CD	On-Demand	Anodyne	PYGM	19	42
CCn1c(=O)c(NC[C@@H]2COCO2)nc2ccccc21	ZINC000853687160	CD	On-Demand	Anodyne	PYGM	19	42
c1ccc(-c2cc3c(NC[C@@H]4COCO4)ncnc3s2)cc1	ZINC000853687164	DG	On-Demand	Anodyne	TNK2	65	36
c1ccc(-c2cc3c(NC[C@H]4COCO4)ncnc3s2)cc1	ZINC000853687166	DG	On-Demand	Anodyne	TNK2	65	36
Nc1nc(NC[C@@H]2COCO2)ncc1[N+](=O)[O-]	ZINC000853687184	BB	On-Demand	Bother	PRKCQ	29	40
Nc1nc(NC[C@H]2COCO2)ncc1[N+](=O)[O-]	ZINC000853687191	BB	On-Demand	Bother	PRKCQ	29	40
c1nc(NC[C@@H]2COCO2)c2ncn(C3CC3)c2n1	ZINC000853687195	CC	On-Demand	Anodyne	ADORA1	57	47
c1nc(NC[C@@H]2COCO2)c2ncn(C3CC3)c2n1	ZINC000853687195	CC	On-Demand	Anodyne	ADORA3	53	40
c1nc(NC[C@@H]2COCO2)c2ncn(C3CC3)c2n1	ZINC000853687195	CC	On-Demand	Anodyne	Q4VQ11_PIG	43	40
c1nc(NC[C@H]2COCO2)c2ncn(C3CC3)c2n1	ZINC000853687197	CC	On-Demand	Anodyne	ADORA1	57	47
c1nc(NC[C@H]2COCO2)c2ncn(C3CC3)c2n1	ZINC000853687197	CC	On-Demand	Anodyne	ADORA3	53	40
c1nc(NC[C@H]2COCO2)c2ncn(C3CC3)c2n1	ZINC000853687197	CC	On-Demand	Anodyne	Q4VQ11_PIG	43	40
c1nc(NC[C@@H]2COCO2)c2c3c(sc2n1)CCCC3	ZINC000853687211	CE	On-Demand	Anodyne	TNK2	50	34
c1nc(NC[C@H]2COCO2)c2c3c(sc2n1)CCCC3	ZINC000853687213	CE	On-Demand	Anodyne	TNK2	50	34
CS(=O)(=O)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687225	DC	On-Demand	Anodyne	DYRK1A	19	43
CS(=O)(=O)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687225	DC	On-Demand	Anodyne	CLK1	19	43
CS(=O)(=O)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687225	DC	On-Demand	Anodyne	CLK2	22	41
CS(=O)(=O)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687225	DC	On-Demand	Anodyne	CLK4	64	43
CS(=O)(=O)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687225	DC	On-Demand	Anodyne	DYRK1B	18	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3nc(C)ccc23)CC1	ZINC000853687229	FF	On-Demand	Anodyne	HTR1D	59	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3nc(C)ccc23)CC1	ZINC000853687229	FF	On-Demand	Anodyne	HTR1B	46	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3nc(C)ccc23)CC1	ZINC000853687229	FF	On-Demand	Anodyne	P2RY12	150	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3nc(C)ccc23)CC1	ZINC000853687230	FF	On-Demand	Anodyne	HTR1D	59	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3nc(C)ccc23)CC1	ZINC000853687230	FF	On-Demand	Anodyne	HTR1B	46	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3nc(C)ccc23)CC1	ZINC000853687230	FF	On-Demand	Anodyne	P2RY12	150	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3c2OCCO3)CC1	ZINC000853687258	FD	On-Demand	Anodyne	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3c2OCCO3)CC1	ZINC000853687258	FD	On-Demand	Anodyne	NR5A1	25	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3c2OCCO3)CC1	ZINC000853687259	FD	On-Demand	Anodyne	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3c2OCCO3)CC1	ZINC000853687259	FD	On-Demand	Anodyne	NR5A1	25	41
COC(=O)c1cccc(NNC(=O)NCC2(N3CCCC3)CCOCC2)c1C	ZINC000853687260	GE	On-Demand	Reactive	HCN1	85	44
COC(=O)c1cccc(NNC(=O)NCC2(N3CCCC3)CCOCC2)c1C	ZINC000853687260	GE	On-Demand	Reactive	HCN4	58	39
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C)[n+]([O-])c2)CC1	ZINC000853687261	FE	On-Demand	Anodyne	DRD4	21	52
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C)[n+]([O-])c2)CC1	ZINC000853687261	FE	On-Demand	Anodyne	LTA4H	15	40
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C)[n+]([O-])c2)CC1	ZINC000853687261	FE	On-Demand	Anodyne	SIGMAR1	18	47
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C)[n+]([O-])c2)CC1	ZINC000853687261	FE	On-Demand	Anodyne	CCR3	17	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C)[n+]([O-])c2)CC1	ZINC000853687261	FE	On-Demand	Anodyne	MCHR1	24	45
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(C)[n+]([O-])c2)CC1	ZINC000853687261	FE	On-Demand	Anodyne	CCR8	22	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(-n3ccnn3)c2)C1	ZINC000853687280	FE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(-n3ccnn3)c2)C1	ZINC000853687282	FE	On-Demand	Anodyne	GPR119	26	41
Cc1ccc(NC(=O)c2ccc(NC[C@H]3COCO3)c([N+](=O)[O-])c2)cc1	ZINC000853687295	FF	On-Demand	Bother	TAAR1	21	46
Cc1ccc(NC(=O)c2ccc(NC[C@@H]3COCO3)c([N+](=O)[O-])c2)cc1	ZINC000853687297	FF	On-Demand	Bother	TAAR1	21	46
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	CHRM2	21	44
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	CHRM1	20	44
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	DRD2	30	50
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	DRD4	60	48
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	ACHE	45	46
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	DRD3	18	50
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	KCNH2	17	44
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	HTR4	25	46
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	CHRM3	33	44
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	LTA4H	25	42
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	SIGMAR1	54	55
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	SSTR5	54	36
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	CCR3	34	42
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	MCHR1	53	49
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	CACNA1G	33	41
C[C@@H](ONC(=N)CCO)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853687307	ED	On-Demand	Anodyne	CCR8	17	43
Fc1cccc2ncnc(NC[C@@H]3COCO3)c12	ZINC000853687329	BD	On-Demand	Anodyne	TNK2	51	35
Fc1cccc2ncnc(NC[C@H]3COCO3)c12	ZINC000853687331	BD	On-Demand	Anodyne	TNK2	51	35
C[C@@H]([C@@H](C)NC(=O)NNc1nc2ccc(Cl)cc2s1)N1CCOCC1	ZINC000853687375	GF	On-Demand	Reactive	CASR	16	48
C[C@@H]([C@@H](C)NC(=O)NNc1nc2ccc(Cl)cc2s1)N1CCOCC1	ZINC000853687375	GF	On-Demand	Reactive	CSNK1D	30	41
CON(C)CCNC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000853687387	DC	On-Demand	Anodyne	HCN1	67	42
CON(C)CCNC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000853687387	DC	On-Demand	Anodyne	HCN4	53	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc([C@H](C)O)n2)CC1	ZINC000853687414	DC	On-Demand	Anodyne	P2RY12	59	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc([C@@H](C)O)n2)CC1	ZINC000853687416	DC	On-Demand	Anodyne	P2RY12	59	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc([C@H](C)O)n2)CC1	ZINC000853687418	DC	On-Demand	Anodyne	P2RY12	59	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc([C@@H](C)O)n2)CC1	ZINC000853687420	DC	On-Demand	Anodyne	P2RY12	59	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncc3c2C[C@H](O)CC3)CC1	ZINC000853687469	FC	On-Demand	Anodyne	P2RY12	56	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncc3c2C[C@@H](O)CC3)CC1	ZINC000853687470	FC	On-Demand	Anodyne	P2RY12	56	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncc3c2C[C@@H](O)CC3)CC1	ZINC000853687471	FC	On-Demand	Anodyne	P2RY12	56	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncc3c2C[C@H](O)CC3)CC1	ZINC000853687472	FC	On-Demand	Anodyne	P2RY12	56	38
O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687492	CD	On-Demand	Bother	DYRK1A	20	45
O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687492	CD	On-Demand	Bother	CLK1	20	45
O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687492	CD	On-Demand	Bother	CLK2	23	43
O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687492	CD	On-Demand	Bother	CLK4	62	45
O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687492	CD	On-Demand	Bother	DYRK1B	19	45
O=[N+]([O-])c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687494	CD	On-Demand	Bother	DYRK1A	20	45
O=[N+]([O-])c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687494	CD	On-Demand	Bother	CLK1	20	45
O=[N+]([O-])c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687494	CD	On-Demand	Bother	CLK2	23	43
O=[N+]([O-])c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687494	CD	On-Demand	Bother	CLK4	62	45
O=[N+]([O-])c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687494	CD	On-Demand	Bother	DYRK1B	19	45
Cc1ccc(OC[C@@H]2CCCCN2C(C)C)c[n+]1[O-]	ZINC000853687555	CE	On-Demand	Anodyne	CHRNA10	67	40
O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1COCO1	ZINC000853687562	CD	On-Demand	Bother	PRKCQ	26	40
Cc1ccc(OC[C@H]2CCCCN2C(C)C)c[n+]1[O-]	ZINC000853687563	CE	On-Demand	Anodyne	CHRNA10	67	40
O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1COCO1	ZINC000853687564	CD	On-Demand	Bother	PRKCQ	26	40
Cc1ccc(-c2csc3ncnc(NC[C@@H]4COCO4)c23)cc1	ZINC000853687603	EG	On-Demand	Anodyne	TNK2	66	33
Cc1ccc(-c2csc3ncnc(NC[C@H]4COCO4)c23)cc1	ZINC000853687604	EG	On-Demand	Anodyne	TNK2	66	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(=O)c3cc(OC)ccc32)CC1	ZINC000853687610	GD	On-Demand	Anodyne	P2RY12	60	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(=O)c3cc(OC)ccc32)CC1	ZINC000853687612	GD	On-Demand	Anodyne	P2RY12	60	39
C#CCOCCOc1cccc2nc(C)ccc12	ZINC000853687639	BF	On-Demand	Mild	HTR1D	24	50
C#CCOCCOc1cccc2nc(C)ccc12	ZINC000853687639	BF	On-Demand	Mild	HTR1B	22	50
CC(C)c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687641	CF	On-Demand	Anodyne	DYRK1A	20	45
CC(C)c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687641	CF	On-Demand	Anodyne	CLK1	20	45
CC(C)c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687641	CF	On-Demand	Anodyne	CLK2	23	43
CC(C)c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687641	CF	On-Demand	Anodyne	CLK4	66	45
CC(C)c1ccc2ncnc(NC[C@@H]3COCO3)c2c1	ZINC000853687641	CF	On-Demand	Anodyne	DYRK1B	19	45
CC(C)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687642	CF	On-Demand	Anodyne	DYRK1A	20	45
CC(C)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687642	CF	On-Demand	Anodyne	CLK1	20	45
CC(C)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687642	CF	On-Demand	Anodyne	CLK2	23	43
CC(C)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687642	CF	On-Demand	Anodyne	CLK4	66	45
CC(C)c1ccc2ncnc(NC[C@H]3COCO3)c2c1	ZINC000853687642	CF	On-Demand	Anodyne	DYRK1B	19	45
O=C(NCC1(N2CCCC2)CCOCC1)NNc1cccc2c1OC(F)(F)O2	ZINC000853687669	GE	On-Demand	Reactive	HCN1	56	37
O=C(NCC1(N2CCCC2)CCOCC1)NNc1cccc2c1OC(F)(F)O2	ZINC000853687669	GE	On-Demand	Reactive	HCN4	47	30
c1ccc(-c2cncnc2NC[C@@H]2COCO2)cc1	ZINC000853687698	CD	On-Demand	Anodyne	TNK2	62	38
c1ccc(-c2cncnc2NC[C@H]2COCO2)cc1	ZINC000853687700	CD	On-Demand	Anodyne	TNK2	62	38
COc1cccc(SCCONC(=N)CCO)c1	ZINC000853687789	CD	On-Demand	Anodyne	MTNR1A	17	51
COc1cccc(SCCONC(=N)CCO)c1	ZINC000853687789	CD	On-Demand	Anodyne	MTNR1B	19	51
O=[N+]([O-])c1cccc2ncnc(NC[C@@H]3COCO3)c12	ZINC000853687797	CD	On-Demand	Bother	TNK2	47	34
O=[N+]([O-])c1cccc2ncnc(NC[C@H]3COCO3)c12	ZINC000853687798	CD	On-Demand	Bother	TNK2	47	34
O=[N+]([O-])c1c[nH]c2ccccc2c1=NC[C@@H]1COCO1	ZINC000853687808	CD	On-Demand	Bother	NMBR	41	31
O=[N+]([O-])c1c[nH]c2ccccc2c1=NC[C@H]1COCO1	ZINC000853687809	CD	On-Demand	Bother	NMBR	41	31
Cc1nonc1COc1ccccc1C(=O)OC(C)(C)C	ZINC000853687872	CF	On-Demand	Anodyne	CACNA1D	17	50
Cn1c(S)nnc1CCNC(=O)NCC1(N2CCCC2)CCOCC1	ZINC000853687886	FC	On-Demand	Anodyne	HCN1	44	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(F)c2C(N)=O)CC1	ZINC000853687904	FC	On-Demand	Anodyne	P2RY12	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(F)c2C(N)=O)CC1	ZINC000853687905	FC	On-Demand	Anodyne	P2RY12	43	37
Cc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c[n+]1[O-]	ZINC000853687929	DE	On-Demand	Anodyne	SLC18A3	15	42
Cc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c[n+]1[O-]	ZINC000853687930	DE	On-Demand	Anodyne	SLC18A3	15	42
CCCOc1cccc(COc2ccc(C)[n+]([O-])c2)c1	ZINC000853687950	CF	On-Demand	Anodyne	MAOB	41	39
CCCOc1cccc(COc2ccc(C)[n+]([O-])c2)c1	ZINC000853687950	CF	On-Demand	Anodyne	FFAR1	29	40
c1ccc(-c2cn3nc(N4CCC(N5CCCOCC5)CC4)sc3n2)cc1	ZINC000853687971	GG	On-Demand	Anodyne	HRH3	20	45
O=[N+]([O-])c1cc(Cl)c(N2CCC(N3CCCOCC3)CC2)c(Cl)c1	ZINC000853687978	FH	On-Demand	Bother	L3MBTL3	41	39
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853687981	JI	On-Demand	Anodyne	KIT	24	42
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853687981	JI	On-Demand	Anodyne	BRAF	21	42
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853687982	JI	On-Demand	Anodyne	KIT	24	42
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853687982	JI	On-Demand	Anodyne	BRAF	21	42
C#CCNC(=O)c1ccc(N2CCC(N3CCCOCC3)CC2)nc1	ZINC000853687983	ED	On-Demand	Mild	HPGDS	25	46
C#CCNC(=O)c1ccc(N2CCC(N3CCCOCC3)CC2)nc1	ZINC000853687983	ED	On-Demand	Mild	L3MBTL3	109	39
CC(=O)c1ccc(N2CCC(N3CCCOCC3)CC2)c(S(N)(=O)=O)c1	ZINC000853687990	GD	On-Demand	Anodyne	L3MBTL3	103	39
Nc1nc(Cl)cc(N2CCC(N3CCCOCC3)CC2)n1	ZINC000853687991	DD	On-Demand	Anodyne	HRH4	40	36
FC(F)(F)c1ccc(N2CCC(N3CCCOCC3)CC2)nc1Cl	ZINC000853687998	FG	On-Demand	Anodyne	L3MBTL3	34	40
O=[N+]([O-])c1c(F)cccc1N1CCC(N2CCCOCC2)CC1	ZINC000853687999	DE	On-Demand	Bother	L3MBTL3	58	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(N2CCCOCC2)CC1	ZINC000853688000	FD	On-Demand	Bother	WDR5	34	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(N2CCCOCC2)CC1	ZINC000853688000	FD	On-Demand	Bother	L3MBTL3	58	37
O=[N+]([O-])c1cc(F)c(N2CCC(N3CCCOCC3)CC2)c(F)c1	ZINC000853688026	EF	On-Demand	Bother	L3MBTL3	42	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cccnc1N	ZINC000853688031	EE	On-Demand	Anodyne	PREP	40	36
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cccnc1N	ZINC000853688031	EE	On-Demand	Anodyne	LGMN	59	34
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cccnc1N	ZINC000853688031	EE	On-Demand	Anodyne	SFRP1	31	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cccnc1N	ZINC000853688031	EE	On-Demand	Anodyne	WNT3	52	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cccnc1N	ZINC000853688032	EE	On-Demand	Anodyne	PREP	40	36
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cccnc1N	ZINC000853688032	EE	On-Demand	Anodyne	LGMN	59	34
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cccnc1N	ZINC000853688032	EE	On-Demand	Anodyne	SFRP1	31	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cccnc1N	ZINC000853688032	EE	On-Demand	Anodyne	WNT3	52	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688034	GF	On-Demand	Anodyne	PREP	52	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688034	GF	On-Demand	Anodyne	LGMN	43	35
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688034	GF	On-Demand	Anodyne	SFRP1	37	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688034	GF	On-Demand	Anodyne	WNT3	53	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688035	GF	On-Demand	Anodyne	PREP	52	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688035	GF	On-Demand	Anodyne	LGMN	43	35
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688035	GF	On-Demand	Anodyne	SFRP1	37	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1ncnn1-c1ccccc1	ZINC000853688035	GF	On-Demand	Anodyne	WNT3	53	40
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688065	JH	On-Demand	Anodyne	DRD4	32	43
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688065	JH	On-Demand	Anodyne	SIGMAR1	18	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688065	JH	On-Demand	Anodyne	SSTR5	40	35
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688065	JH	On-Demand	Anodyne	BIRC2	25	40
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688066	JH	On-Demand	Anodyne	DRD4	32	43
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688066	JH	On-Demand	Anodyne	SIGMAR1	18	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688066	JH	On-Demand	Anodyne	SSTR5	40	35
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688066	JH	On-Demand	Anodyne	BIRC2	25	40
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688067	JH	On-Demand	Anodyne	DRD4	32	43
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688067	JH	On-Demand	Anodyne	SIGMAR1	18	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688067	JH	On-Demand	Anodyne	SSTR5	40	35
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853688067	JH	On-Demand	Anodyne	BIRC2	25	40
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688068	JH	On-Demand	Anodyne	DRD4	32	43
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688068	JH	On-Demand	Anodyne	SIGMAR1	18	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688068	JH	On-Demand	Anodyne	SSTR5	40	35
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853688068	JH	On-Demand	Anodyne	BIRC2	25	40
NC(=O)c1cc(N2CCC(N3CCCOCC3)CC2)ccn1	ZINC000853688071	DC	On-Demand	Anodyne	HRH3	22	40
NC(=O)c1cc(N2CCC(N3CCCOCC3)CC2)ccn1	ZINC000853688071	DC	On-Demand	Anodyne	STAT6	56	34
NC(=O)c1cc(N2CCC(N3CCCOCC3)CC2)ccn1	ZINC000853688071	DC	On-Demand	Anodyne	L3MBTL3	109	45
CC[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1nc(C)cs1	ZINC000853688089	GI	On-Demand	Reactive	LCK	20	42
Cc1nonc1CONC(=N)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688115	ED	On-Demand	Anodyne	PREP	19	47
Cc1nonc1CONC(=N)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688116	ED	On-Demand	Anodyne	PREP	19	47
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688119	FF	On-Demand	Mild	FKBP1A	47	38
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688119	FF	On-Demand	Mild	CACNA1B	15	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688119	FF	On-Demand	Mild	DPP4	22	44
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688119	FF	On-Demand	Mild	PREP	43	36
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688119	FF	On-Demand	Mild	LGMN	76	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688120	FF	On-Demand	Mild	FKBP1A	47	38
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688120	FF	On-Demand	Mild	CACNA1B	15	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688120	FF	On-Demand	Mild	DPP4	22	44
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688120	FF	On-Demand	Mild	PREP	43	36
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853688120	FF	On-Demand	Mild	LGMN	76	40
CCCOc1cccc(CONC(=N)CN2CCSCC2)c1	ZINC000853688121	DF	On-Demand	Anodyne	HRH2	29	41
O=S(=O)(c1ccc(N2CCC(N3CCCOCC3)CC2)cc1)C(F)(F)F	ZINC000853688124	GF	On-Demand	Anodyne	L3MBTL3	97	50
C#Cc1cnc(N2CCC(N3CCCOCC3)CC2)nc1	ZINC000853688141	CD	On-Demand	Mild	HRH3	15	40
C#Cc1cnc(N2CCC(N3CCCOCC3)CC2)nc1	ZINC000853688141	CD	On-Demand	Mild	L3MBTL3	52	46
c1nc2c(c(N3CCC(N4CCCOCC4)CC3)n1)CCC2	ZINC000853688154	DD	On-Demand	Anodyne	L3MBTL3	40	42
Fc1cnc(N2CCC(N3CCCOCC3)CC2)cn1	ZINC000853688161	CD	On-Demand	Anodyne	L3MBTL3	42	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCC1CC=CC1	ZINC000853688170	DF	On-Demand	Anodyne	PREP	19	50
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCC1CC=CC1	ZINC000853688171	DF	On-Demand	Anodyne	PREP	19	50
O=[N+]([O-])c1ccc(N2CCC(N3CCCOCC3)CC2)c(Br)c1	ZINC000853688176	GG	On-Demand	Bother	L3MBTL3	54	39
O=S(=O)(c1ccc(N2CCC(N3CCCOCC3)CC2)cc1)C(F)F	ZINC000853688195	FE	On-Demand	Anodyne	L3MBTL3	76	50
Cc1ccc(N2CCC(N3CCCOCC3)CC2)c([N+](=O)[O-])c1	ZINC000853688204	DF	On-Demand	Bother	L3MBTL3	52	39
O=S1(=O)N=C(Cl)c2ccc(N3CCC(N4CCCOCC4)CC3)cc21	ZINC000853688219	GE	On-Demand	Anodyne	L3MBTL3	41	44
N#Cc1cc(S(N)(=O)=O)ccc1N1CCC(N2CCCOCC2)CC1	ZINC000853688251	FC	On-Demand	Mild	L3MBTL3	64	38
COc1ccc2c(N3CCC(N4CCCOCC4)CC3)ccnc2c1	ZINC000853688252	EF	On-Demand	Anodyne	CCR4	25	48
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cncs1	ZINC000853688264	EF	On-Demand	Anodyne	PREP	23	46
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cncs1	ZINC000853688265	EF	On-Demand	Anodyne	PREP	23	46
O=[N+]([O-])c1cccc([N+](=O)[O-])c1N1CCC(N2CCCOCC2)CC1	ZINC000853688266	FE	On-Demand	Bother	L3MBTL3	74	43
O=[N+]([O-])c1ccc(N2CCC(N3CCCOCC3)CC2)c(Cl)c1	ZINC000853688301	EF	On-Demand	Bother	L3MBTL3	57	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2OC(F)(F)F)CC1	ZINC000853688311	GF	On-Demand	Anodyne	P2RY12	80	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2OC(F)(F)F)CC1	ZINC000853688311	GF	On-Demand	Anodyne	NR5A1	22	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2OC(F)(F)F)CC1	ZINC000853688312	GF	On-Demand	Anodyne	P2RY12	80	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2OC(F)(F)F)CC1	ZINC000853688312	GF	On-Demand	Anodyne	NR5A1	22	40
Fc1cccc2c(N3CCC(N4CCCOCC4)CC3)ccnc12	ZINC000853688324	EG	On-Demand	Anodyne	L3MBTL3	39	41
CON(C)CCNC(=O)NCC1CCN(C(C)=O)CC1	ZINC000853688327	CC	On-Demand	Anodyne	CACNA1I	48	32
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853688328	JI	On-Demand	Mild	VIPR1	26	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853688329	JI	On-Demand	Mild	VIPR1	26	41
O=S(=O)(c1ccccc1N1CCC(N2CCCOCC2)CC1)C(F)F	ZINC000853688348	FE	On-Demand	Anodyne	L3MBTL3	53	40
c1ccc2c(N3CCC(N4CCCOCC4)CC3)nc(-c3ccncc3)nc2c1	ZINC000853688374	GG	On-Demand	Anodyne	PIK3CA	52	43
c1ccc2c(N3CCC(N4CCCOCC4)CC3)nc(-c3ccncc3)nc2c1	ZINC000853688374	GG	On-Demand	Anodyne	PRKD1	26	43
c1ccc2c(N3CCC(N4CCCOCC4)CC3)nc(-c3ccncc3)nc2c1	ZINC000853688374	GG	On-Demand	Anodyne	MTOR	61	42
c1ccc2c(N3CCC(N4CCCOCC4)CC3)nc(-c3ccncc3)nc2c1	ZINC000853688374	GG	On-Demand	Anodyne	PIK3CG	24	43
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688384	JI	On-Demand	Anodyne	TACR1	17	44
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688384	JI	On-Demand	Anodyne	CCKAR	41	44
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688384	JI	On-Demand	Anodyne	NMBR	18	43
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688384	JI	On-Demand	Anodyne	GRPR	52	33
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688384	JI	On-Demand	Anodyne	MMP11	49	31
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688384	JI	On-Demand	Anodyne	MMP9	15	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688392	JI	On-Demand	Anodyne	TACR1	17	44
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688392	JI	On-Demand	Anodyne	CCKAR	41	44
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688392	JI	On-Demand	Anodyne	NMBR	18	43
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688392	JI	On-Demand	Anodyne	GRPR	52	33
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688392	JI	On-Demand	Anodyne	MMP11	49	31
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853688392	JI	On-Demand	Anodyne	MMP9	15	41
Nc1ccc([N+](=O)[O-])c(N2CCC(N3CCCOCC3)CC2)c1	ZINC000853688423	DD	On-Demand	Bother	L3MBTL3	54	39
c1cc(N2CCCC2)nc(N2CCC(N3CCCOCC3)CC2)n1	ZINC000853688431	ED	On-Demand	Anodyne	HRH3	19	41
c1cc(N2CCCC2)nc(N2CCC(N3CCCOCC3)CC2)n1	ZINC000853688431	ED	On-Demand	Anodyne	L3MBTL3	68	44
O=[N+]([O-])c1ccc(N2CCC(N3CCCOCC3)CC2)c(F)c1	ZINC000853688480	DE	On-Demand	Bother	SLC6A9	15	47
O=[N+]([O-])c1ccc(N2CCC(N3CCCOCC3)CC2)c(F)c1	ZINC000853688480	DE	On-Demand	Bother	L3MBTL3	54	39
C#Cc1cccnc1N1CCC(N2CCCOCC2)CC1	ZINC000853688496	CD	On-Demand	Mild	HRH3	16	42
C#Cc1cccnc1N1CCC(N2CCCOCC2)CC1	ZINC000853688496	CD	On-Demand	Mild	L3MBTL3	67	44
Nc1ccc(N2CCC(N3CCCOCC3)CC2)c([N+](=O)[O-])c1	ZINC000853688502	DD	On-Demand	Bother	L3MBTL3	52	39
O=[N+]([O-])c1ccc2nc(N3CCC(N4CCCOCC4)CC3)sc2c1	ZINC000853688543	FF	On-Demand	Bother	HRH3	18	47
Brc1ccc2ccc(N3CCC(N4CCCOCC4)CC3)nc2c1	ZINC000853688544	GH	On-Demand	Anodyne	L3MBTL3	42	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(COc3ccccc3)n2)CC1	ZINC000853688557	GD	On-Demand	Anodyne	P2RY12	138	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(COc3ccccc3)n2)CC1	ZINC000853688558	GD	On-Demand	Anodyne	P2RY12	138	41
NC(=O)c1cc(Cl)nnc1N1CCC(N2CCCOCC2)CC1	ZINC000853688572	EC	On-Demand	Anodyne	STAT6	42	32
NC(=O)c1cc(Cl)nnc1N1CCC(N2CCCOCC2)CC1	ZINC000853688572	EC	On-Demand	Anodyne	L3MBTL3	86	38
N#Cc1cc([N+](=O)[O-])ccc1N1CCC(N2CCCOCC2)CC1	ZINC000853688590	EE	On-Demand	Mild	L3MBTL3	73	40
Cc1nonc1Cn1c(C)ccc([N+](=O)[O-])c1=O	ZINC000853688615	CC	On-Demand	Bother	GSTM2	65	35
Cc1nonc1Cn1c(C)ccc([N+](=O)[O-])c1=O	ZINC000853688615	CC	On-Demand	Bother	GSTP1	41	35
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)COC(C)(C)C)CC1	ZINC000853688644	GE	On-Demand	Anodyne	DRD4	19	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)COC(C)(C)C)CC1	ZINC000853688644	GE	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)COC(C)(C)C)CC1	ZINC000853688644	GE	On-Demand	Anodyne	MCHR1	28	40
COC[C@@H](COc1ccc(C(=O)OC)c(Cl)c1)OC	ZINC000853688674	CE	On-Demand	Anodyne	PDS	73	41
Cc1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c(Br)n1	ZINC000853688681	GH	On-Demand	Anodyne	GRIN2B	41	36
Cc1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c(Br)n1	ZINC000853688682	GH	On-Demand	Anodyne	GRIN2B	41	36
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cc(C2CC2)no1	ZINC000853688711	FF	On-Demand	Anodyne	PREP	21	41
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cc(C2CC2)no1	ZINC000853688711	FF	On-Demand	Anodyne	LGMN	41	32
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cc(C2CC2)no1	ZINC000853688713	FF	On-Demand	Anodyne	PREP	21	41
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cc(C2CC2)no1	ZINC000853688713	FF	On-Demand	Anodyne	LGMN	41	32
CC(C)n1ncnc1CONC(=N)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688719	FE	On-Demand	Anodyne	TRHR	52	31
CC(C)n1ncnc1CONC(=N)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688719	FE	On-Demand	Anodyne	PREP	16	42
CC(C)n1ncnc1CONC(=N)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688719	FE	On-Demand	Anodyne	LGMN	58	33
CC(C)n1ncnc1CONC(=N)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688720	FE	On-Demand	Anodyne	TRHR	52	31
CC(C)n1ncnc1CONC(=N)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688720	FE	On-Demand	Anodyne	PREP	16	42
CC(C)n1ncnc1CONC(=N)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688720	FE	On-Demand	Anodyne	LGMN	58	33
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688727	JI	On-Demand	Anodyne	DRD4	29	42
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688727	JI	On-Demand	Anodyne	ACHE	24	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688727	JI	On-Demand	Anodyne	SIGMAR1	27	46
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688727	JI	On-Demand	Anodyne	SSTR5	58	37
Cc1noc(C)c1COc1ccccc1C(=O)O[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688727	JI	On-Demand	Anodyne	MCHR1	27	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688728	JI	On-Demand	Anodyne	DRD4	29	42
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688728	JI	On-Demand	Anodyne	ACHE	24	41
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688728	JI	On-Demand	Anodyne	SIGMAR1	27	46
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688728	JI	On-Demand	Anodyne	SSTR5	58	37
Cc1noc(C)c1COc1ccccc1C(=O)O[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853688728	JI	On-Demand	Anodyne	MCHR1	27	41
N#Cc1sc(N2CCC(N3CCCOCC3)CC2)nc1Cl	ZINC000853688881	EE	On-Demand	Mild	HRH3	17	45
c1ccc(-c2cc3c(N4CCC(N5CCCOCC5)CC4)ncnc3s2)cc1	ZINC000853688896	GI	On-Demand	Anodyne	HRH3	18	43
C#CCOCCONC(=N)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688960	DD	On-Demand	Mild	PREP	15	51
C#CCOCCONC(=N)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853688963	DD	On-Demand	Mild	PREP	15	51
O=[N+]([O-])c1ccc(N2CCC(N3CCCOCC3)CC2)c([N+](=O)[O-])c1	ZINC000853688975	FE	On-Demand	Bother	L3MBTL3	55	40
N#Cc1ccc(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)c(F)c1	ZINC000853688988	FD	On-Demand	Mild	TRPV1	50	33
COC(=O)c1sc(N2CCC(N3CCCOCC3)CC2)nc1Cl	ZINC000853689000	FE	On-Demand	Anodyne	HRH3	16	42
COC(=O)c1sc(N2CCC(N3CCCOCC3)CC2)nc1Cl	ZINC000853689000	FE	On-Demand	Anodyne	PARE	65	35
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	CHRM2	19	45
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	CHRM1	19	45
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	DRD2	29	48
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	DRD4	56	47
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	ACHE	46	45
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	KCNH2	16	43
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	HTR4	21	45
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	CHRM3	25	45
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	LTA4H	26	42
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	SIGMAR1	48	53
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	SSTR5	53	39
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	CCR3	29	41
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	SLC6A5	23	42
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	MCHR1	54	50
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	CACNA1G	33	40
C[C@@H](ONC(=N)COC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853689003	GE	On-Demand	Anodyne	CCR8	19	41
O=[N+]([O-])c1ccc(Cl)cc1N1CCC(N2CCCOCC2)CC1	ZINC000853689007	EF	On-Demand	Bother	L3MBTL3	52	39
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689024	FE	On-Demand	Anodyne	TRHR	55	33
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689024	FE	On-Demand	Anodyne	PREP	22	46
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689024	FE	On-Demand	Anodyne	LGMN	61	33
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689024	FE	On-Demand	Anodyne	WNT3	41	38
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689025	FE	On-Demand	Anodyne	TRHR	55	33
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689025	FE	On-Demand	Anodyne	PREP	22	46
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689025	FE	On-Demand	Anodyne	LGMN	61	33
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1cn(C(C)(C)C)nn1	ZINC000853689025	FE	On-Demand	Anodyne	WNT3	41	38
Fc1cc(N2CCC(N3CCCOCC3)CC2)ncn1	ZINC000853689026	CD	On-Demand	Anodyne	L3MBTL3	38	41
Fc1nc(F)c(F)c(N2CCC(N3CCCOCC3)CC2)c1F	ZINC000853689027	EE	On-Demand	Anodyne	L3MBTL3	37	42
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1csc(Cl)n1	ZINC000853689033	FG	On-Demand	Anodyne	PREP	17	43
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1csc(Cl)n1	ZINC000853689034	FG	On-Demand	Anodyne	PREP	17	43
Fc1cccc2oc(N3CCC(N4CCCOCC4)CC3)nc12	ZINC000853689039	DF	On-Demand	Anodyne	HTR3A	16	43
Fc1cccc2oc(N3CCC(N4CCCOCC4)CC3)nc12	ZINC000853689039	DF	On-Demand	Anodyne	HRH3	15	44
Fc1cccc2oc(N3CCC(N4CCCOCC4)CC3)nc12	ZINC000853689039	DF	On-Demand	Anodyne	L3MBTL3	66	41
C#CCCCOc1cccnc1N1CCC(N2CCCOCC2)CC1	ZINC000853689041	EF	On-Demand	Mild	L3MBTL3	39	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3[nH]ccc3c2=O)CC1	ZINC000853689066	EC	On-Demand	Anodyne	P2RY12	61	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3[nH]ccc3c2=O)CC1	ZINC000853689068	EC	On-Demand	Anodyne	P2RY12	61	37
C#CCOCCOc1ccc2[nH]c(C)cc2c1F	ZINC000853689077	BF	On-Demand	Mild	STK35	24	42
Cc1nc(N2CCC(N3CCCOCC3)CC2)c2cnn(-c3ccccc3)c2n1	ZINC000853689087	GF	On-Demand	Anodyne	PIK3CA	17	51
Cc1nc(N2CCC(N3CCCOCC3)CC2)c2cnn(-c3ccccc3)c2n1	ZINC000853689087	GF	On-Demand	Anodyne	MTOR	29	51
COC(=O)c1cccc(N2CCC(N3CCCOCC3)CC2)n1	ZINC000853689101	DD	On-Demand	Anodyne	L3MBTL3	101	38
c1cncc(-c2nc(N3CCC(N4CCCOCC4)CC3)c3ccccc3n2)c1	ZINC000853689123	GG	On-Demand	Anodyne	PIK3CA	48	54
c1cncc(-c2nc(N3CCC(N4CCCOCC4)CC3)c3ccccc3n2)c1	ZINC000853689123	GG	On-Demand	Anodyne	PRKD1	26	41
c1cncc(-c2nc(N3CCC(N4CCCOCC4)CC3)c3ccccc3n2)c1	ZINC000853689123	GG	On-Demand	Anodyne	MTOR	51	54
c1cncc(-c2nc(N3CCC(N4CCCOCC4)CC3)c3ccccc3n2)c1	ZINC000853689123	GG	On-Demand	Anodyne	PIK3CG	21	42
c1ccc(COc2cc(N3CCC(N4CCCOCC4)CC3)ncn2)cc1	ZINC000853689130	FF	On-Demand	Anodyne	L3MBTL3	47	42
Brc1ccc2ccnc(N3CCC(N4CCCOCC4)CC3)c2c1	ZINC000853689140	GH	On-Demand	Anodyne	L3MBTL3	38	41
c1nc(N2CCC(N3CCCOCC3)CC2)nc2c1CCCC2	ZINC000853689146	DE	On-Demand	Anodyne	L3MBTL3	32	41
O=[N+]([O-])c1ccc(N2CCC(N3CCCOCC3)CC2)c2nonc12	ZINC000853689156	ED	On-Demand	Bother	GSTM2	97	40
O=[N+]([O-])c1ccc(N2CCC(N3CCCOCC3)CC2)c2nonc12	ZINC000853689156	ED	On-Demand	Bother	GSTP1	56	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853689158	GG	On-Demand	Bother	LGMN	57	35
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853689158	GG	On-Demand	Bother	SFRP1	34	40
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853689158	GG	On-Demand	Bother	WNT3	53	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(C)=O)cc2Cl)CC1	ZINC000853689162	GF	On-Demand	Anodyne	P2RY12	47	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(C)=O)cc2Cl)CC1	ZINC000853689163	GF	On-Demand	Anodyne	P2RY12	47	39
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853689166	GG	On-Demand	Bother	LGMN	57	35
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853689166	GG	On-Demand	Bother	SFRP1	34	40
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853689166	GG	On-Demand	Bother	WNT3	53	40
Cn1cncc1CCONC(=N)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853689170	ED	On-Demand	Anodyne	PREP	25	45
Cn1cncc1CCONC(=N)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000853689172	ED	On-Demand	Anodyne	PREP	25	45
O=[N+]([O-])c1ccc(Br)cc1N1CCC(N2CCCOCC2)CC1	ZINC000853689174	GG	On-Demand	Bother	L3MBTL3	74	41
CCOC(=O)c1nnc2ccccc2c1N1CCC(N2CCCOCC2)CC1	ZINC000853689201	GE	On-Demand	Anodyne	L3MBTL3	43	36
NC(=O)[C@@]1(c2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853689202	CD	On-Demand	Anodyne	MLYCD	27	48
NC(=O)[C@]1(c2ccccc2)CCN(c2cnc(F)cn2)C1	ZINC000853689203	CD	On-Demand	Anodyne	MLYCD	27	48
Fc1cccc(N2CCC(N3CCCOCC3)CC2)n1	ZINC000853689205	CD	On-Demand	Anodyne	L3MBTL3	60	43
CN(C)C(=O)c1cc(N2CCC(N3CCCOCC3)CC2)ccn1	ZINC000853689215	ED	On-Demand	Anodyne	HRH3	15	40
CN(C)C(=O)c1cc(N2CCC(N3CCCOCC3)CC2)ccn1	ZINC000853689215	ED	On-Demand	Anodyne	EPHB4	58	34
CN(C)C(=O)c1cc(N2CCC(N3CCCOCC3)CC2)ccn1	ZINC000853689215	ED	On-Demand	Anodyne	L3MBTL3	87	42
C#CCOCCOc1ccc(C2CCC2)cc1	ZINC000853689225	BF	On-Demand	Mild	HRH3	18	42
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=N)NOCC1(CC#N)CC1	ZINC000853689245	DF	On-Demand	Mild	LGMN	48	34
CC(C)(C)OC(=O)N1CCC[C@H]1C(=N)NOCC1(CC#N)CC1	ZINC000853689248	DF	On-Demand	Mild	LGMN	48	34
COC(=O)Cc1ccnc(NC[C@@H]2CCN(C)[C@H]2c2cccnc2)c1	ZINC000853689278	EE	On-Demand	Anodyne	CHRNA7	43	35
COC(=O)c1ccc(OCC2(CC#N)CC2)cc1Cl	ZINC000853689352	CG	On-Demand	Mild	TRPV4	42	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(Cl)cc3cccnc23)CC1	ZINC000853689360	GF	On-Demand	Anodyne	P2RY12	104	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(Cl)cc3cccnc23)CC1	ZINC000853689361	GF	On-Demand	Anodyne	P2RY12	104	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(C#N)cc1F	ZINC000853689379	GF	On-Demand	Mild	GPR119	36	42
C[C@@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1csc2ccccc12	ZINC000853689446	FI	On-Demand	Anodyne	CPT1A	70	37
C[C@@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1csc2ccccc12	ZINC000853689447	FI	On-Demand	Anodyne	CPT1A	70	37
C[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689498	GH	On-Demand	Anodyne	ACACA	18	40
C[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689498	GH	On-Demand	Anodyne	ACACB	19	40
C[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689498	GH	On-Demand	Anodyne	CALCRL	23	45
C[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689498	GH	On-Demand	Anodyne	L3MBTL3	60	38
C[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689500	GH	On-Demand	Anodyne	ACACA	18	40
C[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689500	GH	On-Demand	Anodyne	ACACB	19	40
C[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689500	GH	On-Demand	Anodyne	CALCRL	23	45
C[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1csc2ccccc12	ZINC000853689500	GH	On-Demand	Anodyne	L3MBTL3	60	38
NC(=O)[C@@]1(c2ccccc2)CCN(c2ncnc(F)c2Br)C1	ZINC000853689523	FE	On-Demand	Anodyne	MLYCD	24	44
NC(=O)[C@]1(c2ccccc2)CCN(c2ncnc(F)c2Br)C1	ZINC000853689524	FE	On-Demand	Anodyne	MLYCD	24	44
C[C@@H](NC(=O)N1CCC(CO)(CO)C1)c1csc2ccccc12	ZINC000853689530	EE	On-Demand	Anodyne	FFAR2	48	33
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2C(=O)c2cccnc2)CC1	ZINC000853689566	GD	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2C(=O)c2cccnc2)CC1	ZINC000853689567	GD	On-Demand	Anodyne	P2RY12	47	36
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689571	JE	On-Demand	Bother	CA2	24	40
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689571	JE	On-Demand	Bother	COLA	44	31
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689572	JE	On-Demand	Bother	CA2	24	40
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689572	JE	On-Demand	Bother	COLA	44	31
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689573	JE	On-Demand	Bother	CA2	24	40
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689573	JE	On-Demand	Bother	COLA	44	31
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689574	JE	On-Demand	Bother	CA2	24	40
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1[N+](=O)[O-]	ZINC000853689574	JE	On-Demand	Bother	COLA	44	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)COc2cccc(F)c2)CC1	ZINC000853689591	GD	On-Demand	Anodyne	P2RY12	104	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)COc2cccc(F)c2)CC1	ZINC000853689592	GD	On-Demand	Anodyne	P2RY12	104	38
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1	ZINC000853689612	HI	On-Demand	Bother	GSTM2	35	40
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1	ZINC000853689612	HI	On-Demand	Bother	GSTP1	15	40
C#Cc1cccnc1NCC1(O)CCN(Cc2ccccc2)CC1	ZINC000853689628	DF	On-Demand	Mild	NPFFR1	43	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(CO)c(=O)cc2C)CC1	ZINC000853689630	FB	On-Demand	Anodyne	P2RY12	54	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(CO)c(=O)cc2C)CC1	ZINC000853689632	FB	On-Demand	Anodyne	P2RY12	54	36
C=C(C)CN1CCC(NC(=O)NNc2cccc(C(=O)OC)c2C)CC1	ZINC000853689633	FE	On-Demand	Reactive	CCR8	49	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000853689636	GE	On-Demand	Anodyne	P2RY12	84	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)OC)c(Cl)c2)CC1	ZINC000853689638	GE	On-Demand	Anodyne	P2RY12	84	38
O=C(NCCCN1C(=O)CCC1=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853689760	GE	On-Demand	Reactive	HRP1_PLAFA	44	31
O=C(NCCCN1C(=O)CCC1=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853689760	GE	On-Demand	Reactive	CSNK1D	32	41
O=S(=O)(CCNc1ncnc2c1ncn2-c1ccccc1)C1CC1	ZINC000853689793	ED	On-Demand	Anodyne	ADORA1	22	40
CS(=O)(=O)N1CC[C@@H](CONC(=N)COc2cccc(F)c2)C1	ZINC000853689816	EC	On-Demand	Anodyne	CHRNA10	33	41
CS(=O)(=O)N1CC[C@H](CONC(=N)COc2cccc(F)c2)C1	ZINC000853689818	EC	On-Demand	Anodyne	CHRNA10	33	41
N=C(COc1cccc(F)c1)NOCC1CC=CC1	ZINC000853689823	CF	On-Demand	Anodyne	CHRNA10	29	42
OC1(CNc2cnc(F)cn2)CCN(Cc2ccccc2)CC1	ZINC000853689893	DE	On-Demand	Anodyne	SIGMAR1	58	40
OC1(CNc2cnc(F)cn2)CCN(Cc2ccccc2)CC1	ZINC000853689893	DE	On-Demand	Anodyne	NPFFR1	41	37
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)COc2cccc(F)c2)C1	ZINC000853689900	GE	On-Demand	Anodyne	GPR119	25	43
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)COc2cccc(F)c2)C1	ZINC000853689903	GE	On-Demand	Anodyne	GPR119	25	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccsc2C(C)=O)CC1	ZINC000853689955	FE	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccsc2C(C)=O)CC1	ZINC000853689956	FE	On-Demand	Anodyne	P2RY12	41	36
CCCOc1cccc(Cn2cc([N+](=O)[O-])c(C(N)=O)n2)c1	ZINC000853689966	DD	On-Demand	Bother	HRH2	34	41
C#CCOCCOc1ccc(Cl)cc1-c1nc(C)no1	ZINC000853690004	CF	On-Demand	Mild	AGPAT2	44	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)nc2Cl)CC1	ZINC000853690031	FE	On-Demand	Anodyne	P2RY12	93	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)nc2Cl)CC1	ZINC000853690033	FE	On-Demand	Anodyne	P2RY12	93	38
N#Cc1cnnc(NC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000853690036	DD	On-Demand	Mild	GRIN2B	18	42
N#Cc1cnnc(NC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000853690036	DD	On-Demand	Mild	PREP	24	40
N#Cc1cnnc(NC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000853690036	DD	On-Demand	Mild	LGMN	57	38
N#Cc1cnnc(NC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000853690036	DD	On-Demand	Mild	TGM2	32	40
N#Cc1cnnc(NC2CN(C(=O)OCc3ccccc3)C2)c1	ZINC000853690036	DD	On-Demand	Mild	F13A1	29	40
O=S(=O)(CCNc1ccnc2c(F)cc(Cl)cc12)C1CC1	ZINC000853690061	EG	On-Demand	Anodyne	HRP1_PLAFA	117	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(Cl)c2F)CC1	ZINC000853690071	FF	On-Demand	Anodyne	P2RY12	50	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(Cl)c2F)CC1	ZINC000853690073	FF	On-Demand	Anodyne	P2RY12	50	37
COC(=O)c1ccc(C(F)(F)F)nc1NCCS(=O)(=O)C1CC1	ZINC000853690130	FD	On-Demand	Anodyne	TRPV1	61	33
CCN1CC[C@H](ONC(=N)COc2cccc(F)c2)C1=O	ZINC000853690138	CD	On-Demand	Anodyne	CHRNA10	37	41
O=C(OCc1ccccc1)N1CC(Nc2ccnc(O)c2[N+](=O)[O-])C1	ZINC000853690150	EE	On-Demand	Bother	GRIN2B	20	43
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853690226	EF	On-Demand	Mild	DRD4	21	44
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853690226	EF	On-Demand	Mild	SIGMAR1	17	41
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853690226	EF	On-Demand	Mild	EPHX2	25	41
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853690228	EF	On-Demand	Mild	DRD4	21	44
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853690228	EF	On-Demand	Mild	SIGMAR1	17	41
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853690228	EF	On-Demand	Mild	EPHX2	25	41
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853690230	EF	On-Demand	Mild	DRD4	21	44
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853690230	EF	On-Demand	Mild	SIGMAR1	17	41
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853690230	EF	On-Demand	Mild	EPHX2	25	41
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853690231	EF	On-Demand	Mild	DRD4	21	44
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853690231	EF	On-Demand	Mild	SIGMAR1	17	41
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853690231	EF	On-Demand	Mild	EPHX2	25	41
COC1([C@@H](C)Nc2ccc3c(c2)S(=O)(=O)N=C3Cl)CCC1	ZINC000853690250	EF	On-Demand	Anodyne	ABCC8	45	35
COC1([C@H](C)Nc2ccc3c(c2)S(=O)(=O)N=C3Cl)CCC1	ZINC000853690253	EF	On-Demand	Anodyne	ABCC8	45	35
C[C@@H](NC(=O)N(CCN1CCOCC1)CC1CC1)c1csc2ccccc12	ZINC000853690317	GH	On-Demand	Anodyne	CASR	56	41
C[C@@H](NC(=O)N(CCN1CCOCC1)CC1CC1)c1csc2ccccc12	ZINC000853690317	GH	On-Demand	Anodyne	PTGDS	37	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)COc2ccccc2F)CC1	ZINC000853690328	GD	On-Demand	Anodyne	P2RY12	115	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)COc2ccccc2F)CC1	ZINC000853690329	GD	On-Demand	Anodyne	P2RY12	115	39
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)COc2ccccc2F)C1	ZINC000853690353	GE	On-Demand	Anodyne	GPR119	22	43
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)COc2ccccc2F)C1	ZINC000853690355	GE	On-Demand	Anodyne	GPR119	22	43
CC(C)c1ccc2ncnc(NCCS(=O)(=O)C3CC3)c2c1	ZINC000853690356	DF	On-Demand	Anodyne	CLK4	57	34
CC(C)c1ccc2ncnc(NCCS(=O)(=O)C3CC3)c2c1	ZINC000853690356	DF	On-Demand	Anodyne	CD38	41	38
C#Cc1cccnc1N1CCC(NC(=O)NC)CC1	ZINC000853690377	CC	On-Demand	Mild	EPHX2	26	40
Cn1nnc2c(NC3CN(C(=O)OCc4ccccc4)C3)ncnc21	ZINC000853690379	ED	On-Demand	Anodyne	ADORA1	25	52
Cn1nnc2c(NC3CN(C(=O)OCc4ccccc4)C3)ncnc21	ZINC000853690379	ED	On-Demand	Anodyne	GRIN2B	21	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(OC)ccc2=O)CC1	ZINC000853690395	EC	On-Demand	Anodyne	P2RY12	84	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(OC)ccc2=O)CC1	ZINC000853690397	EC	On-Demand	Anodyne	P2RY12	84	39
O=C(OCc1ccccc1)N1CC(Nc2cnc(F)cn2)C1	ZINC000853690400	DE	On-Demand	Anodyne	GRIN2B	24	46
O=C(OCc1ccccc1)N1CC(Nc2cnc(F)cn2)C1	ZINC000853690400	DE	On-Demand	Anodyne	PREP	26	40
O=C(OCc1ccccc1)N1CC(Nc2cnc(F)cn2)C1	ZINC000853690400	DE	On-Demand	Anodyne	TGM2	38	44
O=C(OCc1ccccc1)N1CC(Nc2cnc(F)cn2)C1	ZINC000853690400	DE	On-Demand	Anodyne	F13A1	35	40
O=C(OCc1ccccc1)N1CC(Nc2cnc(F)cn2)C1	ZINC000853690400	DE	On-Demand	Anodyne	SLC12A5	42	34
CC(C)c1ccc2ncnc(NC[C@@H]3CCN(C)[C@H]3c3cccnc3)c2c1	ZINC000853690432	FI	On-Demand	Anodyne	CLK4	48	39
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccnc2C(=O)c2cccnc2)C1	ZINC000853690444	FE	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccnc2C(=O)c2cccnc2)C1	ZINC000853690446	FE	On-Demand	Anodyne	GPR119	21	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)CCC3=O)CC1	ZINC000853690452	FD	On-Demand	Anodyne	P2RY12	50	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)CCC3=O)CC1	ZINC000853690455	FD	On-Demand	Anodyne	P2RY12	50	37
CCN1CC[C@H](N(CC)C(=O)N[C@H](C)c2csc3ccccc23)C1	ZINC000853690574	EI	On-Demand	Anodyne	CCR5	27	45
CCN1CC[C@H](N(CC)C(=O)N[C@@H](C)c2csc3ccccc23)C1	ZINC000853690576	EI	On-Demand	Anodyne	CCR5	27	45
CCN1CC[C@@H](N(CC)C(=O)N[C@H](C)c2csc3ccccc23)C1	ZINC000853690578	EI	On-Demand	Anodyne	CCR5	27	45
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](C)c2csc3ccccc23)C1	ZINC000853690580	EI	On-Demand	Anodyne	CCR5	27	45
O=C1C[C@]2(CCN(c3cnc(F)cn3)C2)Oc2ccccc21	ZINC000853690599	CE	On-Demand	Anodyne	SCD	18	43
O=C1C[C@@]2(CCN(c3cnc(F)cn3)C2)Oc2ccccc21	ZINC000853690600	CE	On-Demand	Anodyne	SCD	18	43
CCOC(=O)c1nc(=NC2CN(C(=O)OCc3ccccc3)C2)cc[nH]1	ZINC000853690665	FD	On-Demand	Anodyne	GRIN2B	18	41
N=C(COc1cccc(F)c1)NOCC1C[C@H]2C[C@@H]2C1	ZINC000853690695	CF	On-Demand	Anodyne	CHRNA10	29	41
N=C(COc1cccc(F)c1)NOCC1C[C@@H]2C[C@H]2C1	ZINC000853690697	CF	On-Demand	Anodyne	CHRNA10	29	41
N=C(COc1cccc(F)c1)NOC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853690698	CF	On-Demand	Anodyne	CHRNA10	29	41
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690700	IG	On-Demand	Bother	DRD4	29	50
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690700	IG	On-Demand	Bother	ACHE	24	41
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690700	IG	On-Demand	Bother	SIGMAR1	27	51
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690700	IG	On-Demand	Bother	CCR3	27	41
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690700	IG	On-Demand	Bother	MCHR1	18	42
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690700	IG	On-Demand	Bother	BIRC2	27	40
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690703	IG	On-Demand	Bother	DRD4	29	50
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690703	IG	On-Demand	Bother	ACHE	24	41
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690703	IG	On-Demand	Bother	SIGMAR1	27	51
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690703	IG	On-Demand	Bother	CCR3	27	41
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690703	IG	On-Demand	Bother	MCHR1	18	42
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690703	IG	On-Demand	Bother	BIRC2	27	40
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690705	IG	On-Demand	Bother	DRD4	29	50
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690705	IG	On-Demand	Bother	ACHE	24	41
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690705	IG	On-Demand	Bother	SIGMAR1	27	51
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690705	IG	On-Demand	Bother	CCR3	27	41
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690705	IG	On-Demand	Bother	MCHR1	18	42
CSc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690705	IG	On-Demand	Bother	BIRC2	27	40
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690707	IG	On-Demand	Bother	DRD4	29	50
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690707	IG	On-Demand	Bother	ACHE	24	41
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690707	IG	On-Demand	Bother	SIGMAR1	27	51
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690707	IG	On-Demand	Bother	CCR3	27	41
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690707	IG	On-Demand	Bother	MCHR1	18	42
CSc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000853690707	IG	On-Demand	Bother	BIRC2	27	40
CCOC(=O)N1CCN(C(=O)[C@H](C)O[C@@H]2CCCc3c[nH]nc32)CC1	ZINC000853690708	FD	On-Demand	Anodyne	P2RY12	81	37
CCOC(=O)N1CCN(C(=O)[C@H](C)O[C@H]2CCCc3c[nH]nc32)CC1	ZINC000853690710	FD	On-Demand	Anodyne	P2RY12	81	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)O[C@H]2CCCc3c[nH]nc32)CC1	ZINC000853690712	FD	On-Demand	Anodyne	P2RY12	81	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)O[C@@H]2CCCc3c[nH]nc32)CC1	ZINC000853690714	FD	On-Demand	Anodyne	P2RY12	81	37
O=C(OCc1ccccc1)N1CC(Nc2cc(F)ncn2)C1	ZINC000853690719	DE	On-Demand	Anodyne	GRIN2B	23	48
O=C(OCc1ccccc1)N1CC(Nc2cc(F)ncn2)C1	ZINC000853690719	DE	On-Demand	Anodyne	TGM2	42	42
O=C(OCc1ccccc1)N1CC(Nc2cc(F)ncn2)C1	ZINC000853690719	DE	On-Demand	Anodyne	F13A1	39	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-c3ncn(C)n3)cc2)CC1	ZINC000853690728	GD	On-Demand	Anodyne	P2RY12	93	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-c3ncn(C)n3)cc2)CC1	ZINC000853690730	GD	On-Demand	Anodyne	P2RY12	93	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccncc2)C1	ZINC000853690738	CE	On-Demand	Anodyne	GPR119	49	48
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccncc2)C1	ZINC000853690740	CE	On-Demand	Anodyne	GPR119	49	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690754	FE	On-Demand	Mild	PGR	19	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690754	FE	On-Demand	Mild	AR	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690754	FE	On-Demand	Mild	P2RY12	102	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690754	FE	On-Demand	Mild	TRPV4	45	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690755	FE	On-Demand	Mild	PGR	19	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690755	FE	On-Demand	Mild	AR	18	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690755	FE	On-Demand	Mild	P2RY12	102	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)c(Cl)c2)CC1	ZINC000853690755	FE	On-Demand	Mild	TRPV4	45	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@H](O)c2ccco2)CC1	ZINC000853690759	GD	On-Demand	Anodyne	P2RY12	64	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@@H](O)c2ccco2)CC1	ZINC000853690761	GD	On-Demand	Anodyne	P2RY12	64	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@H](O)c2ccco2)CC1	ZINC000853690763	GD	On-Demand	Anodyne	P2RY12	64	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@@H](O)c2ccco2)CC1	ZINC000853690765	GD	On-Demand	Anodyne	P2RY12	64	36
C=C(C)CN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853690828	DF	On-Demand	Reactive	CCR3	40	41
C=C(C)CN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853690828	DF	On-Demand	Reactive	MCHR1	17	41
COc1cccc(Nc2nc(NCCS(=O)(=O)C3CC3)nc3[nH]cnc23)c1	ZINC000853690844	GE	On-Demand	Anodyne	PDPK1	18	43
COc1cccc(Nc2nc(NCCS(=O)(=O)C3CC3)nc3[nH]cnc23)c1	ZINC000853690844	GE	On-Demand	Anodyne	SYK	24	45
COc1cccc(Nc2nc(NCCS(=O)(=O)C3CC3)nc3[nH]cnc23)c1	ZINC000853690844	GE	On-Demand	Anodyne	CDK1	21	45
NC(=O)[C@@]1(c2ccccc2)CCN(c2cc(F)ncn2)C1	ZINC000853690862	CD	On-Demand	Anodyne	MLYCD	25	45
NC(=O)[C@]1(c2ccccc2)CCN(c2cc(F)ncn2)C1	ZINC000853690864	CD	On-Demand	Anodyne	MLYCD	25	45
C[C@@H](NC(=O)N1CCO[C@@H](CCCN(C)C)C1)c1csc2ccccc12	ZINC000853690908	GH	On-Demand	Anodyne	FFAR2	43	34
C[C@@H](NC(=O)N1CCO[C@H](CCCN(C)C)C1)c1csc2ccccc12	ZINC000853690910	GH	On-Demand	Anodyne	FFAR2	43	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3ccc(Cl)nc23)CC1	ZINC000853690944	GF	On-Demand	Anodyne	P2RY12	85	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3oc(C)nc23)CC1	ZINC000853690945	FE	On-Demand	Anodyne	P2RY12	88	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3ccc(Cl)nc23)CC1	ZINC000853690946	GF	On-Demand	Anodyne	P2RY12	85	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3oc(C)nc23)CC1	ZINC000853690947	FE	On-Demand	Anodyne	P2RY12	88	41
CC(=O)c1ccc(C(F)(F)F)nc1NCCS(=O)(=O)C1CC1	ZINC000853690964	EE	On-Demand	Anodyne	TRPV1	59	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3ncncc3c2=O)CC1	ZINC000853690980	FC	On-Demand	Anodyne	P2RY12	43	34
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3ncncc3c2=O)CC1	ZINC000853690983	FC	On-Demand	Anodyne	P2RY12	43	34
Cc1ccc(NC2CN(C(=O)OCc3ccccc3)C2)nn1	ZINC000853691039	CE	On-Demand	Anodyne	GRIN2B	23	44
Cc1ccc(NC2CN(C(=O)OCc3ccccc3)C2)nn1	ZINC000853691039	CE	On-Demand	Anodyne	PREP	25	41
Cc1ccc(NC2CN(C(=O)OCc3ccccc3)C2)nn1	ZINC000853691039	CE	On-Demand	Anodyne	TGM2	41	41
Cc1ccc(NC2CN(C(=O)OCc3ccccc3)C2)nn1	ZINC000853691039	CE	On-Demand	Anodyne	KLK5	40	37
Cc1ccc(NC2CN(C(=O)OCc3ccccc3)C2)nn1	ZINC000853691039	CE	On-Demand	Anodyne	F13A1	35	41
COC(=O)C1(COc2cc([N+](=O)[O-])ccc2I)CC1	ZINC000853691051	GF	On-Demand	Bother	CACNA1C	40	34
COC(=O)C1(COc2cc([N+](=O)[O-])ccc2I)CC1	ZINC000853691051	GF	On-Demand	Bother	CACNA1D	60	34
COC(=O)C1(COc2cc([N+](=O)[O-])ccc2I)CC1	ZINC000853691051	GF	On-Demand	Bother	KCNMA1	19	40
C=C(C)CN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853691115	EG	On-Demand	Reactive	EPHX2	20	43
C=C(C)CN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853691115	EG	On-Demand	Reactive	CXCR3	16	42
C[C@@H](NC(=O)N1CCC(O)(CO)CC1)c1csc2ccccc12	ZINC000853691196	EE	On-Demand	Anodyne	FFAR2	58	33
C#CCOCCOc1c(C#N)cnc2c(OC)cc(OC)cc12	ZINC000853691236	DE	On-Demand	Mild	SRC	42	37
C#Cc1cccnc1N1CCC(CC(=O)OC)CC1	ZINC000853691352	CD	On-Demand	Mild	SIRT3	48	30
C#Cc1cccnc1N1CCC(CC(=O)OC)CC1	ZINC000853691352	CD	On-Demand	Mild	SIRT2	42	30
C#Cc1cccnc1N1CCC(CC(=O)OC)CC1	ZINC000853691352	CD	On-Demand	Mild	SIRT1	48	30
O=C(OCc1ccccc1)N1CC(Nc2nc(C3CCOCC3)ns2)C1	ZINC000853691396	FF	On-Demand	Anodyne	GRIN2B	19	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccncc2)CC1	ZINC000853691398	DD	On-Demand	Anodyne	P2RY12	82	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccncc2)CC1	ZINC000853691399	DD	On-Demand	Anodyne	P2RY12	82	43
CC(C)c1ccc2ncnc(N[C@@H]3CCC(=O)N[C@H]3c3ccccc3)c2c1	ZINC000853691411	FI	On-Demand	Anodyne	CD38	53	37
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc3ncncc3c2=O)CC1	ZINC000853691478	GD	On-Demand	Anodyne	SIGMAR1	15	43
COC(=O)C1(COc2cc([N+](=O)[O-])ccc2Br)CC1	ZINC000853691482	EF	On-Demand	Bother	CACNA1D	57	34
FC(F)OCCOc1ccncc1	ZINC000853691490	AD	On-Demand	Anodyne	CYP2C19	16	47
O=C(OCc1ccccc1)N1CC(Nc2cnccn2)C1	ZINC000853691510	CD	On-Demand	Anodyne	GRIN2B	25	65
O=C(OCc1ccccc1)N1CC(Nc2cnccn2)C1	ZINC000853691510	CD	On-Demand	Anodyne	PREP	26	41
O=C(OCc1ccccc1)N1CC(Nc2cnccn2)C1	ZINC000853691510	CD	On-Demand	Anodyne	TGM2	43	45
O=C(OCc1ccccc1)N1CC(Nc2cnccn2)C1	ZINC000853691510	CD	On-Demand	Anodyne	F13A1	41	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@H](O)c2cccnc2)CC1	ZINC000853691525	GD	On-Demand	Anodyne	P2RY12	60	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@H](O)c2cccnc2)CC1	ZINC000853691525	GD	On-Demand	Anodyne	PTAFR	19	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@H](O)c2cccnc2)CC1	ZINC000853691526	GD	On-Demand	Anodyne	P2RY12	60	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@H](O)c2cccnc2)CC1	ZINC000853691526	GD	On-Demand	Anodyne	PTAFR	19	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@@H](O)c2cccnc2)CC1	ZINC000853691527	GD	On-Demand	Anodyne	P2RY12	60	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@@H](O)c2cccnc2)CC1	ZINC000853691527	GD	On-Demand	Anodyne	PTAFR	19	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@@H](O)c2cccnc2)CC1	ZINC000853691528	GD	On-Demand	Anodyne	P2RY12	60	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@@H](O)c2cccnc2)CC1	ZINC000853691528	GD	On-Demand	Anodyne	PTAFR	19	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(F)ccc2C)CC1	ZINC000853691539	EE	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(F)ccc2C)CC1	ZINC000853691540	EE	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc3ccccc3c2)CC1	ZINC000853691560	FE	On-Demand	Anodyne	P2RY12	193	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc3ccccc3c2)CC1	ZINC000853691560	FE	On-Demand	Anodyne	CCKAR	44	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc3ccccc3c2)CC1	ZINC000853691561	FE	On-Demand	Anodyne	P2RY12	193	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc3ccccc3c2)CC1	ZINC000853691561	FE	On-Demand	Anodyne	CCKAR	44	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2cnc3ccccc3c2)C1	ZINC000853691617	EG	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cnc3ccccc3c2)C1	ZINC000853691618	EG	On-Demand	Anodyne	GPR119	37	41
C=CCN1CCC(NC(=O)NNc2cccc(C(=O)OC)c2C)CC1	ZINC000853691661	EE	On-Demand	Reactive	CCR8	49	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)C(=O)NC3)CC1	ZINC000853691682	FC	On-Demand	Anodyne	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)C(=O)NC3)CC1	ZINC000853691683	FC	On-Demand	Anodyne	P2RY12	42	36
Cc1nonc1COc1ccc2c(c1)C(=O)NC2	ZINC000853691769	BD	On-Demand	Anodyne	MAOB	31	41
NC(=O)C1CCN(Cc2ccc(CNc3cnc(F)cn3)cc2)CC1	ZINC000853691817	ED	On-Demand	Anodyne	LTA4H	15	44
NC(=O)C1CCN(Cc2ccc(CNc3cnc(F)cn3)cc2)CC1	ZINC000853691817	ED	On-Demand	Anodyne	SIGMAR1	25	45
NC(=O)C1CCN(Cc2ccc(CNc3cnc(F)cn3)cc2)CC1	ZINC000853691817	ED	On-Demand	Anodyne	MCHR1	25	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(F)ccc2=O)CC1	ZINC000853691823	EC	On-Demand	Anodyne	P2RY12	55	39
NC(=O)C1CCN(Cc2ccc(CNc3cc(F)ncn3)cc2)CC1	ZINC000853691839	ED	On-Demand	Anodyne	SIGMAR1	25	42
NC(=O)C1CCN(Cc2ccc(CNc3cc(F)ncn3)cc2)CC1	ZINC000853691839	ED	On-Demand	Anodyne	SSTR5	45	35
CCOc1nc(NCc2ccnc(Cl)c2)ncc1Cl	ZINC000853691846	CG	On-Demand	Anodyne	CLK2	15	44
CCOc1nc(NCc2ccnc(Cl)c2)ncc1Cl	ZINC000853691846	CG	On-Demand	Anodyne	CLK4	15	44
CS(=O)(=O)N1CC[C@@H](COc2cc(F)cc(I)c2)C1	ZINC000853691884	GE	On-Demand	Anodyne	CHRNA10	34	40
CS(=O)(=O)N1CC[C@H](COc2cc(F)cc(I)c2)C1	ZINC000853691885	GE	On-Demand	Anodyne	CHRNA10	34	40
CCCC[C@H](CC)C(=O)NOCc1nonc1C	ZINC000853691966	CE	On-Demand	Anodyne	CASP7	47	31
CCCC[C@@H](CC)C(=O)NOCc1nonc1C	ZINC000853691967	CE	On-Demand	Anodyne	CASP7	47	31
CCCC[C@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692120	CG	On-Demand	Mild	CTSG	28	41
CCCC[C@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692120	CG	On-Demand	Mild	CTRB1	24	41
CCCC[C@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692120	CG	On-Demand	Mild	MMP3	15	48
CCCC[C@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692120	CG	On-Demand	Mild	CELA2A	24	41
CCCC[C@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692120	CG	On-Demand	Mild	CTRB_BOVIN	59	42
CCCC[C@@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692121	CG	On-Demand	Mild	CTSG	28	41
CCCC[C@@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692121	CG	On-Demand	Mild	CTRB1	24	41
CCCC[C@@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692121	CG	On-Demand	Mild	MMP3	15	48
CCCC[C@@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692121	CG	On-Demand	Mild	CELA2A	24	41
CCCC[C@@H](CC)C(=O)NOCCc1ccc(C#N)cc1	ZINC000853692121	CG	On-Demand	Mild	CTRB_BOVIN	59	42
C=CCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853692130	DE	On-Demand	Mild	DRD4	15	45
C=CCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853692130	DE	On-Demand	Mild	SIGMAR1	19	42
C=CCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853692130	DE	On-Demand	Mild	EPHX2	21	42
C=CCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853692131	DE	On-Demand	Mild	DRD4	15	45
C=CCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853692131	DE	On-Demand	Mild	SIGMAR1	19	42
C=CCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853692131	DE	On-Demand	Mild	EPHX2	21	42
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853692132	DE	On-Demand	Mild	DRD4	15	45
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853692132	DE	On-Demand	Mild	SIGMAR1	19	42
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853692132	DE	On-Demand	Mild	EPHX2	21	42
C=CCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853692133	DE	On-Demand	Mild	DRD4	15	45
C=CCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853692133	DE	On-Demand	Mild	SIGMAR1	19	42
C=CCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853692133	DE	On-Demand	Mild	EPHX2	21	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3ncn(C)n3)c2)CC1	ZINC000853692135	GD	On-Demand	Anodyne	P2RY12	177	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3ncn(C)n3)c2)CC1	ZINC000853692136	GD	On-Demand	Anodyne	P2RY12	177	41
CCCC[C@H](CC)C(=O)NO[C@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853692180	FD	On-Demand	Anodyne	P2RY12	76	35
CCCC[C@H](CC)C(=O)NO[C@@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853692181	FD	On-Demand	Anodyne	P2RY12	76	35
CCCC[C@@H](CC)C(=O)NO[C@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853692182	FD	On-Demand	Anodyne	P2RY12	76	35
CCCC[C@@H](CC)C(=O)NO[C@@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853692183	FD	On-Demand	Anodyne	P2RY12	76	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([C@@H]3CCOC3)cc2)CC1	ZINC000853692234	GE	On-Demand	Anodyne	P2RY12	67	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([C@@H]3CCOC3)cc2)CC1	ZINC000853692235	GE	On-Demand	Anodyne	P2RY12	67	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([C@H]3CCOC3)cc2)CC1	ZINC000853692236	GE	On-Demand	Anodyne	P2RY12	67	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([C@H]3CCOC3)cc2)CC1	ZINC000853692237	GE	On-Demand	Anodyne	P2RY12	67	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])c(CO)c2)CC1	ZINC000853692243	GD	On-Demand	Bother	P2RY12	44	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([N+](=O)[O-])c(CO)c2)CC1	ZINC000853692244	GD	On-Demand	Bother	P2RY12	44	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc3cnccc3nc2C)CC1	ZINC000853692247	FE	On-Demand	Anodyne	P2RY12	111	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc3cnccc3nc2C)CC1	ZINC000853692248	FE	On-Demand	Anodyne	P2RY12	111	41
Cc1cc(C)c2cccc(OCc3oc(C)nc3C)c2n1	ZINC000853692272	CI	On-Demand	Anodyne	BDKRB2	84	37
COC(=O)c1cccc(NNC(=O)NCCCN2CCCCC2=O)c1C	ZINC000853692293	FD	On-Demand	Reactive	TYRO3	20	40
C#Cc1ccnn1[C@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853692305	DC	On-Demand	Mild	P2RY12	56	37
C#Cc1ccnn1[C@@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853692306	DC	On-Demand	Mild	P2RY12	56	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2CCO)CC1	ZINC000853692325	FD	On-Demand	Anodyne	P2RY12	77	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2CCO)CC1	ZINC000853692326	FD	On-Demand	Anodyne	P2RY12	77	40
C#CCOCCOc1ccc2c(c1)C(=O)NC2	ZINC000853692392	BC	On-Demand	Mild	HTR1A	15	45
C#CCOCCOc1ccc2c(c1)C(=O)NC2	ZINC000853692392	BC	On-Demand	Mild	MAOB	17	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(Cc3ccc(C)cc3)n2)CC1	ZINC000853692414	GD	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(Cc3ccc(C)cc3)n2)CC1	ZINC000853692415	GD	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)OC)c(OC)c2)CC1	ZINC000853692422	GD	On-Demand	Anodyne	HTR4	19	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)OC)c(OC)c2)CC1	ZINC000853692422	GD	On-Demand	Anodyne	P2RY12	72	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)OC)c(OC)c2)CC1	ZINC000853692423	GD	On-Demand	Anodyne	HTR4	19	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)OC)c(OC)c2)CC1	ZINC000853692423	GD	On-Demand	Anodyne	P2RY12	72	39
C#Cc1cccnc1NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000853692424	EE	On-Demand	Mild	LTA4H	20	50
C#Cc1cccnc1NCc1ccc(CN2CCC(C(N)=O)CC2)cc1	ZINC000853692424	EE	On-Demand	Mild	SIGMAR1	21	46
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)ncn2C)CC1	ZINC000853692439	DB	On-Demand	Anodyne	P2RY12	52	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)ncn2C)CC1	ZINC000853692440	DB	On-Demand	Anodyne	P2RY12	52	37
CN(C)c1ccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)cc1	ZINC000853692447	GF	On-Demand	Clean	EPHX2	36	41
CON(C)CCNC(=O)NCCOc1ccc(F)c(F)c1	ZINC000853692455	DD	On-Demand	Anodyne	MTNR1A	31	41
CON(C)CCNC(=O)NCCOc1ccc(F)c(F)c1	ZINC000853692455	DD	On-Demand	Anodyne	MTNR1B	20	41
Fc1ccc(N2CC[C@@H](Nc3cc(F)ncn3)C2)cc1	ZINC000853692460	CE	On-Demand	Anodyne	HRH4	27	46
Fc1ccc(N2CC[C@H](Nc3cc(F)ncn3)C2)cc1	ZINC000853692462	CE	On-Demand	Anodyne	HRH4	27	46
COc1cccc(SCCONC(=N)CNC(=O)OC(C)(C)C)c1	ZINC000853692495	FF	On-Demand	Anodyne	MTNR1A	28	54
COc1cccc(SCCONC(=N)CNC(=O)OC(C)(C)C)c1	ZINC000853692495	FF	On-Demand	Anodyne	MTNR1B	29	54
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(C#N)ncn2)CC1	ZINC000853692497	ED	On-Demand	Mild	SIRT3	40	41
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(C#N)ncn2)CC1	ZINC000853692497	ED	On-Demand	Mild	SIRT2	29	41
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(C#N)ncn2)CC1	ZINC000853692497	ED	On-Demand	Mild	SIRT1	24	41
Cc1nonc1COc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853692511	EH	On-Demand	Anodyne	ACACB	21	42
Cc1nonc1COc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853692512	EH	On-Demand	Anodyne	ACACB	21	42
COC[C@@H](COc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1)OC	ZINC000853692531	EG	On-Demand	Anodyne	ACACA	22	42
COC[C@@H](COc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1)OC	ZINC000853692531	EG	On-Demand	Anodyne	ACACB	23	42
COC[C@@H](COc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)OC	ZINC000853692533	EG	On-Demand	Anodyne	ACACA	22	42
COC[C@@H](COc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)OC	ZINC000853692533	EG	On-Demand	Anodyne	ACACB	23	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)c(C)c2)CC1	ZINC000853692561	ED	On-Demand	Mild	P2RY12	73	39
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)N[C@H]2CCN(c3ccccc3)C2)C1	ZINC000853692563	GF	On-Demand	Anodyne	GPR119	16	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)c(C)c2)CC1	ZINC000853692564	ED	On-Demand	Mild	P2RY12	73	39
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)N[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000853692566	GF	On-Demand	Anodyne	GPR119	16	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)N[C@@H]2CCN(c3ccccc3)C2)C1	ZINC000853692567	GF	On-Demand	Anodyne	GPR119	16	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)N[C@H]2CCN(c3ccccc3)C2)C1	ZINC000853692569	GF	On-Demand	Anodyne	GPR119	16	41
COC(=O)c1[nH]ccc1OCc1nonc1C	ZINC000853692590	BD	On-Demand	Anodyne	CACNA1D	20	51
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCOC(F)F)cc1	ZINC000853692603	EH	On-Demand	Anodyne	ACACA	24	44
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCOC(F)F)cc1	ZINC000853692603	EH	On-Demand	Anodyne	ACACB	24	44
CC(C)(C)OC(=O)NCC1(O)CCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853692613	GG	On-Demand	Anodyne	HTR3A	34	45
COC(=O)C1(COc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)CC1	ZINC000853692631	EH	On-Demand	Anodyne	ACACA	23	40
COC(=O)C1(COc2ccc([C@@H](C)NC(=O)OC(C)(C)C)cc2)CC1	ZINC000853692631	EH	On-Demand	Anodyne	ACACB	24	40
COC(=O)C1(COc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)CC1	ZINC000853692632	EH	On-Demand	Anodyne	ACACA	23	40
COC(=O)C1(COc2ccc([C@H](C)NC(=O)OC(C)(C)C)cc2)CC1	ZINC000853692632	EH	On-Demand	Anodyne	ACACB	24	40
COC(=O)c1sc2nc(C)nc(NCc3ccnc(Cl)c3)c2c1C	ZINC000853692646	FH	On-Demand	Anodyne	CHRM4	20	42
C=CCN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853692655	DE	On-Demand	Reactive	CCR3	35	41
C=CCN1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853692655	DE	On-Demand	Reactive	MCHR1	18	43
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	ADORA1	176	77
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	SLC29A1	149	73
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	ADORA2A	64	73
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	ADORA2B	21	58
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	ADK	67	53
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	AHCY	48	38
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	P2RX4	35	42
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	P2RX1	46	40
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	P2RY1	33	42
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	AMD1	16	40
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	ADORA3	190	77
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	OXGR1	115	39
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	RNASE1	43	33
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	DNMT3B	83	51
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	Q4VQ11_PIG	83	58
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	GPR17	61	43
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	HSPA5	75	51
OC[C@H]1O[C@@H](n2cnc3c(NCc4ccnc(Cl)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853692666	GC	On-Demand	Anodyne	DOT1L	91	47
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)nc2CC)CC1	ZINC000853692700	EE	On-Demand	Anodyne	P2RY12	106	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)nc2CC)CC1	ZINC000853692701	EE	On-Demand	Anodyne	P2RY12	106	39
O=C(NCCOc1ccccc1C(F)(F)F)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853692710	GH	On-Demand	Anodyne	RBP4	88	40
O=C(NCCOc1ccccc1C(F)(F)F)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853692711	GH	On-Demand	Anodyne	RBP4	88	40
O=C(NCCOc1ccccc1C(F)(F)F)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853692712	GH	On-Demand	Anodyne	RBP4	88	40
O=C(NCCOc1ccccc1C(F)(F)F)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853692713	GH	On-Demand	Anodyne	RBP4	88	40
CC(C)(C)OC(=O)N1CC(CCO)(Nc2cnccn2)C1	ZINC000853692717	CD	On-Demand	Anodyne	GPR119	18	43
CCCC[C@@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692718	EG	On-Demand	Anodyne	P2RY12	86	35
CCCC[C@@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692718	EG	On-Demand	Anodyne	CTSG	23	40
CCCC[C@@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692718	EG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692718	EG	On-Demand	Anodyne	CTRB1	32	40
CCCC[C@@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692718	EG	On-Demand	Anodyne	CELA2A	22	40
CCCC[C@@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692719	EG	On-Demand	Anodyne	P2RY12	86	35
CCCC[C@@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692719	EG	On-Demand	Anodyne	CTSG	23	40
CCCC[C@@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692719	EG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692719	EG	On-Demand	Anodyne	CTRB1	32	40
CCCC[C@@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692719	EG	On-Demand	Anodyne	CELA2A	22	40
CCCC[C@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692720	EG	On-Demand	Anodyne	P2RY12	86	35
CCCC[C@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692720	EG	On-Demand	Anodyne	CTSG	23	40
CCCC[C@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692720	EG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692720	EG	On-Demand	Anodyne	CTRB1	32	40
CCCC[C@H](CC)C(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692720	EG	On-Demand	Anodyne	CELA2A	22	40
CCCC[C@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692721	EG	On-Demand	Anodyne	P2RY12	86	35
CCCC[C@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692721	EG	On-Demand	Anodyne	CTSG	23	40
CCCC[C@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692721	EG	On-Demand	Anodyne	CTSK	22	40
CCCC[C@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692721	EG	On-Demand	Anodyne	CTRB1	32	40
CCCC[C@H](CC)C(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692721	EG	On-Demand	Anodyne	CELA2A	22	40
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3c(c2)C(=O)NC3)C1	ZINC000853692743	ED	On-Demand	Anodyne	GPR119	26	50
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3c(c2)C(=O)NC3)C1	ZINC000853692744	ED	On-Demand	Anodyne	GPR119	26	50
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-c3ncnn3C)cc2)CC1	ZINC000853692746	GD	On-Demand	Anodyne	P2RY12	64	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-c3ncnn3C)cc2)CC1	ZINC000853692747	GD	On-Demand	Anodyne	P2RY12	64	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000853692754	GD	On-Demand	Bother	P2RY12	40	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC)c([N+](=O)[O-])c2)CC1	ZINC000853692755	GD	On-Demand	Bother	P2RY12	40	37
CON(C)CCNC(=O)NCCOc1ccccc1C(F)(F)F	ZINC000853692758	ED	On-Demand	Anodyne	RBP4	19	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(N(C)C)cc2)CC1	ZINC000853692777	ED	On-Demand	Clean	P2RY12	57	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(N(C)C)cc2)CC1	ZINC000853692778	ED	On-Demand	Clean	P2RY12	57	42
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(-c3nccs3)n2)CC1	ZINC000853692800	GG	On-Demand	Anodyne	DRD4	17	46
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(-c3nccs3)n2)CC1	ZINC000853692800	GG	On-Demand	Anodyne	SIGMAR1	17	45
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc(-c3nccs3)n2)CC1	ZINC000853692800	GG	On-Demand	Anodyne	SSTR5	40	34
COC(=O)C1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853692836	GG	On-Demand	Anodyne	SLC6A3	16	45
COC(=O)C1CCC(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853692836	GG	On-Demand	Anodyne	EPHX2	17	43
C#CCOCCOc1ccc(-c2c(C)noc2C)cc1	ZINC000853692837	CF	On-Demand	Mild	BRD4	30	44
COC(=O)C1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853692838	GG	On-Demand	Anodyne	SLC6A3	16	45
COC(=O)C1CCC(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000853692838	GG	On-Demand	Anodyne	EPHX2	17	43
CON(C)CCNC(=O)NCCn1c(=O)oc2ccccc21	ZINC000853692839	DC	On-Demand	Anodyne	TSPO	17	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C#N)cc(OC)c2)CC1	ZINC000853692853	FD	On-Demand	Mild	P2RY12	40	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C#N)cc(OC)c2)CC1	ZINC000853692854	FD	On-Demand	Mild	P2RY12	40	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3ncnn3C)c2)CC1	ZINC000853692855	GD	On-Demand	Anodyne	P2RY12	163	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3ncnn3C)c2)CC1	ZINC000853692856	GD	On-Demand	Anodyne	P2RY12	163	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCC2SCCS2)cc1	ZINC000853692860	FJ	On-Demand	Anodyne	ACACA	26	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCC2SCCS2)cc1	ZINC000853692860	FJ	On-Demand	Anodyne	ACACB	26	43
CN(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853692869	CG	On-Demand	Clean	MAOB	20	41
CN(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853692869	CG	On-Demand	Clean	LTA4H	54	49
CN(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853692869	CG	On-Demand	Clean	ESRRG	46	35
CN(C)c1ccc(OCCOCc2ccccc2)cc1	ZINC000853692869	CG	On-Demand	Clean	TAAR1	15	48
O=C(NCc1cccc(OCCC2SCCS2)c1)Nc1ccccc1	ZINC000853692898	FJ	On-Demand	Anodyne	ADRB1	28	40
O=C(NCc1cccc(OCCC2SCCS2)c1)Nc1ccccc1	ZINC000853692898	FJ	On-Demand	Anodyne	HRH2	46	52
O=C(NCc1cccc(OCCC2SCCS2)c1)Nc1ccccc1	ZINC000853692898	FJ	On-Demand	Anodyne	ROCK2	28	46
O=C(NCc1cccc(OCCC2SCCS2)c1)Nc1ccccc1	ZINC000853692898	FJ	On-Demand	Anodyne	EPHX2	43	43
O=C(NCc1cccc(OCCC2SCCS2)c1)Nc1ccccc1	ZINC000853692898	FJ	On-Demand	Anodyne	NAMPT	42	44
O=C(NCc1cccc(OCCC2SCCS2)c1)Nc1ccccc1	ZINC000853692898	FJ	On-Demand	Anodyne	PDS	55	40
Fc1cnc(NC2CCN(Cc3cccc(Br)c3)CC2)cn1	ZINC000853692905	FG	On-Demand	Anodyne	DRD4	17	47
Fc1cnc(NC2CCN(Cc3cccc(Br)c3)CC2)cn1	ZINC000853692905	FG	On-Demand	Anodyne	SIGMAR1	24	51
Fc1cnc(NC2CCN(Cc3cccc(Br)c3)CC2)cn1	ZINC000853692905	FG	On-Demand	Anodyne	SSTR5	72	39
O=C(NCCCN1CCCCC1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853692907	ED	On-Demand	Anodyne	TYRO3	19	40
O=C(NCCCN1CCCCC1=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853692909	ED	On-Demand	Anodyne	TYRO3	19	40
O=C(NCCCN1CCCCC1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853692911	ED	On-Demand	Anodyne	TYRO3	19	40
O=C(NCCCN1CCCCC1=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853692912	ED	On-Demand	Anodyne	TYRO3	19	40
COC(=O)C1CCC(NC(=O)N2CCN(c3ccc(C)cc3C)CC2)CC1	ZINC000853692917	FF	On-Demand	Anodyne	EPHX2	19	41
CC(C)(C)OC(=O)NCC(=N)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692942	GE	On-Demand	Anodyne	SFRP1	49	36
CC(C)(C)OC(=O)NCC(=N)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853692943	GE	On-Demand	Anodyne	SFRP1	49	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853692952	GF	On-Demand	Anodyne	GPR119	20	47
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853692954	GF	On-Demand	Anodyne	GPR119	20	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc[nH]c2C(=O)OC)CC1	ZINC000853692977	FC	On-Demand	Anodyne	P2RY12	41	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc[nH]c2C(=O)OC)CC1	ZINC000853692979	FC	On-Demand	Anodyne	P2RY12	41	39
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N(C)C)cc2)CC1	ZINC000853692998	GG	On-Demand	Clean	DRD4	20	54
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N(C)C)cc2)CC1	ZINC000853692998	GG	On-Demand	Clean	LTA4H	20	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N(C)C)cc2)CC1	ZINC000853692998	GG	On-Demand	Clean	SIGMAR1	24	49
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N(C)C)cc2)CC1	ZINC000853692998	GG	On-Demand	Clean	SSTR5	41	36
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N(C)C)cc2)CC1	ZINC000853692998	GG	On-Demand	Clean	CCR3	19	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N(C)C)cc2)CC1	ZINC000853692998	GG	On-Demand	Clean	SLC6A5	30	40
Cc1ccccc1CN1CCC(NC(=O)COc2ccc(N(C)C)cc2)CC1	ZINC000853692998	GG	On-Demand	Clean	MCHR1	34	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(-c3cnn(C)c3)ccc2=O)CC1	ZINC000853693035	GC	On-Demand	Anodyne	P2RY12	122	38
Cc1cc(OCCC2SCCS2)c2ccccc2n1	ZINC000853693037	CI	On-Demand	Anodyne	HTR1D	19	40
Cc1cc(OCCC2SCCS2)c2ccccc2n1	ZINC000853693037	CI	On-Demand	Anodyne	HTR1B	17	40
Cc1cc(OCCC2SCCS2)c2ccccc2n1	ZINC000853693037	CI	On-Demand	Anodyne	ADAM17	51	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(-c3cnn(C)c3)ccc2=O)CC1	ZINC000853693038	GC	On-Demand	Anodyne	P2RY12	122	38
Fc1cc(NC2CCN(Cc3cccc(Br)c3)CC2)ncn1	ZINC000853693050	FG	On-Demand	Anodyne	DRD4	17	49
Fc1cc(NC2CCN(Cc3cccc(Br)c3)CC2)ncn1	ZINC000853693050	FG	On-Demand	Anodyne	SIGMAR1	25	51
Fc1cc(NC2CCN(Cc3cccc(Br)c3)CC2)ncn1	ZINC000853693050	FG	On-Demand	Anodyne	SSTR5	68	39
Fc1cc(NC2CCN(Cc3cccc(Br)c3)CC2)ncn1	ZINC000853693050	FG	On-Demand	Anodyne	CCR3	17	42
Fc1cc(NC2CCN(Cc3cccc(Br)c3)CC2)ncn1	ZINC000853693050	FG	On-Demand	Anodyne	SCN5A	65	33
COCCCNC(=O)[C@H](C)OC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000853693083	ID	On-Demand	Anodyne	KCNA3	15	41
COCCCNC(=O)[C@@H](C)OC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1	ZINC000853693086	ID	On-Demand	Anodyne	KCNA3	15	41
CC(C)(C)OC(=O)NCC1(O)CCN(c2nccnc2OC2CCC2)CC1	ZINC000853693090	GE	On-Demand	Anodyne	SIRT3	36	41
CC(C)(C)OC(=O)NCC1(O)CCN(c2nccnc2OC2CCC2)CC1	ZINC000853693090	GE	On-Demand	Anodyne	SIRT2	33	41
CC(C)(C)OC(=O)NCC1(O)CCN(c2nccnc2OC2CCC2)CC1	ZINC000853693090	GE	On-Demand	Anodyne	SIRT1	33	41
Cn1nccc1-c1cc(F)ccc1OCCCCC1(C)OCCO1	ZINC000853693100	EH	On-Demand	Anodyne	HTR2A	25	47
COc1cccc(SCCn2ccnc2C(C)=O)c1	ZINC000853693134	CF	On-Demand	Anodyne	MTNR1A	21	52
COc1cccc(SCCn2ccnc2C(C)=O)c1	ZINC000853693134	CF	On-Demand	Anodyne	MTNR1B	24	52
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCc2cncn2C)cc1	ZINC000853693140	EH	On-Demand	Anodyne	ACACA	20	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCc2cncn2C)cc1	ZINC000853693140	EH	On-Demand	Anodyne	ACACB	21	41
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(Nc3ccccc3)ncn2)CC1	ZINC000853693149	GG	On-Demand	Anodyne	HCN1	42	30
CN(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693155	DG	On-Demand	Clean	AVPR1A	15	45
CN(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693155	DG	On-Demand	Clean	GRIN2B	38	42
CN(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693155	DG	On-Demand	Clean	SIGMAR1	16	45
CN(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693155	DG	On-Demand	Clean	CHEK2	20	46
CN(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693155	DG	On-Demand	Clean	SLC18A3	17	44
CN(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693155	DG	On-Demand	Clean	SMO	37	46
CN(C)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693155	DG	On-Demand	Clean	L3MBTL3	47	34
CN(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693157	DG	On-Demand	Clean	AVPR1A	15	45
CN(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693157	DG	On-Demand	Clean	GRIN2B	38	42
CN(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693157	DG	On-Demand	Clean	SIGMAR1	16	45
CN(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693157	DG	On-Demand	Clean	CHEK2	20	46
CN(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693157	DG	On-Demand	Clean	SLC18A3	17	44
CN(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693157	DG	On-Demand	Clean	SMO	37	46
CN(C)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853693157	DG	On-Demand	Clean	L3MBTL3	47	34
COC[C@@H](COc1cc(/C=C/C(=O)OC)ccc1OC)OC	ZINC000853693173	DD	On-Demand	Anodyne	APP	19	41
COC[C@@H](COc1cc(/C=C/C(=O)OC)ccc1OC)OC	ZINC000853693173	DD	On-Demand	Anodyne	NR1H4	46	42
COC[C@@H](COc1cc(/C=C/C(=O)OC)ccc1OC)OC	ZINC000853693173	DD	On-Demand	Anodyne	TUBB1	57	39
COC[C@@H](COc1cc(/C=C/C(=O)OC)ccc1OC)OC	ZINC000853693173	DD	On-Demand	Anodyne	AKR1C3	21	40
COC[C@@H](COc1cc(/C=C\C(=O)OC)ccc1OC)OC	ZINC000853693182	DD	On-Demand	Anodyne	APP	19	41
COC[C@@H](COc1cc(/C=C\C(=O)OC)ccc1OC)OC	ZINC000853693182	DD	On-Demand	Anodyne	NR1H4	46	42
COC[C@@H](COc1cc(/C=C\C(=O)OC)ccc1OC)OC	ZINC000853693182	DD	On-Demand	Anodyne	TUBB1	57	39
COC[C@@H](COc1cc(/C=C\C(=O)OC)ccc1OC)OC	ZINC000853693182	DD	On-Demand	Anodyne	AKR1C3	21	40
CO[C@@H](COc1cccc2c(C)cc(C)nc12)[C@@H]1CCOC1	ZINC000853693183	DG	On-Demand	Anodyne	BDKRB2	79	35
CO[C@@H](COc1cccc2c(C)cc(C)nc12)[C@H]1CCOC1	ZINC000853693188	DG	On-Demand	Anodyne	BDKRB2	79	35
COC(=O)/C=C\c1ccc(OC)c(OCC2(C(=O)OC)CC2)c1	ZINC000853693193	DE	On-Demand	Anodyne	NR1H4	42	35
COC(=O)/C=C\c1ccc(OC)c(OCC2(C(=O)OC)CC2)c1	ZINC000853693193	DE	On-Demand	Anodyne	TUBB1	48	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc(C(F)(F)F)c2)CC1	ZINC000853693210	GE	On-Demand	Anodyne	P2RY12	78	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc(C(F)(F)F)c2)CC1	ZINC000853693212	GE	On-Demand	Anodyne	P2RY12	78	37
COC(=O)C1CCC(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853693223	GE	On-Demand	Anodyne	EPHX2	15	46
COC(=O)C1CCC(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853693226	GE	On-Demand	Anodyne	EPHX2	15	46
CN(CCO[Si](C)(C)C(C)(C)C)c1ncnc2[nH]ccc12	ZINC000853693232	DG	On-Demand	Reactive	JAK3	22	45
COC(=O)/C=C\c1ccc(OC)c(OC[C@H](OC)C2CCCC2)c1	ZINC000853693236	EG	On-Demand	Anodyne	NR1H4	51	42
COC(=O)/C=C\c1ccc(OC)c(OC[C@H](OC)C2CCCC2)c1	ZINC000853693236	EG	On-Demand	Anodyne	TUBB1	42	36
COC(=O)/C=C\c1ccc(OC)c(OC[C@H](OC)C2CCCC2)c1	ZINC000853693236	EG	On-Demand	Anodyne	ACKR3	48	35
COC(=O)/C=C\c1ccc(OC)c(OC[C@@H](OC)C2CCCC2)c1	ZINC000853693238	EG	On-Demand	Anodyne	NR1H4	51	42
COC(=O)/C=C\c1ccc(OC)c(OC[C@@H](OC)C2CCCC2)c1	ZINC000853693238	EG	On-Demand	Anodyne	TUBB1	42	36
COC(=O)/C=C\c1ccc(OC)c(OC[C@@H](OC)C2CCCC2)c1	ZINC000853693238	EG	On-Demand	Anodyne	ACKR3	48	35
C=C(Cl)COc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853693346	GF	On-Demand	Mild	GABRA1	35	72
C=C(Cl)COc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853693346	GF	On-Demand	Mild	GABRA4	45	69
C=C(Cl)COc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853693346	GF	On-Demand	Mild	GABRA5	82	72
C=C(Cl)COc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853693346	GF	On-Demand	Mild	GABRA3	41	69
C=C(Cl)COc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853693346	GF	On-Demand	Mild	GABRA2	36	69
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnn(CC)c2)CC1	ZINC000853693379	DC	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnn(CC)c2)CC1	ZINC000853693380	DC	On-Demand	Anodyne	P2RY12	42	35
C#CCOCCOc1cccc2c(C)cc(C)nc12	ZINC000853693411	CF	On-Demand	Mild	BDKRB2	59	30
CC(C)(C)OC(=O)NCC1(O)CCN(c2ncccn2)CC1	ZINC000853693420	DD	On-Demand	Anodyne	SIRT3	43	42
CC(C)(C)OC(=O)NCC1(O)CCN(c2ncccn2)CC1	ZINC000853693420	DD	On-Demand	Anodyne	SIRT2	33	42
CC(C)(C)OC(=O)NCC1(O)CCN(c2ncccn2)CC1	ZINC000853693420	DD	On-Demand	Anodyne	SIRT1	29	42
COC(=O)/C=C\c1ccc(OC)c(OCC2(CC#N)CC2)c1	ZINC000853693439	DF	On-Demand	Mild	NR1H4	42	35
COC(=O)/C=C\c1ccc(OC)c(OCC2(CC#N)CC2)c1	ZINC000853693439	DF	On-Demand	Mild	TUBB1	41	36
CCCOc1cccc(CONC(=N)CNC(=O)OC(C)(C)C)c1	ZINC000853693465	EF	On-Demand	Anodyne	HRH2	28	44
CCCOc1cccc(CONC(=N)CNC(=O)OC(C)(C)C)c1	ZINC000853693465	EF	On-Demand	Anodyne	PDS	49	36
Fc1ccc(N2CC[C@@H](Nc3cnc(F)cn3)C2)cc1	ZINC000853693476	CE	On-Demand	Anodyne	HRH4	23	42
Fc1ccc(N2CC[C@H](Nc3cnc(F)cn3)C2)cc1	ZINC000853693478	CE	On-Demand	Anodyne	HRH4	23	42
Cc1cc(C)c2cccc(OCCc3cncn3C)c2n1	ZINC000853693481	CG	On-Demand	Anodyne	BDKRB2	45	42
O[C@@H](CNc1nc(C(F)(F)F)nc2ccccc12)CN1CCCCC1	ZINC000853693497	FF	On-Demand	Anodyne	HNMT	62	37
C#CCOCCOc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853693500	DG	On-Demand	Mild	ACACA	27	45
C#CCOCCOc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853693500	DG	On-Demand	Mild	ACACB	26	45
C#CCOCCOc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853693502	DG	On-Demand	Mild	ACACA	27	45
C#CCOCCOc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853693502	DG	On-Demand	Mild	ACACB	26	45
CON(C)CCNC(=O)NCCc1ccc(OCC(C)C)cc1	ZINC000853693552	DE	On-Demand	Anodyne	ADRB1	42	43
C#Cc1ccnn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853693553	ED	On-Demand	Mild	DRD4	21	52
C#Cc1ccnn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853693553	ED	On-Demand	Mild	SIGMAR1	19	48
C#Cc1ccnn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853693553	ED	On-Demand	Mild	MCHR1	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3nccs3)n2)CC1	ZINC000853693622	FD	On-Demand	Anodyne	P2RY12	54	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3nccs3)n2)CC1	ZINC000853693623	FD	On-Demand	Anodyne	P2RY12	54	36
Cc1cc(C)c2cccc(OCCOC(F)F)c2n1	ZINC000853693659	CG	On-Demand	Anodyne	BDKRB2	66	31
CC(=O)c1nccn1CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853693693	FD	On-Demand	Anodyne	EPHX2	23	41
CC[C@H](O)c1nccn1CC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853693694	GE	On-Demand	Anodyne	EPHX2	17	40
CC[C@H](C)N(CC)C(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000853693711	FG	On-Demand	Clean	NPY2R	83	39
Cn1nccc1-c1cc(F)ccc1OCCC1SCCS1	ZINC000853693715	DH	On-Demand	Anodyne	HTR2A	24	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2C(C)=O)CC1	ZINC000853693729	DC	On-Demand	Anodyne	P2RY12	52	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2C(C)=O)CC1	ZINC000853693743	DC	On-Demand	Anodyne	P2RY12	52	36
C[C@H](O)c1nnnn1CCOCc1ccccc1	ZINC000853693745	BC	On-Demand	Anodyne	GHSR	38	46
C[C@@H](O)c1nnnn1CCOCc1ccccc1	ZINC000853693746	BC	On-Demand	Anodyne	GHSR	38	46
O=C(NCCCN1CCCCC1=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853693752	GF	On-Demand	Reactive	HRP1_PLAFA	41	36
O=C(NCCCN1CCCCC1=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853693752	GF	On-Demand	Reactive	TYRO3	20	42
Cc1cc(C(F)(F)F)ccc1OCCOC(F)F	ZINC000853693767	CH	On-Demand	Anodyne	PPARD	59	42
Cc1ccccc1CN1CCC(NC(=O)Cn2nnnc2[C@H](C)O)CC1	ZINC000853693829	FC	On-Demand	Anodyne	SIGMAR1	16	46
Cc1ccccc1CN1CCC(NC(=O)Cn2nnnc2[C@@H](C)O)CC1	ZINC000853693831	FC	On-Demand	Anodyne	SIGMAR1	16	46
CC[C@H](O)c1nccn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853693867	FE	On-Demand	Anodyne	SIGMAR1	16	45
CC[C@H](O)c1nccn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853693867	FE	On-Demand	Anodyne	SSTR5	48	37
Cc1cc(C)c2cccc(OCc3nonc3C)c2n1	ZINC000853693870	CG	On-Demand	Anodyne	BDKRB2	90	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnccc2-c2ccccc2)CC1	ZINC000853693883	GF	On-Demand	Anodyne	P2RY12	216	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnccc2-c2ccccc2)CC1	ZINC000853693885	GF	On-Demand	Anodyne	P2RY12	216	47
CC[C@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@H]1CC1(C)C	ZINC000853693909	EH	On-Demand	Anodyne	ABCC8	44	33
CC[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@@H]1CC1(C)C	ZINC000853693913	EH	On-Demand	Anodyne	ABCC8	44	33
CC[C@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@@H]1CC1(C)C	ZINC000853693923	EH	On-Demand	Anodyne	ABCC8	44	33
CC[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)[C@H]1CC1(C)C	ZINC000853693929	EH	On-Demand	Anodyne	ABCC8	44	33
CCOC(=O)N1CCN(C(=O)[C@H](C)ON=Cc2cc(OC)cc(OC)c2)CC1	ZINC000853693941	GD	On-Demand	Mild	P2RY12	35	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)ON=Cc2cc(OC)cc(OC)c2)CC1	ZINC000853693944	GD	On-Demand	Mild	P2RY12	35	40
C#CCOCCOc1ccc(F)cc1-c1ccnn1C	ZINC000853693956	CE	On-Demand	Mild	HTR2A	23	48
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCC2(O)CCC2)cc1	ZINC000853693970	EH	On-Demand	Anodyne	ACACA	23	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCC2(O)CCC2)cc1	ZINC000853693970	EH	On-Demand	Anodyne	ACACB	24	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C#N)c(OC)c2)CC1	ZINC000853694007	FD	On-Demand	Mild	P2RY12	61	39
C#Cc1ccnn1C[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853694008	CE	On-Demand	Mild	L3MBTL3	57	36
C#Cc1ccnn1C[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853694009	CE	On-Demand	Mild	L3MBTL3	57	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C#N)c(OC)c2)CC1	ZINC000853694010	FD	On-Demand	Mild	P2RY12	61	39
COC(=O)/C=C\c1ccc(OC)c(OCCCCC2(C)OCCO2)c1	ZINC000853694014	FG	On-Demand	Anodyne	APP	18	40
COC(=O)/C=C\c1ccc(OC)c(OCCCCC2(C)OCCO2)c1	ZINC000853694014	FG	On-Demand	Anodyne	TUBB1	41	36
Cn1nccc1-c1ccccc1OCCC1SCCS1	ZINC000853694026	DH	On-Demand	Anodyne	HTR2A	18	40
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(F)ncn2)CC1	ZINC000853694027	ED	On-Demand	Anodyne	SIRT3	51	42
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(F)ncn2)CC1	ZINC000853694027	ED	On-Demand	Anodyne	SIRT2	41	42
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(F)ncn2)CC1	ZINC000853694027	ED	On-Demand	Anodyne	SIRT1	38	42
Cc1nonc1COc1ccc(-c2c(C)noc2C)cc1	ZINC000853694032	CG	On-Demand	Anodyne	BRD4	34	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)cc2OC(C)C)CC1	ZINC000853694072	GF	On-Demand	Anodyne	P2RY12	41	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)cc2OC(C)C)CC1	ZINC000853694073	GF	On-Demand	Anodyne	P2RY12	41	37
C=C(Cl)COc1cccc(CCOC)c1	ZINC000853694077	BG	On-Demand	Mild	CRTM	47	33
CC(C)(C)OC(=O)N1CCC(Cn2cc(C(=O)c3ccc(F)cc3)nn2)CC1	ZINC000853694101	GG	On-Demand	Anodyne	GPR119	50	45
CCCN(Cc1ccc(F)cc1[N+](=O)[O-])S(=O)(=O)C(F)(F)F	ZINC000853694113	EF	On-Demand	Bother	COLA	75	42
Cn1nnc2c(N3CCC(O)(CNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853694127	FC	On-Demand	Anodyne	SIRT3	83	47
Cn1nnc2c(N3CCC(O)(CNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853694127	FC	On-Demand	Anodyne	SIRT2	72	47
Cn1nnc2c(N3CCC(O)(CNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853694127	FC	On-Demand	Anodyne	SIRT1	63	47
COC(=O)C1CCC(NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853694131	GG	On-Demand	Reactive	LCK	23	47
COC(=O)C1CCC(NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853694131	GG	On-Demand	Reactive	CSNK1D	40	43
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCOc2ccc(F)c(F)c2)C1	ZINC000853694169	GE	On-Demand	Anodyne	CHRNA10	21	42
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCOc2ccc(F)c(F)c2)C1	ZINC000853694173	GE	On-Demand	Anodyne	CHRNA10	21	42
CC(C)(C)OC(=O)N1CCO[C@H](COc2cnccc2-c2ccccc2)C1	ZINC000853694178	FH	On-Demand	Anodyne	GPR119	34	44
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cnccc2-c2ccccc2)C1	ZINC000853694180	FH	On-Demand	Anodyne	GPR119	34	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)nc3ccccc23)CC1	ZINC000853694219	FF	On-Demand	Anodyne	P2RY12	198	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)nc3ccccc23)CC1	ZINC000853694219	FF	On-Demand	Anodyne	ADAM17	83	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)nc3ccccc23)CC1	ZINC000853694224	FF	On-Demand	Anodyne	P2RY12	198	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)nc3ccccc23)CC1	ZINC000853694224	FF	On-Demand	Anodyne	ADAM17	83	42
CC[C@@H](O)CNC(=O)NCc1ccc(N2CCN(CC)CC2)c(F)c1	ZINC000853694256	FD	On-Demand	Clean	NPY2R	82	37
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	MAOA	30	44
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	MAOB	76	45
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	MTNR1A	19	40
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	MTNR1B	17	41
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	ABCB1	19	46
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	ACR	15	40
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	TAAR1	22	57
COCCc1cccc(OCc2ccc(OC)cc2)c1	ZINC000853694295	CG	On-Demand	Anodyne	FFAR1	45	48
Cn1nccc1-c1cc(F)ccc1OC[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853694296	GG	On-Demand	Anodyne	HTR2A	23	42
Cn1nccc1-c1cc(F)ccc1OC[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853694299	GG	On-Demand	Anodyne	HTR2A	23	42
CCCN(C[C@@H]1CCN(C(=O)c2ccccc2)C1)S(=O)(=O)C(F)(F)F	ZINC000853694318	GF	On-Demand	Anodyne	SFRP1	81	39
CCCN(C[C@@H]1CCN(C(=O)c2ccccc2)C1)S(=O)(=O)C(F)(F)F	ZINC000853694318	GF	On-Demand	Anodyne	WNT3	44	34
CCCN(C[C@H]1CCN(C(=O)c2ccccc2)C1)S(=O)(=O)C(F)(F)F	ZINC000853694319	GF	On-Demand	Anodyne	SFRP1	81	39
CCCN(C[C@H]1CCN(C(=O)c2ccccc2)C1)S(=O)(=O)C(F)(F)F	ZINC000853694319	GF	On-Demand	Anodyne	WNT3	44	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2-c2ccnn2C)CC1	ZINC000853694365	GE	On-Demand	Anodyne	P2RY12	63	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2-c2ccnn2C)CC1	ZINC000853694368	GE	On-Demand	Anodyne	P2RY12	63	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2C(=O)c2ccccn2)CC1	ZINC000853694388	GD	On-Demand	Anodyne	P2RY12	109	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2C(=O)c2ccccn2)CC1	ZINC000853694392	GD	On-Demand	Anodyne	P2RY12	109	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCc2cncs2)cc1	ZINC000853694414	EI	On-Demand	Anodyne	CYP3A4	43	39
Cn1nccc1-c1ccccc1OCCOC(F)F	ZINC000853694427	CF	On-Demand	Anodyne	HTR2A	17	40
COC(=O)C1CCC(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)CC1	ZINC000853694430	GE	On-Demand	Clean	EPHX2	24	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)CC(=O)N3C)CC1	ZINC000853694447	GD	On-Demand	Anodyne	P2RY12	96	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)CC(=O)N3C)CC1	ZINC000853694448	GD	On-Demand	Anodyne	P2RY12	96	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2C(=O)c2ccccc2)CC1	ZINC000853694483	GD	On-Demand	Anodyne	P2RY12	151	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2C(=O)c2ccccc2)CC1	ZINC000853694485	GD	On-Demand	Anodyne	P2RY12	151	42
O[C@@H](CNc1nc(-c2cccnc2)nc2ccccc12)CN1CCCCC1	ZINC000853694507	FF	On-Demand	Anodyne	HNMT	56	36
Cn1nccc1-c1cc(F)ccc1OCCOC(F)F	ZINC000853694537	CF	On-Demand	Anodyne	HTR2A	23	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)c(F)c2)CC1	ZINC000853694580	EE	On-Demand	Anodyne	P2RY12	73	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)c(F)c2)CC1	ZINC000853694582	EE	On-Demand	Anodyne	P2RY12	73	39
COC(=O)/C=C\c1ccc(OC)c(OCCO[C@@H]2CC2(F)F)c1	ZINC000853694595	EF	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OC)c(OCCO[C@@H]2CC2(F)F)c1	ZINC000853694595	EF	On-Demand	Anodyne	NR1H4	45	37
COC(=O)/C=C\c1ccc(OC)c(OCCO[C@@H]2CC2(F)F)c1	ZINC000853694595	EF	On-Demand	Anodyne	TUBB1	43	37
COC(=O)/C=C\c1ccc(OC)c(OCCO[C@H]2CC2(F)F)c1	ZINC000853694597	EF	On-Demand	Anodyne	APP	19	41
COC(=O)/C=C\c1ccc(OC)c(OCCO[C@H]2CC2(F)F)c1	ZINC000853694597	EF	On-Demand	Anodyne	NR1H4	45	37
COC(=O)/C=C\c1ccc(OC)c(OCCO[C@H]2CC2(F)F)c1	ZINC000853694597	EF	On-Demand	Anodyne	TUBB1	43	37
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)Cc2cccc(F)c2)C1	ZINC000853694611	FF	On-Demand	Anodyne	GPR119	20	52
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)Cc2cccc(F)c2)C1	ZINC000853694614	FF	On-Demand	Anodyne	GPR119	20	52
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3nccs3)c2)CC1	ZINC000853694637	GF	On-Demand	Anodyne	P2RY12	152	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3nccs3)c2)CC1	ZINC000853694638	GF	On-Demand	Anodyne	P2RY12	152	40
CC(C)(C)OC(=O)NCC(=N)NOCCOCc1ccccc1	ZINC000853694659	DE	On-Demand	Anodyne	CTSK	18	47
CC(C)(C)OC(=O)NCC(=N)NOCCOCc1ccccc1	ZINC000853694659	DE	On-Demand	Anodyne	CAPN2	51	32
CC(C)(C)OC(=O)NCC(=N)NOCCOCc1ccccc1	ZINC000853694659	DE	On-Demand	Anodyne	NPR	58	35
CCCN(Cc1ccc(OC)cc1)S(=O)(=O)C(F)(F)F	ZINC000853694712	DF	On-Demand	Anodyne	BMP1	41	41
CCCN(Cc1ccc(OC)cc1)S(=O)(=O)C(F)(F)F	ZINC000853694712	DF	On-Demand	Anodyne	MMP3	17	46
CCCN(Cc1ccc(OC)cc1)S(=O)(=O)C(F)(F)F	ZINC000853694712	DF	On-Demand	Anodyne	MMP9	22	42
CCCN(Cc1ccc(OC)cc1)S(=O)(=O)C(F)(F)F	ZINC000853694712	DF	On-Demand	Anodyne	MMP1	21	41
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853694715	FF	On-Demand	Anodyne	SIRT3	51	42
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853694715	FF	On-Demand	Anodyne	SIRT2	41	42
CC(C)(C)OC(=O)NCC1(O)CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853694715	FF	On-Demand	Anodyne	SIRT1	38	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCO[C@@H]2CC2(F)F)cc1	ZINC000853694734	FI	On-Demand	Anodyne	ACACA	20	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCO[C@@H]2CC2(F)F)cc1	ZINC000853694734	FI	On-Demand	Anodyne	ACACB	21	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCO[C@H]2CC2(F)F)cc1	ZINC000853694735	FI	On-Demand	Anodyne	ACACA	20	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(OCCO[C@H]2CC2(F)F)cc1	ZINC000853694735	FI	On-Demand	Anodyne	ACACB	21	43
COC(=O)C1CCC(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1	ZINC000853694741	GE	On-Demand	Clean	MTNR1A	20	48
COC(=O)C1CCC(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1	ZINC000853694741	GE	On-Demand	Clean	MTNR1B	20	48
COC(=O)C1CCC(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)CC1	ZINC000853694741	GE	On-Demand	Clean	EPHX2	39	40
COC(=O)C1CCC(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1	ZINC000853694742	GE	On-Demand	Clean	MTNR1A	20	48
COC(=O)C1CCC(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1	ZINC000853694742	GE	On-Demand	Clean	MTNR1B	20	48
COC(=O)C1CCC(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)CC1	ZINC000853694742	GE	On-Demand	Clean	EPHX2	39	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C(=O)OC)cc(F)c2C)CC1	ZINC000853694772	GD	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C(=O)OC)cc(F)c2C)CC1	ZINC000853694774	GD	On-Demand	Anodyne	P2RY12	55	38
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc(C(=O)c3ccc(F)cc3)nn2)C1	ZINC000853694785	GG	On-Demand	Anodyne	GPR119	41	41
CON(C)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853694805	FE	On-Demand	Anodyne	DRD4	25	45
CON(C)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853694805	FE	On-Demand	Anodyne	ACHE	31	43
CON(C)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853694805	FE	On-Demand	Anodyne	HTR4	54	38
CON(C)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853694805	FE	On-Demand	Anodyne	SIGMAR1	31	44
CON(C)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853694805	FE	On-Demand	Anodyne	CCR3	47	42
CON(C)CCNC(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853694805	FE	On-Demand	Anodyne	CACNA1I	67	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccnc2C#N)CC1	ZINC000853694812	ED	On-Demand	Mild	P2RY12	72	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccnc2C#N)CC1	ZINC000853694815	ED	On-Demand	Mild	P2RY12	72	36
C[C@@H](O)c1nnnn1CC[C@@H]1CCCCO1	ZINC000853694826	BC	On-Demand	Anodyne	PDE8B	46	37
C[C@H](O)c1nnnn1CC[C@H]1CCCCO1	ZINC000853694828	BC	On-Demand	Anodyne	PDE8B	46	37
C[C@H](O)c1nnnn1CC[C@@H]1CCCCO1	ZINC000853694830	BC	On-Demand	Anodyne	PDE8B	46	37
C[C@@H](O)c1nnnn1CC[C@H]1CCCCO1	ZINC000853694831	BC	On-Demand	Anodyne	PDE8B	46	37
CC(=O)c1nccn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853694842	FE	On-Demand	Anodyne	DRD4	19	52
CC(=O)c1nccn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853694842	FE	On-Demand	Anodyne	SIGMAR1	18	48
CC(=O)c1nccn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853694842	FE	On-Demand	Anodyne	SSTR5	45	36
CC(=O)c1nccn1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853694842	FE	On-Demand	Anodyne	MCHR1	20	40
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000853694855	CD	On-Demand	Anodyne	DRD3	15	41
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000853694855	CD	On-Demand	Anodyne	NPY1R	17	41
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccc2)C1	ZINC000853694855	CD	On-Demand	Anodyne	EPHX2	15	43
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000853694857	CD	On-Demand	Anodyne	DRD3	15	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000853694857	CD	On-Demand	Anodyne	NPY1R	17	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccc2)C1	ZINC000853694857	CD	On-Demand	Anodyne	EPHX2	15	43
CCCOc1cccc(Cn2ccnc2C(C)=O)c1	ZINC000853694883	CF	On-Demand	Anodyne	HRH2	30	42
CCCOc1cccc(Cn2ccnc2C(C)=O)c1	ZINC000853694883	CF	On-Demand	Anodyne	UPP1	51	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nccc2C(N)=O)CC1	ZINC000853694952	DB	On-Demand	Anodyne	P2RY12	64	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nccc2C(N)=O)CC1	ZINC000853694954	DB	On-Demand	Anodyne	P2RY12	64	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccc(F)c2)CC1	ZINC000853694961	GD	On-Demand	Anodyne	P2RY12	66	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccc(F)c2)CC1	ZINC000853694961	GD	On-Demand	Anodyne	TRY2_BOVIN	55	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)Cc2cccc(F)c2)CC1	ZINC000853694961	GD	On-Demand	Anodyne	ST14	30	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccc(F)c2)CC1	ZINC000853694962	GD	On-Demand	Anodyne	P2RY12	66	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccc(F)c2)CC1	ZINC000853694962	GD	On-Demand	Anodyne	TRY2_BOVIN	55	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)Cc2cccc(F)c2)CC1	ZINC000853694962	GD	On-Demand	Anodyne	ST14	30	42
COC(=O)/C=C\c1ccc(OC)c(OCCc2cncn2C)c1	ZINC000853694983	DE	On-Demand	Anodyne	APP	20	43
COC(=O)/C=C\c1ccc(OC)c(OCCc2cncn2C)c1	ZINC000853694983	DE	On-Demand	Anodyne	TUBB1	41	35
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853695101	GG	On-Demand	Mild	ACHE	21	40
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853695101	GG	On-Demand	Mild	HTR4	44	38
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853695101	GG	On-Demand	Mild	SIGMAR1	18	40
C#CCCN(CCOC)C(=O)NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000853695101	GG	On-Demand	Mild	CACNA1I	61	38
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccnc2C(=O)c2ccccn2)C1	ZINC000853695111	FE	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccnc2C(=O)c2ccccn2)C1	ZINC000853695112	FE	On-Demand	Anodyne	GPR119	22	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1ccc(Br)cc1	ZINC000853695131	GF	On-Demand	Mild	PAPA1_CARPA	16	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(CCOC)c2)CC1	ZINC000853695173	FD	On-Demand	Anodyne	P2RY12	160	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(CCOC)c2)CC1	ZINC000853695173	FD	On-Demand	Anodyne	TRY2_BOVIN	38	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(CCOC)c2)CC1	ZINC000853695174	FD	On-Demand	Anodyne	P2RY12	160	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(CCOC)c2)CC1	ZINC000853695174	FD	On-Demand	Anodyne	TRY2_BOVIN	38	40
CC[C@H](O)c1nccn1Cc1ccc(OC)cc1	ZINC000853695250	BE	On-Demand	Anodyne	PROKR1	60	33
Cc1cc(C(F)(F)F)ccc1OCc1nonc1C	ZINC000853695286	CG	On-Demand	Anodyne	PPARD	47	39
C#CCOCCOc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853695295	GD	On-Demand	Mild	GABRA1	35	72
C#CCOCCOc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853695295	GD	On-Demand	Mild	GABRA4	46	72
C#CCOCCOc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853695295	GD	On-Demand	Mild	GABRA5	82	72
C#CCOCCOc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853695295	GD	On-Demand	Mild	GABRA3	43	72
C#CCOCCOc1ccc2c(c1)C(=O)N(C)Cc1c(C(=O)OCC)ncn1-2	ZINC000853695295	GD	On-Demand	Mild	GABRA2	39	72
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCc3nonc3C)ccc1-2	ZINC000853695303	GD	On-Demand	Anodyne	GABRA1	34	66
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCc3nonc3C)ccc1-2	ZINC000853695303	GD	On-Demand	Anodyne	GABRA4	43	66
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCc3nonc3C)ccc1-2	ZINC000853695303	GD	On-Demand	Anodyne	GABRA5	78	66
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCc3nonc3C)ccc1-2	ZINC000853695303	GD	On-Demand	Anodyne	GABRA3	39	66
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCc3nonc3C)ccc1-2	ZINC000853695303	GD	On-Demand	Anodyne	GABRA2	35	66
N=C(Cc1cccc(F)c1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853695308	FG	On-Demand	Anodyne	GRIN2B	50	43
N=C(Cc1cccc(F)c1)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853695308	FG	On-Demand	Anodyne	ST14	45	37
N=C(Cc1cccc(F)c1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853695309	FG	On-Demand	Anodyne	GRIN2B	50	43
N=C(Cc1cccc(F)c1)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853695309	FG	On-Demand	Anodyne	ST14	45	37
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCCOC(F)F)ccc1-2	ZINC000853695328	GE	On-Demand	Anodyne	GABRA1	34	70
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCCOC(F)F)ccc1-2	ZINC000853695328	GE	On-Demand	Anodyne	GABRA4	46	70
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCCOC(F)F)ccc1-2	ZINC000853695328	GE	On-Demand	Anodyne	GABRA5	81	70
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCCOC(F)F)ccc1-2	ZINC000853695328	GE	On-Demand	Anodyne	GABRA3	41	70
CCOC(=O)c1ncn2c1CN(C)C(=O)c1cc(OCCOC(F)F)ccc1-2	ZINC000853695328	GE	On-Demand	Anodyne	GABRA2	37	70
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3c(Cl)cccc3c2=O)CC1	ZINC000853695352	GD	On-Demand	Anodyne	P2RY12	80	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3c(Cl)cccc3c2=O)CC1	ZINC000853695353	GD	On-Demand	Anodyne	P2RY12	80	38
O=C1OCc2c(Cl)ccc(OCC3CCC3)c21	ZINC000853695416	CG	On-Demand	Anodyne	HPGD	23	44
O=C1OCc2c(Cl)ccc(OCc3cccc(C(=O)N4CCCCC4)c3)c21	ZINC000853695434	GI	On-Demand	Anodyne	PTGER1	40	42
O=C1OCc2c(Cl)ccc(OCc3cccc(C(=O)N4CCCCC4)c3)c21	ZINC000853695434	GI	On-Demand	Anodyne	PARP1	15	47
O=C1OCc2c(Cl)ccc(OCCCNC(=O)C3CCCC3)c21	ZINC000853695435	EG	On-Demand	Anodyne	TBK1	52	33
O=C1OCc2c(Cl)ccc(OCCC3CC3)c21	ZINC000853695438	CG	On-Demand	Anodyne	HPGD	30	40
CCCOc1cccc(CNC(=O)COc2ccc(Cl)c3c2C(=O)OC3)c1	ZINC000853695441	GG	On-Demand	Anodyne	PDS	48	34
NC(=O)[C@@H]1CC[C@@H](CNc2cc(F)ncn2)CC1	ZINC000853695469	CD	On-Demand	Anodyne	VCP	69	47
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC000853695490	FF	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC000853695491	FF	On-Demand	Anodyne	P2RY12	47	36
NC(=O)[C@@H]1CC[C@@H](CNc2cnc(F)cn2)CC1	ZINC000853695683	CD	On-Demand	Anodyne	VCP	63	45
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@H]1CCOc2ccccc21	ZINC000853695684	FG	On-Demand	Anodyne	BDKRB1	23	40
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@H]1CCOc2ccccc21	ZINC000853695684	FG	On-Demand	Anodyne	LUXR	63	35
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@H]1CCOc2ccccc21	ZINC000853695684	FG	On-Demand	Anodyne	TRAR	83	45
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@@H]1CCOc2ccccc21	ZINC000853695685	FG	On-Demand	Anodyne	BDKRB1	23	40
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@@H]1CCOc2ccccc21	ZINC000853695685	FG	On-Demand	Anodyne	LUXR	63	35
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@@H]1CCOc2ccccc21	ZINC000853695685	FG	On-Demand	Anodyne	TRAR	83	45
O=C1OCc2c(Cl)ccc(OCCc3ccc4c(c3)CCO4)c21	ZINC000853695701	EH	On-Demand	Anodyne	KCNJ1	43	38
CN(CCOc1ccc(Cl)c2c1C(=O)OC2)Cc1ccccc1	ZINC000853695738	EH	On-Demand	Anodyne	SLC6A9	18	41
Cc1cc(CNc2cc(Cl)nc3cc(C)nn23)cc(C)n1	ZINC000853695755	DG	On-Demand	Anodyne	KCNN1	15	44
NC(=O)[C@@H]1CC[C@@H](CNc2nc(Cl)nc3c(Br)c[nH]c23)CC1	ZINC000853695756	GG	On-Demand	Anodyne	VCP	48	37
CCN1CC[C@H](N(CC)C(=O)NCc2ccccc2N(C)CC)C1	ZINC000853695774	EF	On-Demand	Anodyne	CCR5	41	52
CCN1CC[C@@H](N(CC)C(=O)NCc2ccccc2N(C)CC)C1	ZINC000853695775	EF	On-Demand	Anodyne	CCR5	41	52
CC(C)(C)OC(=O)N1CCC(COc2ccc(Cl)c3c2C(=O)OC3)CC1	ZINC000853695797	GI	On-Demand	Anodyne	GPR119	48	43
N#Cc1ncc(Br)cc1NC[C@@H]1CC[C@@H](C(N)=O)CC1	ZINC000853695814	EE	On-Demand	Mild	VCP	58	37
O=C1OCc2c(Cl)ccc(OCCOC3CCC3)c21	ZINC000853695837	CF	On-Demand	Anodyne	HPGD	15	44
O=C1OCc2c(Cl)ccc(OCCC3CCC3)c21	ZINC000853695849	CH	On-Demand	Anodyne	HPGD	35	43
O=C1OCc2c(Cl)ccc(OCC3CCCC3)c21	ZINC000853695925	CH	On-Demand	Anodyne	HPGD	26	44
C#Cc1cccnc1NC[C@@H]1CC[C@@H](C(N)=O)CC1	ZINC000853695931	CD	On-Demand	Mild	VCP	66	42
O=C1OCc2c(Cl)ccc(OCCCN3CCCCC3)c21	ZINC000853695935	DG	On-Demand	Anodyne	HTR1A	21	46
O=C1OCc2c(Cl)ccc(OCCCN3CCCCC3)c21	ZINC000853695935	DG	On-Demand	Anodyne	DRD2	25	46
O=C1OCc2c(Cl)ccc(OCCCN3CCCCC3)c21	ZINC000853695935	DG	On-Demand	Anodyne	HTR2A	21	41
O=C1OCc2c(Cl)ccc(OCCCN3CCCCC3)c21	ZINC000853695935	DG	On-Demand	Anodyne	HRH3	71	46
O=C1OCc2c(Cl)ccc(OCCCN3CCCCC3)c21	ZINC000853695935	DG	On-Demand	Anodyne	SIGMAR1	29	43
O=C1OCc2c(Cl)ccc(OCCCN3CCCCC3)c21	ZINC000853695935	DG	On-Demand	Anodyne	HNMT	72	32
NC(=O)[C@@H]1CC[C@@H](CNc2ccc3c(c2)S(=O)(=O)N=C3Cl)CC1	ZINC000853695943	FE	On-Demand	Anodyne	VCP	61	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-c3nnc(N)o3)cc2)CC1	ZINC000853695987	GD	On-Demand	Anodyne	P2RY12	52	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-c3nnc(N)o3)cc2)CC1	ZINC000853695988	GD	On-Demand	Anodyne	P2RY12	52	37
NC(=O)[C@@H]1CC[C@@H](CNc2ncnc(F)c2Br)CC1	ZINC000853696043	EE	On-Demand	Anodyne	VCP	51	39
O=C1OCc2c(Cl)ccc(OCCCOCCc3ccccc3)c21	ZINC000853696060	EI	On-Demand	Anodyne	HPGD	20	40
C#CCCCOc1cccnc1NC[C@@H]1CC[C@@H](C(N)=O)CC1	ZINC000853696061	DF	On-Demand	Mild	VCP	57	39
NC(=O)[C@@H]1CC[C@@H](CNc2nc(Cl)c(C(F)(F)F)cc2Cl)CC1	ZINC000853696077	FI	On-Demand	Anodyne	VCP	64	43
CC(C)(C)OC(=O)N1CC[C@H](CCOc2ccc(Cl)c3c2C(=O)OC3)C1	ZINC000853696087	GI	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2ccc(Cl)c3c2C(=O)OC3)C1	ZINC000853696088	GI	On-Demand	Anodyne	GPR119	32	42
O=C1OCc2c(Cl)ccc(OC[C@@H]3CCOC3)c21	ZINC000853696101	CE	On-Demand	Anodyne	XDH	17	42
O=C1OCc2c(Cl)ccc(OC[C@H]3CCOC3)c21	ZINC000853696102	CE	On-Demand	Anodyne	XDH	17	42
CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1CN2c1nc2ncccc2cc1C#N	ZINC000853696127	FG	On-Demand	Mild	GPR119	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCCCc2nc[nH]n2)C1	ZINC000853696158	FD	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCCCc2nc[nH]n2)C1	ZINC000853696160	FD	On-Demand	Anodyne	GPR119	34	41
CN1CCN(C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CCC1=O	ZINC000853696162	FD	On-Demand	Anodyne	GPR119	31	43
CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1CN2c1cnccn1	ZINC000853696163	CE	On-Demand	Anodyne	GPR119	20	54
CN1CCN(C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCC1=O	ZINC000853696164	FD	On-Demand	Anodyne	GPR119	31	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C#N)c2cccc(Cl)c2)CC1	ZINC000853696168	FE	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C#N)c2cccc(Cl)c2)CC1	ZINC000853696169	FE	On-Demand	Anodyne	P2RY12	55	38
C[C@H]1CCCCN1C(=O)COc1ccc(Cl)c2c1C(=O)OC2	ZINC000853696177	DF	On-Demand	Anodyne	CPT1A	121	40
C[C@H]1CCCCN1C(=O)COc1ccc(Cl)c2c1C(=O)OC2	ZINC000853696177	DF	On-Demand	Anodyne	CPT2	45	40
C[C@@H]1CCCCN1C(=O)COc1ccc(Cl)c2c1C(=O)OC2	ZINC000853696179	DF	On-Demand	Anodyne	CPT1A	121	40
C[C@@H]1CCCCN1C(=O)COc1ccc(Cl)c2c1C(=O)OC2	ZINC000853696179	DF	On-Demand	Anodyne	CPT2	45	40
C[C@@H]1Cc2ccccc2N1C(=O)COc1ccc(Cl)c2c1C(=O)OC2	ZINC000853696181	FG	On-Demand	Anodyne	DRD4	28	48
C#CCOCCOc1ccc2c(c1)C(=O)CCC2	ZINC000853696246	BE	On-Demand	Mild	MAOB	20	46
COc1cc(N(C)C[C@H]2CCCN2C)c([N+](=O)[O-])cc1C	ZINC000853696248	CE	On-Demand	Bother	CHRNA10	55	37
COc1cc(N(C)C[C@H]2CCCN2C)c([N+](=O)[O-])cc1C	ZINC000853696248	CE	On-Demand	Bother	ACKR3	63	32
COc1cc(N(C)C[C@@H]2CCCN2C)c([N+](=O)[O-])cc1C	ZINC000853696250	CE	On-Demand	Bother	CHRNA10	55	37
COc1cc(N(C)C[C@@H]2CCCN2C)c([N+](=O)[O-])cc1C	ZINC000853696250	CE	On-Demand	Bother	ACKR3	63	32
CO[C@@H](Cn1c(C)cn(-c2cccc([N+](=O)[O-])c2)c1=O)C1CCC1	ZINC000853696255	EF	On-Demand	Bother	CACNA1C	42	34
CO[C@@H](Cn1c(C)cn(-c2cccc([N+](=O)[O-])c2)c1=O)C1CCC1	ZINC000853696255	EF	On-Demand	Bother	CACNA1D	66	33
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ncn(-c3ccncc3)c2=O)C1	ZINC000853696266	FE	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CCn2ncn(-c3ccncc3)c2=O)C1	ZINC000853696267	FE	On-Demand	Anodyne	GPR119	40	42
O=C1OCc2c(Cl)ccc(OCC(=O)N3CCC(Cc4ccccc4)CC3)c21	ZINC000853696278	GH	On-Demand	Anodyne	GRIN2B	55	39
O=C1CCCc2ccc(OCCC3SCCS3)cc21	ZINC000853696301	CH	On-Demand	Anodyne	MAOB	18	47
CC(C)(C)OC(=O)N1CCC(CCCn2ncn(-c3ccncc3)c2=O)CC1	ZINC000853696325	GF	On-Demand	Anodyne	GPR119	47	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853696340	GG	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853696341	GG	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853696342	GG	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853696343	GG	On-Demand	Anodyne	GPR119	35	47
CC(=O)N[C@@H]1CCN(c2ncccn2)C1	ZINC000853696366	BC	On-Demand	Anodyne	HRH4	44	35
CC(=O)N[C@H]1CCN(c2ncccn2)C1	ZINC000853696368	BC	On-Demand	Anodyne	HRH4	44	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)CC(=O)N3)CC1	ZINC000853696413	FD	On-Demand	Anodyne	P2RY12	60	40
CON(C)CCNC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853696414	ED	On-Demand	Anodyne	GPR119	29	42
CON(C)CCNC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853696415	ED	On-Demand	Anodyne	GPR119	29	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)CC(=O)N3)CC1	ZINC000853696416	FD	On-Demand	Anodyne	P2RY12	60	40
C#CCCCOc1cccnc1NC1CCN(OC)CC1	ZINC000853696458	CE	On-Demand	Mild	EHMT2	74	33
CN(C[C@@H]1CCCN1C)c1cc(Br)cnc1C#N	ZINC000853696465	DE	On-Demand	Mild	CHRNA10	65	40
Cn1nccc1-c1ccc(F)cc1OCCCCC1(C)OCCO1	ZINC000853696479	EH	On-Demand	Anodyne	HTR2A	20	42
C#CCOCCOc1ccnc2cc(F)c(OC)cc12	ZINC000853696483	CE	On-Demand	Mild	FGFR2	48	40
C#CCOCCOc1ccnc2cc(F)c(OC)cc12	ZINC000853696483	CE	On-Demand	Mild	MST1R	28	40
C#CCOCCOc1ccnc2cc(F)c(OC)cc12	ZINC000853696483	CE	On-Demand	Mild	MET	57	36
C#CCOCCOc1ccnc2cc(F)c(OC)cc12	ZINC000853696483	CE	On-Demand	Mild	PDGFRA	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3ccncc3c2=O)CC1	ZINC000853696498	FD	On-Demand	Anodyne	P2RY12	50	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3ccncc3c2=O)CC1	ZINC000853696499	FD	On-Demand	Anodyne	P2RY12	50	38
COC(=O)Cn1cc(Cn2c(C)cn(-c3cccc([N+](=O)[O-])c3)c2=O)nn1	ZINC000853696518	FC	On-Demand	Bother	CACNA1D	40	31
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@@]3(O)C[C@H]3C2)C1	ZINC000853696547	FD	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@@]3(O)C[C@H]3C2)C1	ZINC000853696548	FD	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC(S(C)(=O)=O)C2)C1	ZINC000853696568	GD	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC(S(C)(=O)=O)C2)C1	ZINC000853696569	GD	On-Demand	Anodyne	GPR119	41	41
CCOC(=O)c1nccc(N2c3ccccc3C[C@@H]2CNC(=O)C(F)(F)F)n1	ZINC000853696575	GE	On-Demand	Anodyne	TPP2	52	32
CCOC(=O)c1nccc(N2c3ccccc3C[C@H]2CNC(=O)C(F)(F)F)n1	ZINC000853696577	GE	On-Demand	Anodyne	TPP2	52	32
CC(C)c1ccc2ncnc(N3Cc4ccncc4C3)c2c1	ZINC000853696589	CH	On-Demand	Anodyne	PDGFRB	19	40
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C#N)c2ccc(OC)cc2)CC1	ZINC000853696598	FD	On-Demand	Anodyne	P2RY12	60	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C#N)c2ccc(OC)cc2)CC1	ZINC000853696600	FD	On-Demand	Anodyne	P2RY12	60	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853696601	FD	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853696601	FD	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853696603	FD	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853696603	FD	On-Demand	Anodyne	GPR119	26	43
CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1CN2c1cnc(F)cn1	ZINC000853696610	DE	On-Demand	Anodyne	GPR119	24	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(-c3nncs3)cc2)CC1	ZINC000853696611	GE	On-Demand	Anodyne	P2RY12	52	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(-c3nncs3)cc2)CC1	ZINC000853696613	GE	On-Demand	Anodyne	P2RY12	52	37
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccco2)CC1	ZINC000853696741	FE	On-Demand	Mild	DRD4	22	50
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccco2)CC1	ZINC000853696741	FE	On-Demand	Mild	SIGMAR1	22	47
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccco2)CC1	ZINC000853696741	FE	On-Demand	Mild	CCR3	16	41
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccco2)CC1	ZINC000853696741	FE	On-Demand	Mild	MCHR1	27	40
Cc1ccccc1CN1CCC(NC(=O)CON=C(N)c2ccco2)CC1	ZINC000853696741	FE	On-Demand	Mild	CCR8	16	42
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@@H](O)C(F)(F)C2)C1	ZINC000853696804	GE	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@H](O)C(F)(F)C2)C1	ZINC000853696805	GE	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@@H](O)C(F)(F)C2)C1	ZINC000853696806	GE	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@H](O)C(F)(F)C2)C1	ZINC000853696807	GE	On-Demand	Anodyne	GPR119	28	40
CN1C[C@H](CNC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696816	FD	On-Demand	Anodyne	CACNA1I	47	36
CN1C[C@H](CNC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696816	FD	On-Demand	Anodyne	GPR119	26	41
CN1C[C@H](CNC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696817	FD	On-Demand	Anodyne	CACNA1I	47	36
CN1C[C@H](CNC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696817	FD	On-Demand	Anodyne	GPR119	26	41
CN1C[C@@H](CNC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696818	FD	On-Demand	Anodyne	CACNA1I	47	36
CN1C[C@@H](CNC(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696818	FD	On-Demand	Anodyne	GPR119	26	41
CN1C[C@@H](CNC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696819	FD	On-Demand	Anodyne	CACNA1I	47	36
CN1C[C@@H](CNC(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853696819	FD	On-Demand	Anodyne	GPR119	26	41
CNC(=O)[C@H]1CCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853696829	EF	On-Demand	Anodyne	PTGES	15	41
CNC(=O)[C@@H]1CCN(c2nc(Cl)c(C(F)(F)F)cc2Cl)C1	ZINC000853696830	EF	On-Demand	Anodyne	PTGES	15	41
COc1cccc(Nc2nc(NCC(=O)N(C)OC)nc3[nH]cnc23)c1	ZINC000853696844	FD	On-Demand	Anodyne	PDPK1	17	45
COc1cccc(Nc2nc(NCC(=O)N(C)OC)nc3[nH]cnc23)c1	ZINC000853696844	FD	On-Demand	Anodyne	SYK	27	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3ccc(F)cc3c2=O)CC1	ZINC000853696917	GE	On-Demand	Anodyne	P2RY12	56	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3ccc(F)cc3c2=O)CC1	ZINC000853696918	GE	On-Demand	Anodyne	P2RY12	56	36
O=C(Cn1ccc2ccncc2c1=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853696919	GE	On-Demand	Anodyne	C3AR1	40	38
C#Cc1cccnc1N(C)C[C@H]1CCCN1C	ZINC000853696927	BD	On-Demand	Mild	CHRNA10	66	39
C#Cc1cccnc1N(C)C[C@@H]1CCCN1C	ZINC000853696928	BD	On-Demand	Mild	CHRNA10	66	39
CN(C[C@@H]1CCCN1C)c1ccc(C(=O)C2CC2)cc1S(N)(=O)=O	ZINC000853697026	FD	On-Demand	Anodyne	CHRNA10	53	33
CN(C[C@@H]1CCCN1C)c1ccc(C(=O)C2CC2)cc1S(N)(=O)=O	ZINC000853697026	FD	On-Demand	Anodyne	ACKR3	47	31
Cc1ccccc1CN1CCC(NC(=O)Cn2ccc3ccncc3c2=O)CC1	ZINC000853697039	GE	On-Demand	Anodyne	SIGMAR1	15	44
C#CCCCOc1cccnc1N(C)C[C@@H]1CCCN1C	ZINC000853697045	CE	On-Demand	Mild	CHRNA10	65	39
C#CCCCOc1cccnc1N(C)C[C@H]1CCCN1C	ZINC000853697047	CE	On-Demand	Mild	CHRNA10	65	39
Cc1noc(C)c1CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853697059	FG	On-Demand	Reactive	LCK	24	40
Cc1noc(C)c1CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853697059	FG	On-Demand	Reactive	CSNK1D	34	41
CN(C[C@@H]1CCCN1C)c1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853697076	ED	On-Demand	Anodyne	CHRNA10	56	39
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	CHRM2	19	44
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	CHRM1	19	44
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	DRD2	27	47
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	DRD4	56	48
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	ACHE	45	50
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	KCNH2	18	44
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	CHRM3	25	44
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	LTA4H	20	40
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	SIGMAR1	52	52
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	SSTR5	57	37
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	CCR3	27	41
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	MCHR1	55	48
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	CACNA1G	17	41
C[C@@H](ONC(=N)[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697109	FD	On-Demand	Anodyne	CCR8	25	40
N#CCN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853697112	EE	On-Demand	Reactive	EPHX2	16	42
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	CHRM2	19	44
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	CHRM1	19	44
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	DRD2	27	47
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	DRD4	56	48
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	ACHE	45	50
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	KCNH2	18	44
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	CHRM3	25	44
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	LTA4H	20	40
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	SIGMAR1	52	52
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	SSTR5	57	37
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	CCR3	27	41
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	MCHR1	55	48
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	CACNA1G	17	41
C[C@@H](ONC(=N)[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853697114	FD	On-Demand	Anodyne	CCR8	25	40
O=c1oc2ccc(OCCOC(F)F)cc2o1	ZINC000853697126	BE	On-Demand	Anodyne	ALDH2	82	38
C[Si](C)(C)c1ccc(CNC(=O)NC2CCN(CC#N)CC2)cc1	ZINC000853697151	EE	On-Demand	Mild	MCHR1	21	50
O=[N+]([O-])c1ccc2c(I)nn(CCOC(F)F)c2c1	ZINC000853697161	GF	On-Demand	Bother	F2RL3	46	33
O=c1oc2ccc(OCCC3SCCS3)cc2o1	ZINC000853697167	CF	On-Demand	Anodyne	ALDH2	61	38
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N[C@@]2(C)CC2(C)C)C1	ZINC000853697231	EG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N[C@]2(C)CC2(C)C)C1	ZINC000853697232	EG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@]2(C)CC2(C)C)C1	ZINC000853697233	EG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@@]2(C)CC2(C)C)C1	ZINC000853697234	EG	On-Demand	Anodyne	GPR119	23	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)On2nnc3cccnc32)CC1	ZINC000853697240	EB	On-Demand	Anodyne	P2RY12	93	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)On2nnc3cccnc32)CC1	ZINC000853697240	EB	On-Demand	Anodyne	GRIN2B	18	40
CCOC(=O)N1CCN(C(=O)[C@H](C)On2nnc3cccnc32)CC1	ZINC000853697241	EB	On-Demand	Anodyne	P2RY12	93	38
CCOC(=O)N1CCN(C(=O)[C@H](C)On2nnc3cccnc32)CC1	ZINC000853697241	EB	On-Demand	Anodyne	GRIN2B	18	40
C[C@@H](CCNC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853697246	FE	On-Demand	Anodyne	GPR119	27	41
C[C@@H](CCNC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853697248	FE	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)C1	ZINC000853697268	FF	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)C1	ZINC000853697269	FF	On-Demand	Anodyne	GPR119	30	43
CON(C)CCNC(=O)N[C@H](C)c1nc(-c2ccccc2)cs1	ZINC000853697280	EF	On-Demand	Anodyne	ROCK1	21	44
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853697281	FG	On-Demand	Anodyne	GPR119	28	44
CON(C)CCNC(=O)N[C@@H](C)c1nc(-c2ccccc2)cs1	ZINC000853697282	EF	On-Demand	Anodyne	ROCK1	21	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853697283	FG	On-Demand	Anodyne	GPR119	28	44
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N(CCC2CC2)CC2CC2)C1	ZINC000853697292	GH	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N(CCC2CC2)CC2CC2)C1	ZINC000853697294	GH	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NC(C)(C2CC2)C2CC2)C1	ZINC000853697303	FH	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NC(C)(C2CC2)C2CC2)C1	ZINC000853697305	FH	On-Demand	Anodyne	GPR119	28	40
Cn1nccc1-c1ccc(F)cc1OCCC1SCCS1	ZINC000853697328	DH	On-Demand	Anodyne	HTR2A	19	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C#N)c2ccccc2Cl)CC1	ZINC000853697334	FE	On-Demand	Anodyne	P2RY12	71	39
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C#N)c2ccccc2Cl)CC1	ZINC000853697337	FE	On-Demand	Anodyne	P2RY12	71	39
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccc3ccncc3c2=O)C1	ZINC000853697346	EE	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccc3ccncc3c2=O)C1	ZINC000853697347	EE	On-Demand	Anodyne	GPR119	24	42
O=C1CCCc2ccc(OCc3csc(Cl)n3)cc21	ZINC000853697348	CH	On-Demand	Anodyne	MAOB	23	48
O=C1CCCc2ccc(OCCOC(F)F)cc21	ZINC000853697414	CF	On-Demand	Anodyne	MAOB	21	48
Fc1cnc(S[C@H]2CCCN(Cc3ccccc3)C2)cn1	ZINC000853697449	DG	On-Demand	Anodyne	DRD4	16	41
Fc1cnc(S[C@H]2CCCN(Cc3ccccc3)C2)cn1	ZINC000853697449	DG	On-Demand	Anodyne	SIGMAR1	37	43
Fc1cnc(S[C@@H]2CCCN(Cc3ccccc3)C2)cn1	ZINC000853697451	DG	On-Demand	Anodyne	DRD4	16	41
Fc1cnc(S[C@@H]2CCCN(Cc3ccccc3)C2)cn1	ZINC000853697451	DG	On-Demand	Anodyne	SIGMAR1	37	43
CCOC(=O)c1nccc(N2C[C@H]3CC[C@H]2CN3C(=O)OC(C)(C)C)n1	ZINC000853697469	FE	On-Demand	Anodyne	GPR119	21	46
O=C(COC(=O)c1ccc(CSc2nc3ccccc3s2)cc1)NCC(=O)N1CCCC1	ZINC000853697486	JG	On-Demand	Anodyne	ST14	41	31
O=C(COC(=O)c1ccc(CSc2nc3ccccc3s2)cc1)NCC(=O)N1CCCC1	ZINC000853697486	JG	On-Demand	Anodyne	TMPRSS6	53	31
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cncc(-c3ccccc3)c2=O)CC1	ZINC000853697504	GD	On-Demand	Anodyne	P2RY12	197	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cncc(-c3ccccc3)c2=O)CC1	ZINC000853697505	GD	On-Demand	Anodyne	P2RY12	197	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C#N)c2cccc(F)c2)CC1	ZINC000853697506	ED	On-Demand	Anodyne	P2RY12	57	38
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C#N)c2cccc(F)c2)CC1	ZINC000853697507	ED	On-Demand	Anodyne	P2RY12	57	38
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	HTR1A	119	60
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	DRD2	97	58
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	DRD1	25	49
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	DRD4	61	54
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	ADRA1D	59	49
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	HTR2A	93	58
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	HTR2C	52	55
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	SLC6A4	25	55
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	ADRA1A	78	49
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	ADRA1B	50	49
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	DRD3	125	52
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	HTR4	27	46
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	DRD5	19	40
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	HRP1_PLAFA	68	38
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	HTR7	126	50
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	SIGMAR1	15	49
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	NPY1R	19	46
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	CCR1	19	41
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	HTR6	15	50
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	MCHR1	16	43
CON(C)CCNC(=O)NCCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853697566	GD	On-Demand	Anodyne	CACNA1G	21	49
COC(=O)c1c(OCCOC(F)F)ccn1Cc1ccccc1	ZINC000853697579	EF	On-Demand	Anodyne	MAPK8	17	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C#N)c2ccccc2F)CC1	ZINC000853697582	ED	On-Demand	Anodyne	P2RY12	69	39
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C#N)c2ccccc2F)CC1	ZINC000853697583	ED	On-Demand	Anodyne	P2RY12	69	39
CON(C)CCNC(=O)N[C@H](C)c1sc(-c2ccc(Cl)cc2)nc1C	ZINC000853697633	GH	On-Demand	Anodyne	UTS2	42	34
CON(C)CCNC(=O)N[C@@H](C)c1sc(-c2ccc(Cl)cc2)nc1C	ZINC000853697634	GH	On-Demand	Anodyne	UTS2	42	34
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)[C@H]1CCCO1	ZINC000853697673	DD	On-Demand	Anodyne	L3MBTL3	45	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)[C@@H]1CCCO1	ZINC000853697675	DD	On-Demand	Anodyne	L3MBTL3	45	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)[C@H]1CCCO1	ZINC000853697677	DD	On-Demand	Anodyne	L3MBTL3	45	34
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)[C@@H]1CCCO1	ZINC000853697679	DD	On-Demand	Anodyne	L3MBTL3	45	34
O=C(COc1ccc(Cl)c2c1C(=O)OC2)NCCCc1ccccc1	ZINC000853697710	FG	On-Demand	Anodyne	CRTM	36	41
CC(C)(C)OC(=O)NC(C)(C)C(=N)NOCCOCc1ccccc1	ZINC000853697734	FG	On-Demand	Anodyne	CTSK	16	48
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3c(c2)C(=O)CCC3)C1	ZINC000853697810	FG	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3c(c2)C(=O)CCC3)C1	ZINC000853697813	FG	On-Demand	Anodyne	GPR119	27	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)C(=O)CCC3)CC1	ZINC000853697834	FE	On-Demand	Anodyne	P2RY12	44	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)C(=O)CCC3)CC1	ZINC000853697836	FE	On-Demand	Anodyne	P2RY12	44	36
C#CCOCCOc1cc(F)ccc1-c1ccnn1C	ZINC000853697859	CE	On-Demand	Mild	HTR2A	17	43
O=C(c1ccccc1)N1CC[C@H](Cn2ccc3ccncc3c2=O)C1	ZINC000853697865	EF	On-Demand	Anodyne	SMO	33	41
O=C(c1ccccc1)N1CC[C@@H](Cn2ccc3ccncc3c2=O)C1	ZINC000853697866	EF	On-Demand	Anodyne	SMO	33	41
CCC(=O)c1ccc(N(C)C[C@@H]2CCCN2C)c(S(=O)(=O)NC)c1	ZINC000853697867	FD	On-Demand	Anodyne	CHRNA10	48	32
CCC(=O)c1ccc(N(C)C[C@@H]2CCCN2C)c(S(=O)(=O)NC)c1	ZINC000853697867	FD	On-Demand	Anodyne	ACKR3	42	30
CCC(=O)c1ccc(N(C)C[C@H]2CCCN2C)c(S(=O)(=O)NC)c1	ZINC000853697868	FD	On-Demand	Anodyne	CHRNA10	48	32
CCC(=O)c1ccc(N(C)C[C@H]2CCCN2C)c(S(=O)(=O)NC)c1	ZINC000853697868	FD	On-Demand	Anodyne	ACKR3	42	30
CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1CN2c1ncnc(F)c1Br	ZINC000853697870	GF	On-Demand	Anodyne	GPR119	21	44
CN(C[C@@H]1CCCN1C)c1ccc(C(F)F)cc1[N+](=O)[O-]	ZINC000853697873	CG	On-Demand	Bother	CHRNA10	59	34
CN(C[C@@H]1CCCN1C)c1cnc(F)cn1	ZINC000853697889	BD	On-Demand	Anodyne	CHRNA10	68	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc3ccc(F)cc3c2)CC1	ZINC000853697971	GE	On-Demand	Anodyne	P2RY12	93	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc3ccc(F)cc3c2)CC1	ZINC000853697972	GE	On-Demand	Anodyne	P2RY12	93	37
OCC[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853698018	DE	On-Demand	Anodyne	SIRT3	60	35
OCC[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853698018	DE	On-Demand	Anodyne	SIRT2	54	34
OCC[C@@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853698018	DE	On-Demand	Anodyne	SIRT1	52	33
OCC[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853698019	DE	On-Demand	Anodyne	SIRT3	60	35
OCC[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853698019	DE	On-Demand	Anodyne	SIRT2	54	34
OCC[C@H]1CCCN(c2ncnc(F)c2Br)CC1	ZINC000853698019	DE	On-Demand	Anodyne	SIRT1	52	33
CCOC(=O)c1nccc(N2CCC3(CC2)CCN3C(=O)OC(C)(C)C)n1	ZINC000853698029	GF	On-Demand	Anodyne	GPR119	16	41
COC(=O)c1nccc(N2C[C@H]3CC[C@H]2CN3C(=O)OC(C)(C)C)n1	ZINC000853698045	ED	On-Demand	Anodyne	GPR119	19	46
Cn1nccc1-c1ccc(F)cc1OCCOC(F)F	ZINC000853698070	CF	On-Demand	Anodyne	HTR2A	17	42
O=C1OCc2c(Cl)ccc(OCC(=O)N3CCc4ccccc4C3)c21	ZINC000853698129	FF	On-Demand	Anodyne	CPT2	32	42
CC[C@H](C)N(CC)C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853698137	EG	On-Demand	Anodyne	GPR119	25	41
CC[C@H](C)N(CC)C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853698140	EG	On-Demand	Anodyne	GPR119	25	41
CCCCCNC(=O)COc1ccc(Cl)c2c1C(=O)OC2	ZINC000853698147	DF	On-Demand	Anodyne	ASAH1	40	33
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853698161	GG	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853698163	GG	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853698166	GG	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853698169	GG	On-Demand	Anodyne	GPR119	36	41
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@H]1CCCc2ccccc21	ZINC000853698247	FH	On-Demand	Anodyne	BDKRB1	40	38
O=C(COc1ccc(Cl)c2c1C(=O)OC2)N[C@@H]1CCCc2ccccc21	ZINC000853698248	FH	On-Demand	Anodyne	BDKRB1	40	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(N3CCCC3)c2)CC1	ZINC000853698255	GE	On-Demand	Anodyne	P2RY12	152	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(N3CCCC3)c2)CC1	ZINC000853698256	GE	On-Demand	Anodyne	P2RY12	152	40
N#CCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853698259	DD	On-Demand	Mild	DRD4	15	45
N#CCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853698259	DD	On-Demand	Mild	SIGMAR1	16	42
N#CCN1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853698259	DD	On-Demand	Mild	EPHX2	19	42
N#CCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853698260	DD	On-Demand	Mild	DRD4	15	45
N#CCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853698260	DD	On-Demand	Mild	SIGMAR1	16	42
N#CCN1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853698260	DD	On-Demand	Mild	EPHX2	19	42
N#CCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853698261	DD	On-Demand	Mild	DRD4	15	45
N#CCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853698261	DD	On-Demand	Mild	SIGMAR1	16	42
N#CCN1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853698261	DD	On-Demand	Mild	EPHX2	19	42
N#CCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853698262	DD	On-Demand	Mild	DRD4	15	45
N#CCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853698262	DD	On-Demand	Mild	SIGMAR1	16	42
N#CCN1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853698262	DD	On-Demand	Mild	EPHX2	19	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(C)c(C)nn2C)CC1	ZINC000853698299	ED	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(C)c(C)nn2C)CC1	ZINC000853698300	ED	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3oc(=O)oc3c2)CC1	ZINC000853698339	FD	On-Demand	Anodyne	ALDH2	21	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3oc(=O)oc3c2)CC1	ZINC000853698339	FD	On-Demand	Anodyne	P2RY12	49	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3oc(=O)oc3c2)CC1	ZINC000853698340	FD	On-Demand	Anodyne	ALDH2	21	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3oc(=O)oc3c2)CC1	ZINC000853698340	FD	On-Demand	Anodyne	P2RY12	49	37
C[C@@H](NC(=O)NCCc1nnc(S)n1C)c1nc(-c2ccccc2)cs1	ZINC000853698364	GF	On-Demand	Anodyne	ROCK1	17	42
Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(CSc2nc[nH]n2)cc1	ZINC000853698407	HH	On-Demand	Anodyne	CTSA	42	30
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(CSc2nc[nH]n2)cc1	ZINC000853698408	HH	On-Demand	Anodyne	CTSA	42	30
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc(CSc2nc[nH]n2)cc1	ZINC000853698409	HH	On-Demand	Anodyne	CTSA	42	30
Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc(CSc2nc[nH]n2)cc1	ZINC000853698410	HH	On-Demand	Anodyne	CTSA	42	30
CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=N)NOCc1cccnc1N	ZINC000853698441	FD	On-Demand	Anodyne	GPR119	34	41
CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=N)NOCc1cccnc1N	ZINC000853698443	FD	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCC2CCC(O)CC2)C1	ZINC000853698511	FE	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)NCC2CCC(O)CC2)C1	ZINC000853698511	FE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCC2CCC(O)CC2)C1	ZINC000853698512	FE	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)NCC2CCC(O)CC2)C1	ZINC000853698512	FE	On-Demand	Anodyne	GPR119	26	40
CC[C@@H](O)CNC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853698521	ED	On-Demand	Anodyne	GPR119	26	41
CC[C@@H](O)CNC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853698522	ED	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@H](Cn3ccnn3)C2)C1	ZINC000853698523	GD	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@H](Cn3ccnn3)C2)C1	ZINC000853698524	GD	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC[C@@H](CCNC(=O)N2CC[C@@H](Cn3ccnn3)C2)C1	ZINC000853698525	GD	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CC[C@H](CCNC(=O)N2CC[C@@H](Cn3ccnn3)C2)C1	ZINC000853698526	GD	On-Demand	Anodyne	GPR119	28	40
COC(=O)[C@@H]1CCN(C(=O)NCC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H]1C	ZINC000853698536	GE	On-Demand	Anodyne	GPR119	30	41
COC(=O)[C@@H]1CCN(C(=O)NCC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H]1C	ZINC000853698537	GE	On-Demand	Anodyne	GPR119	30	41
COC(=O)c1c(OCc2nonc2C)ccn1C	ZINC000853698598	CD	On-Demand	Anodyne	CACNA1D	15	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncn(-c3ccncc3)c2=O)CC1	ZINC000853698644	FC	On-Demand	Anodyne	P2RY12	41	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncn(-c3ccncc3)c2=O)CC1	ZINC000853698646	FC	On-Demand	Anodyne	P2RY12	41	38
C=C(Cl)COc1cccc(OCCOC)c1	ZINC000853698675	BF	On-Demand	Mild	PLA2G4B	37	42
Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccc(CSc3nc[nH]n3)cc2)cccc1[N+](=O)[O-]	ZINC000853698762	IG	On-Demand	Bother	GSTM2	23	40
Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc(CSc3nc[nH]n3)cc2)cccc1[N+](=O)[O-]	ZINC000853698763	IG	On-Demand	Bother	GSTM2	23	40
C#CCOCCOc1ccc2oc(=O)oc2c1	ZINC000853698771	BD	On-Demand	Mild	ALDH2	62	39
C#CCOCCOc1ccc2oc(=O)oc2c1	ZINC000853698771	BD	On-Demand	Mild	MAOB	19	45
C=C(Cl)COc1cccc(N2CCCC2)c1	ZINC000853698782	BG	On-Demand	Mild	CPT1A	15	42
C=C(Cl)COc1cccc(N2CCCC2)c1	ZINC000853698782	BG	On-Demand	Mild	CPT2	21	42
Cc1noc(C)c1CCNC(=O)NNc1cc(F)cc(Cl)c1	ZINC000853698825	EF	On-Demand	Reactive	P2RX7	18	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(F)ccc2Cl)CC1	ZINC000853698875	FF	On-Demand	Anodyne	P2RY12	69	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(F)ccc2Cl)CC1	ZINC000853698875	FF	On-Demand	Anodyne	P2RX7	38	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(F)ccc2Cl)CC1	ZINC000853698876	FF	On-Demand	Anodyne	P2RY12	69	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(F)ccc2Cl)CC1	ZINC000853698876	FF	On-Demand	Anodyne	P2RX7	38	40
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CSc2nc[nH]n2)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853698881	JE	On-Demand	Anodyne	CA2	42	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C(C)(C)C)cc2=O)CC1	ZINC000853698926	FE	On-Demand	Anodyne	P2RY12	75	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C(C)(C)C)cc2=O)CC1	ZINC000853698927	FE	On-Demand	Anodyne	P2RY12	75	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2CCCO2)CC1	ZINC000853698948	FD	On-Demand	Anodyne	DRD4	18	50
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2CCCO2)CC1	ZINC000853698948	FD	On-Demand	Anodyne	SIGMAR1	19	43
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2CCCO2)CC1	ZINC000853698948	FD	On-Demand	Anodyne	MCHR1	29	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2CCCO2)CC1	ZINC000853698949	FD	On-Demand	Anodyne	DRD4	18	50
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2CCCO2)CC1	ZINC000853698949	FD	On-Demand	Anodyne	SIGMAR1	19	43
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2CCCO2)CC1	ZINC000853698949	FD	On-Demand	Anodyne	MCHR1	29	40
Fc1cc(S[C@H]2CCCN(Cc3ccccc3)C2)ncn1	ZINC000853698967	DG	On-Demand	Anodyne	DRD4	25	40
Fc1cc(S[C@H]2CCCN(Cc3ccccc3)C2)ncn1	ZINC000853698967	DG	On-Demand	Anodyne	SIGMAR1	36	42
Fc1cc(S[C@@H]2CCCN(Cc3ccccc3)C2)ncn1	ZINC000853698968	DG	On-Demand	Anodyne	DRD4	25	40
Fc1cc(S[C@@H]2CCCN(Cc3ccccc3)C2)ncn1	ZINC000853698968	DG	On-Demand	Anodyne	SIGMAR1	36	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc(SC)nc2)CC1	ZINC000853699040	FD	On-Demand	Anodyne	P2RY12	50	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc(SC)nc2)CC1	ZINC000853699041	FD	On-Demand	Anodyne	P2RY12	50	38
O=C(OCC(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccc(CSc2nc[nH]n2)cc1	ZINC000853699180	IG	On-Demand	Anodyne	SSTR4	43	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccn(C)c2C(=O)OC)CC1	ZINC000853699186	FC	On-Demand	Anodyne	P2RY12	45	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccn(C)c2C(=O)OC)CC1	ZINC000853699189	FC	On-Demand	Anodyne	P2RY12	45	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OCCOC)c2)CC1	ZINC000853699235	GD	On-Demand	Anodyne	P2RY12	179	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OCCOC)c2)CC1	ZINC000853699236	GD	On-Demand	Anodyne	P2RY12	179	49
COC(=O)c1c(OCc2ccc(OC)cc2)ccn1C	ZINC000853699242	CE	On-Demand	Anodyne	MTNR1B	18	44
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(N3CCCC3)c2)C1	ZINC000853699245	FG	On-Demand	Anodyne	GPR119	32	46
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(N3CCCC3)c2)C1	ZINC000853699246	FG	On-Demand	Anodyne	GPR119	32	46
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	CHRM2	20	44
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	CHRM1	16	44
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	DRD2	20	47
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	DRD4	47	47
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	ACHE	40	46
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	KCNH2	15	44
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	CHRM3	25	44
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	SIGMAR1	45	50
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	SSTR5	59	37
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	CCR3	26	40
C[C@@H](ON=C(N)c1ccco1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853699254	FE	On-Demand	Mild	MCHR1	42	46
CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853699274	GE	On-Demand	Mild	GPR119	29	49
CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=N)NOCCc1ccc(C#N)cc1	ZINC000853699275	GE	On-Demand	Mild	GPR119	29	49
CC(C)(C)OC(=O)NCc1ccccc1OC[C@H]1CCN(S(C)(=O)=O)C1	ZINC000853699302	GE	On-Demand	Anodyne	GPR119	23	43
CC(C)(C)OC(=O)NCc1ccccc1OC[C@@H]1CCN(S(C)(=O)=O)C1	ZINC000853699303	GE	On-Demand	Anodyne	GPR119	23	43
C[C@@H](NC(=O)N1CCc2nccnc2C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000853699335	GE	On-Demand	Anodyne	MAPK1	51	39
Cc1cncc(=O)n1C[C@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853699353	DD	On-Demand	Anodyne	GPR119	30	42
Cc1cncc(=O)n1C[C@@H]1CN(C(=O)OC(C)(C)C)CCO1	ZINC000853699354	DD	On-Demand	Anodyne	GPR119	30	42
C[C@@H](NC(=O)N1CCC(O)(CO)CC1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000853699361	GD	On-Demand	Anodyne	CACNA1H	45	37
CC(C)(C)OC(=O)NCc1ccc(OCc2ncnn2-c2ccccc2)cc1	ZINC000853699401	GH	On-Demand	Anodyne	PDS	58	37
COc1ccc(N2CC[C@H](CNc3cc(Br)cnc3C#N)C2)cc1	ZINC000853699406	GH	On-Demand	Mild	IKBKE	15	40
CC(C)(C)OC(=O)NCc1ccc(OCCOC(F)F)cc1	ZINC000853699443	DG	On-Demand	Anodyne	PDS	72	41
COC[C@@H](COc1ccccc1CNC(=O)OC(C)(C)C)OC	ZINC000853699467	EF	On-Demand	Anodyne	PDS	68	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3ccccn3)n2)CC1	ZINC000853699489	FD	On-Demand	Anodyne	P2RY12	137	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3ccccn3)n2)CC1	ZINC000853699490	FD	On-Demand	Anodyne	P2RY12	137	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccc(-c3ccccn3)n2)C1	ZINC000853699491	EF	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccc(-c3ccccn3)n2)C1	ZINC000853699492	EF	On-Demand	Anodyne	GPR119	25	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccncc2=O)CC1	ZINC000853699524	DC	On-Demand	Anodyne	P2RY12	49	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccncc2=O)CC1	ZINC000853699525	DC	On-Demand	Anodyne	P2RY12	49	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C)cncc2=O)CC1	ZINC000853699561	DC	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C)cncc2=O)CC1	ZINC000853699562	DC	On-Demand	Anodyne	P2RY12	55	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2-n2cccn2)CC1	ZINC000853699577	FD	On-Demand	Anodyne	P2RY12	175	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2-n2cccn2)CC1	ZINC000853699578	FD	On-Demand	Anodyne	P2RY12	175	41
O=C(c1ccccc1)N1CC[C@H](COc2ccc3cc[nH]c3c2)C1	ZINC000853699623	DH	On-Demand	Anodyne	GRIN2B	57	50
O=C(c1ccccc1)N1CC[C@H](COc2ccc3cc[nH]c3c2)C1	ZINC000853699623	DH	On-Demand	Anodyne	CHEK2	32	49
O=C(c1ccccc1)N1CC[C@H](COc2ccc3cc[nH]c3c2)C1	ZINC000853699623	DH	On-Demand	Anodyne	SLC18A3	15	42
O=C(c1ccccc1)N1CC[C@@H](COc2ccc3cc[nH]c3c2)C1	ZINC000853699624	DH	On-Demand	Anodyne	GRIN2B	57	50
O=C(c1ccccc1)N1CC[C@@H](COc2ccc3cc[nH]c3c2)C1	ZINC000853699624	DH	On-Demand	Anodyne	CHEK2	32	49
O=C(c1ccccc1)N1CC[C@@H](COc2ccc3cc[nH]c3c2)C1	ZINC000853699624	DH	On-Demand	Anodyne	SLC18A3	15	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3cc[nH]c3c2)CC1	ZINC000853699627	EE	On-Demand	Anodyne	P2RY12	131	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3cc[nH]c3c2)CC1	ZINC000853699628	EE	On-Demand	Anodyne	P2RY12	131	38
COC(=O)Cc1ccnc(NC[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853699640	FF	On-Demand	Clean	GRIN2B	20	43
COC(=O)Cc1ccnc(NC[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853699641	FF	On-Demand	Clean	GRIN2B	20	43
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccn3ncc(C#N)c23)C1	ZINC000853699642	ED	On-Demand	Mild	GPR119	19	40
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccn3ncc(C#N)c23)C1	ZINC000853699643	ED	On-Demand	Mild	GPR119	19	40
COC[C@@H](COc1ccc(CNC(=O)OC(C)(C)C)cc1)OC	ZINC000853699647	EF	On-Demand	Anodyne	PDS	86	48
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccnc2C(=O)c2ccncc2)C1	ZINC000853699730	FE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccnc2C(=O)c2ccncc2)C1	ZINC000853699731	FE	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)NCc1ccccc1OCCOC(F)F	ZINC000853699732	DG	On-Demand	Anodyne	PDS	47	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2C(=O)c2cccs2)CC1	ZINC000853699798	GE	On-Demand	Anodyne	P2RY12	42	34
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2C(=O)c2cccs2)CC1	ZINC000853699799	GE	On-Demand	Anodyne	P2RY12	42	34
CC(C)(C)OC(=O)N1CCOc2cc(OCCC3(O)CCC3)ccc2C1	ZINC000853699818	FH	On-Demand	Anodyne	GPR119	17	40
CC(C)(C)OC(=O)N1CCO[C@H](Cn2ccncc2=O)C1	ZINC000853699828	CC	On-Demand	Anodyne	GPR119	26	42
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2ccncc2=O)C1	ZINC000853699829	CC	On-Demand	Anodyne	GPR119	26	42
CO[C@@H](COc1ccc(CNC(=O)OC(C)(C)C)cc1)C1CCC1	ZINC000853699858	EH	On-Demand	Anodyne	CACNA1B	15	48
CO[C@@H](COc1ccc(CNC(=O)OC(C)(C)C)cc1)C1CCC1	ZINC000853699858	EH	On-Demand	Anodyne	PDS	57	39
COC(=O)C1(COc2ccc(CNC(=O)OC(C)(C)C)cc2)CC1	ZINC000853699861	EG	On-Demand	Anodyne	PDS	44	35
CC(C)(C)OC(=O)NCc1ccc(OCc2cccnc2N)cc1	ZINC000853699869	EG	On-Demand	Anodyne	PDS	44	35
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccccc2-n2cccn2)C1	ZINC000853699892	FF	On-Demand	Anodyne	GPR119	29	40
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccccc2-n2cccn2)C1	ZINC000853699893	FF	On-Demand	Anodyne	GPR119	29	40
CO[C@@H](COc1ccccc1CNC(=O)OC(C)(C)C)C1CCC1	ZINC000853699923	EH	On-Demand	Anodyne	REN	31	40
COc1ccc(N2CC[C@H](CNc3cc(C(C)=O)ccn3)C2)cc1	ZINC000853699951	EG	On-Demand	Clean	F10	18	49
COc1ccc(N2CC[C@H](CNc3cc(C(C)=O)ccn3)C2)cc1	ZINC000853699951	EG	On-Demand	Clean	GRIN2B	17	42
CC(C)n1ncnc1COc1ccc(CNC(=O)OC(C)(C)C)cc1	ZINC000853699957	EG	On-Demand	Anodyne	PDS	42	34
CC(C)(C)OC(=O)NCc1ccc(OC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853699962	GE	On-Demand	Anodyne	MMP13	25	41
CC(C)(C)OC(=O)NCc1ccc(OC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853699962	GE	On-Demand	Anodyne	MMP1	23	41
CC(C)(C)OC(=O)NCc1ccc(OC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853699962	GE	On-Demand	Anodyne	GPR119	29	49
CC(C)(C)OC(=O)NCc1ccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853699963	GE	On-Demand	Anodyne	MMP13	25	41
CC(C)(C)OC(=O)NCc1ccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853699963	GE	On-Demand	Anodyne	MMP1	23	41
CC(C)(C)OC(=O)NCc1ccc(OC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853699963	GE	On-Demand	Anodyne	GPR119	29	49
C#CCOCCOc1ccc(CNC(=O)OC(C)(C)C)cc1	ZINC000853700015	DF	On-Demand	Mild	PDS	45	36
CC(C)(C)OC(=O)N1CCOc2cc(OCc3cc(C4CC4)no3)ccc2C1	ZINC000853700017	GI	On-Demand	Anodyne	GPR119	32	40
Cc1nonc1COc1ccccc1CNC(=O)OC(C)(C)C	ZINC000853700073	DF	On-Demand	Anodyne	CACNA1D	15	46
CC(=O)c1ccc2c(c1)oc(=O)n2Cc1oc(C)nc1C	ZINC000853700080	CE	On-Demand	Anodyne	MIF	16	43
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncn(-c3ccccc3)c2=O)CC1	ZINC000853700132	FC	On-Demand	Anodyne	P2RY12	168	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncn(-c3ccccc3)c2=O)CC1	ZINC000853700133	FC	On-Demand	Anodyne	P2RY12	168	41
CC(C)(C)OC(=O)NCc1ccccc1OCC1(CC#N)CC1	ZINC000853700138	DH	On-Demand	Mild	PAPA1_CARPA	36	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2C(=O)c2ccncc2)CC1	ZINC000853700157	GD	On-Demand	Anodyne	P2RY12	44	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2C(=O)c2ccncc2)CC1	ZINC000853700158	GD	On-Demand	Anodyne	P2RY12	44	39
Cc1nocc1COc1ccc2c(c1)OCCN(C(=O)OC(C)(C)C)C2	ZINC000853700159	FH	On-Demand	Anodyne	GPR119	19	40
C[C@@H](NC(=O)NCC1CCC(O)CC1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000853700162	GF	On-Demand	Anodyne	CACNA1I	49	34
C[C@H](NC(=O)NCC1CCC(O)CC1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000853700163	GF	On-Demand	Anodyne	CACNA1I	49	34
CN1CCN(C(=O)OC(C)(C)C)C[C@@H]1C(=N)NOCc1cncs1	ZINC000853700185	FD	On-Demand	Anodyne	GPR119	25	40
CN1CCN(C(=O)OC(C)(C)C)C[C@H]1C(=N)NOCc1cncs1	ZINC000853700186	FD	On-Demand	Anodyne	GPR119	25	40
CO[C@@H](COc1ccc(CNC(=O)OC(C)(C)C)cc1)[C@H]1CCOC1	ZINC000853700205	FG	On-Demand	Anodyne	PDS	45	36
CO[C@@H](COc1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@H]1CCOC1	ZINC000853700206	FG	On-Demand	Anodyne	PDS	45	36
O=C(NCCCc1c[nH]c2ccccc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853700219	EH	On-Demand	Anodyne	CCKAR	45	37
O=C(NCCCc1c[nH]c2ccccc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853700219	EH	On-Demand	Anodyne	NMBR	62	35
O=C(NCCCc1c[nH]c2ccccc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853700219	EH	On-Demand	Anodyne	CCKBR	45	40
O=C(NCCCc1c[nH]c2ccccc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853700220	EH	On-Demand	Anodyne	CCKAR	45	37
O=C(NCCCc1c[nH]c2ccccc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853700220	EH	On-Demand	Anodyne	NMBR	62	35
O=C(NCCCc1c[nH]c2ccccc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853700220	EH	On-Demand	Anodyne	CCKBR	45	40
O=C(NCCCc1c[nH]c2ccccc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853700221	EH	On-Demand	Anodyne	CCKAR	45	37
O=C(NCCCc1c[nH]c2ccccc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853700221	EH	On-Demand	Anodyne	NMBR	62	35
O=C(NCCCc1c[nH]c2ccccc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853700221	EH	On-Demand	Anodyne	CCKBR	45	40
O=C(NCCCc1c[nH]c2ccccc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853700222	EH	On-Demand	Anodyne	CCKAR	45	37
O=C(NCCCc1c[nH]c2ccccc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853700222	EH	On-Demand	Anodyne	NMBR	62	35
O=C(NCCCc1c[nH]c2ccccc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853700222	EH	On-Demand	Anodyne	CCKBR	45	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C)S(=O)(=O)N(C)C)CC1	ZINC000853700226	FB	On-Demand	Anodyne	CHRNA3	17	41
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C)S(=O)(=O)N(C)C)CC1	ZINC000853700227	FB	On-Demand	Anodyne	CHRNA3	17	41
Fc1ncnc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1Br	ZINC000853700235	GG	On-Demand	Anodyne	ADK	21	60
Fc1cnc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cn1	ZINC000853700238	CE	On-Demand	Anodyne	ADK	17	50
COC(=O)[C@@H]1CN(c2cnc(F)cn2)C[C@H]1c1ccc(Br)cc1	ZINC000853700266	GF	On-Demand	Anodyne	SLC6A4	22	44
COC(=O)[C@@H]1CN(c2cnc(F)cn2)C[C@H]1c1ccc(Br)cc1	ZINC000853700266	GF	On-Demand	Anodyne	SLC6A3	35	44
O=C(CCCc1ccccc1)NCCNc1ncnc(F)c1Br	ZINC000853700267	GF	On-Demand	Anodyne	FAAH	53	37
O=C(CCCc1ccccc1)NCCNc1ncnc(F)c1Br	ZINC000853700267	GF	On-Demand	Anodyne	CES1	51	37
O=C(CCCc1ccccc1)NCCNc1ncnc(F)c1Br	ZINC000853700267	GF	On-Demand	Anodyne	CES1D	45	33
COc1cccc(Nc2nc(N[C@@H]3CC[C@H]3O)nc3[nH]cnc23)c1	ZINC000853700269	EE	On-Demand	Anodyne	PDPK1	17	49
COc1cccc(Nc2nc(N[C@@H]3CC[C@H]3O)nc3[nH]cnc23)c1	ZINC000853700269	EE	On-Demand	Anodyne	SYK	32	41
COc1cccc(Nc2nc(N[C@@H]3CC[C@H]3O)nc3[nH]cnc23)c1	ZINC000853700269	EE	On-Demand	Anodyne	CDK1	24	52
COc1cccc(Nc2nc(N[C@@H]3CC[C@H]3O)nc3[nH]cnc23)c1	ZINC000853700269	EE	On-Demand	Anodyne	TTK	41	40
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	HTR1D	63	36
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	HTR1B	57	39
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	SSTR2	73	36
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	CCKAR	49	36
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	MC3R	64	37
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	MC5R	72	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	GHSR	42	37
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	MC1R	79	37
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700289	GG	On-Demand	Anodyne	KISS1R	48	31
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	HTR1D	63	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	HTR1B	57	39
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	SSTR2	73	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	CCKAR	49	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	MC3R	64	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	MC5R	72	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	GHSR	42	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	MC1R	79	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCCc2c[nH]c3ccccc23)C1	ZINC000853700290	GG	On-Demand	Anodyne	KISS1R	48	31
N#Cc1ncc(Br)cc1NCCNC(=O)CCCc1ccccc1	ZINC000853700296	GG	On-Demand	Mild	CES1	41	38
N#Cc1ncc(Br)cc1NCCNC(=O)CCCc1ccccc1	ZINC000853700296	GG	On-Demand	Mild	CES1D	55	35
C#CCCN(CCOC)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700298	EF	On-Demand	Mild	CCKAR	52	37
C#CCCN(CCOC)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700298	EF	On-Demand	Mild	MPO	63	36
O=C1CCC2=C(CCN(C(=O)NCCCc3c[nH]c4ccccc34)C2)N1	ZINC000853700321	FF	On-Demand	Anodyne	SSTR2	22	41
O[C@@H]1CC[C@H]1Nc1nc(Nc2ccccc2)c2nc[nH]c2n1	ZINC000853700326	CE	On-Demand	Anodyne	TTK	38	44
COC(=O)N(C)CCNC(=O)N[C@H](COc1ccccc1)c1ccccc1	ZINC000853700354	FF	On-Demand	Anodyne	UTS2	49	37
COC(=O)N(C)CCNC(=O)N[C@H](COc1ccccc1)c1ccccc1	ZINC000853700354	FF	On-Demand	Anodyne	PDS	45	36
COC(=O)N(C)CCNC(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000853700355	FF	On-Demand	Anodyne	UTS2	49	37
COC(=O)N(C)CCNC(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000853700355	FF	On-Demand	Anodyne	PDS	45	36
CC(C)(C)OC(=O)N1CCC(COc2ccc(-n3c(O)nnc3O)cc2)CC1	ZINC000853700359	GF	On-Demand	Anodyne	GPR119	69	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C(=O)OC)cccc2=O)CC1	ZINC000853700366	FC	On-Demand	Anodyne	P2RY12	129	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C(=O)OC)cccc2=O)CC1	ZINC000853700367	FC	On-Demand	Anodyne	P2RY12	129	42
COCCN(CCF)C(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000853700402	FG	On-Demand	Anodyne	UTS2	41	34
C#Cc1cccnc1N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000853700404	DF	On-Demand	Mild	ADK	18	52
O=C(NCCCc1c[nH]c2ccccc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853700424	GE	On-Demand	Anodyne	TPR	15	46
O=C(NCCCc1c[nH]c2ccccc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853700424	GE	On-Demand	Anodyne	CCKAR	46	37
O=C(NCCCc1c[nH]c2ccccc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853700424	GE	On-Demand	Anodyne	MPO	64	37
O=C(NCCCc1c[nH]c2ccccc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853700424	GE	On-Demand	Anodyne	NMBR	44	38
O=C(NCCCc1c[nH]c2ccccc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853700424	GE	On-Demand	Anodyne	MMP9	15	46
O=C(NCCCc1c[nH]c2ccccc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853700424	GE	On-Demand	Anodyne	KISS1R	45	30
O=C(CCCc1ccccc1)NCCNc1cnc(F)cn1	ZINC000853700472	DE	On-Demand	Anodyne	FAAH	61	37
O=C(CCCc1ccccc1)NCCNc1cnc(F)cn1	ZINC000853700472	DE	On-Demand	Anodyne	CES1	61	36
O=C(CCCc1ccccc1)NCCNc1cnc(F)cn1	ZINC000853700472	DE	On-Demand	Anodyne	CES1D	54	32
O[C@@H]1CC[C@H]1Nc1nc(NCc2ccccc2)c2ccccc2n1	ZINC000853700491	DG	On-Demand	Anodyne	MERTK	15	41
O[C@@H]1CC[C@H]1Nc1nc(NCc2ccccc2)c2ccccc2n1	ZINC000853700491	DG	On-Demand	Anodyne	PKNB	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnnc2Nc2cccnc2)CC1	ZINC000853700518	FD	On-Demand	Anodyne	P2RY12	81	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnnc2Nc2cccnc2)CC1	ZINC000853700519	FD	On-Demand	Anodyne	P2RY12	81	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2CS(C)(=O)=O)CC1	ZINC000853700535	GD	On-Demand	Anodyne	P2RY12	58	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2CS(C)(=O)=O)CC1	ZINC000853700536	GD	On-Demand	Anodyne	P2RY12	58	39
CCCCC[C@@H](C)NC(=O)COc1ccc(-n2c(O)nnc2O)cc1	ZINC000853700549	EE	On-Demand	Anodyne	PLA2G4B	85	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)OCc2ncc[nH]2)CC1	ZINC000853700557	DC	On-Demand	Anodyne	P2RY12	59	38
CCOC(=O)N1CCN(C(=O)[C@H](C)OCc2ncc[nH]2)CC1	ZINC000853700558	DC	On-Demand	Anodyne	P2RY12	59	38
COC(=O)[C@@H]1CN(c2cc(F)ncn2)C[C@H]1c1ccc(Br)cc1	ZINC000853700559	GF	On-Demand	Anodyne	SLC6A4	27	43
COC(=O)[C@@H]1CN(c2cc(F)ncn2)C[C@H]1c1ccc(Br)cc1	ZINC000853700559	GF	On-Demand	Anodyne	SLC6A3	39	43
CON(C)CCNC(=O)N[C@H](COc1ccccc1)c1ccccc1	ZINC000853700561	EF	On-Demand	Anodyne	UTS2	53	38
CON(C)CCNC(=O)N[C@H](COc1ccccc1)c1ccccc1	ZINC000853700561	EF	On-Demand	Anodyne	PDS	56	37
CON(C)CCNC(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000853700562	EF	On-Demand	Anodyne	UTS2	53	38
CON(C)CCNC(=O)N[C@@H](COc1ccccc1)c1ccccc1	ZINC000853700562	EF	On-Demand	Anodyne	PDS	56	37
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccccc2CS(C)(=O)=O)C1	ZINC000853700570	GE	On-Demand	Anodyne	GPR119	42	38
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccccc2CS(C)(=O)=O)C1	ZINC000853700571	GE	On-Demand	Anodyne	GPR119	42	38
O=C(CCCc1ccccc1)NCCNc1cc(F)ncn1	ZINC000853700581	DE	On-Demand	Anodyne	FAAH	51	36
O=C(CCCc1ccccc1)NCCNc1cc(F)ncn1	ZINC000853700581	DE	On-Demand	Anodyne	CES1	54	35
O=C(CCCc1ccccc1)NCCNc1cc(F)ncn1	ZINC000853700581	DE	On-Demand	Anodyne	SUCNR1	40	35
O=C(CCCc1ccccc1)NCCNc1cc(F)ncn1	ZINC000853700581	DE	On-Demand	Anodyne	CES1D	42	29
O=C(COc1ccc(-n2c(O)nnc2O)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853700594	GE	On-Demand	Anodyne	KCNQ2	19	45
O=C(COc1ccc(-n2c(O)nnc2O)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853700594	GE	On-Demand	Anodyne	PRNP	45	34
O=C(COc1ccc(-n2c(O)nnc2O)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853700594	GE	On-Demand	Anodyne	MCHR1	22	48
Cc1ccccc1CN1CCC(NC(=O)COc2ccc3cc[nH]c3c2)CC1	ZINC000853700602	GH	On-Demand	Anodyne	DRD4	24	57
Cc1ccccc1CN1CCC(NC(=O)COc2ccc3cc[nH]c3c2)CC1	ZINC000853700602	GH	On-Demand	Anodyne	HTR1B	21	46
Cc1ccccc1CN1CCC(NC(=O)COc2ccc3cc[nH]c3c2)CC1	ZINC000853700602	GH	On-Demand	Anodyne	LTA4H	16	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc3cc[nH]c3c2)CC1	ZINC000853700602	GH	On-Demand	Anodyne	SIGMAR1	24	48
Cc1ccccc1CN1CCC(NC(=O)COc2ccc3cc[nH]c3c2)CC1	ZINC000853700602	GH	On-Demand	Anodyne	SSTR5	53	37
Cc1ccccc1CN1CCC(NC(=O)COc2ccc3cc[nH]c3c2)CC1	ZINC000853700602	GH	On-Demand	Anodyne	CCR3	31	44
Cc1ccccc1CN1CCC(NC(=O)COc2ccc3cc[nH]c3c2)CC1	ZINC000853700602	GH	On-Demand	Anodyne	MCHR1	35	52
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	HTR1A	15	46
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	MC4R	16	40
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	CCKAR	43	39
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	MPO	79	38
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	MC3R	27	40
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	GRIA1	17	44
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	MMP11	40	31
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	MMP9	15	47
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	MC1R	34	42
COCCN(CCF)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700646	DF	On-Demand	Anodyne	KISS1R	57	31
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700648	FG	On-Demand	Mild	SSTR2	42	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700648	FG	On-Demand	Mild	CCKAR	82	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700648	FG	On-Demand	Mild	MPO	54	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700648	FG	On-Demand	Mild	CCKBR	55	40
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	CCKAR	52	39
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	BRS3	26	40
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	NMBR	51	31
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	MC3R	64	36
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	MC5R	70	36
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	MTNR1A	17	42
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	GRPR	63	31
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	GHSR	55	46
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	MC1R	83	36
Cn1c(S)nnc1CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700694	FE	On-Demand	Anodyne	KISS1R	48	31
CO[C@@H](COc1ccc(F)cc1C(=O)c1ccccc1)[C@@H]1CCOC1	ZINC000853700697	EG	On-Demand	Anodyne	ABCB1	15	41
CO[C@@H](COc1ccc(F)cc1C(=O)c1ccccc1)[C@H]1CCOC1	ZINC000853700700	EG	On-Demand	Anodyne	ABCB1	15	41
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853700736	FE	On-Demand	Anodyne	HTR1B	29	40
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853700736	FE	On-Demand	Anodyne	SSTR2	66	39
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853700736	FE	On-Demand	Anodyne	MC5R	39	41
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853700737	FE	On-Demand	Anodyne	HTR1B	29	40
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853700737	FE	On-Demand	Anodyne	SSTR2	66	39
O=C(NCCCc1c[nH]c2ccccc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853700737	FE	On-Demand	Anodyne	MC5R	39	41
C#CCOCCOc1cccc2c1CCCC(=O)N2	ZINC000853700777	CD	On-Demand	Mild	CHS1	53	33
O=C(NCCCc1c[nH]c2ccccc12)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700780	GH	On-Demand	Anodyne	CCKAR	60	39
O=C(NCCCc1c[nH]c2ccccc12)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700780	GH	On-Demand	Anodyne	MPO	92	41
O=C(NCCCc1c[nH]c2ccccc12)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700780	GH	On-Demand	Anodyne	BRS3	26	40
O=C(NCCCc1c[nH]c2ccccc12)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700780	GH	On-Demand	Anodyne	MC3R	43	36
O=C(NCCCc1c[nH]c2ccccc12)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700780	GH	On-Demand	Anodyne	MC1R	52	39
O=C(NCCCc1c[nH]c2ccccc12)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700780	GH	On-Demand	Anodyne	KISS1R	64	33
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700782	GH	On-Demand	Anodyne	CCKAR	60	39
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700782	GH	On-Demand	Anodyne	MPO	92	41
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700782	GH	On-Demand	Anodyne	BRS3	26	40
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700782	GH	On-Demand	Anodyne	MC3R	43	36
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700782	GH	On-Demand	Anodyne	MC1R	52	39
O=C(NCCCc1c[nH]c2ccccc12)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853700782	GH	On-Demand	Anodyne	KISS1R	64	33
CC(C)(C)OC(=O)N1CC[C@H](CCOc2ccc(-n3c(O)nnc3O)cc2)C1	ZINC000853700802	GF	On-Demand	Anodyne	GPR119	55	46
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2ccc(-n3c(O)nnc3O)cc2)C1	ZINC000853700805	GF	On-Demand	Anodyne	GPR119	55	46
CC(=O)c1ccnc(N[C@@H]2CC[C@H]2O)c1	ZINC000853700810	BD	On-Demand	Anodyne	TYK2	38	42
Fc1cc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)ncn1	ZINC000853700845	CE	On-Demand	Anodyne	ADK	19	54
Cn1nnc2c(N[C@@H]3CC[C@H]3O)ncnc21	ZINC000853700857	BB	On-Demand	Anodyne	ADORA1	20	42
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)COc2ccc3oc4ccccc4c3c2)cc1OC	ZINC000853700881	JJ	On-Demand	Anodyne	CPT1A	119	42
O=C(NCCCc1c[nH]c2ccccc12)NCCc1nnc(S)n1C1CC1	ZINC000853700906	GF	On-Demand	Anodyne	MC3R	52	35
O=C(NCCCc1c[nH]c2ccccc12)NCCc1nnc(S)n1C1CC1	ZINC000853700906	GF	On-Demand	Anodyne	GHSR	43	40
O=C(NCCCc1c[nH]c2ccccc12)NCCc1nnc(S)n1C1CC1	ZINC000853700906	GF	On-Demand	Anodyne	MC1R	40	38
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3cc(C#N)cnn3)[C@@H]2C1	ZINC000853700908	DD	On-Demand	Mild	GPR119	44	50
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	HTR1A	15	48
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	HTR1D	38	41
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	HTR1B	27	41
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	TACR1	25	43
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	CCKAR	85	42
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	BCHE	15	42
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MPO	60	39
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	BRS3	26	42
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	NMBR	66	31
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MC3R	40	39
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MTNR1A	46	49
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MTNR1B	38	41
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	GRIA1	18	44
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	GRPR	49	31
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MMP11	42	31
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	CCKBR	70	40
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	GHSR	47	37
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MMP9	19	49
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MC1R	53	39
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	MMP1	17	42
CON(C)CCNC(=O)NCCCc1c[nH]c2ccccc12	ZINC000853700920	DD	On-Demand	Anodyne	KISS1R	51	31
C#Cc1cccnc1NCCNC(=O)CCCc1ccccc1	ZINC000853700931	DF	On-Demand	Mild	FAAH	46	38
C#Cc1cccnc1NCCNC(=O)CCCc1ccccc1	ZINC000853700931	DF	On-Demand	Mild	CES1	52	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(Br)n2)CC1	ZINC000853700934	FC	On-Demand	Anodyne	P2RY12	76	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(Br)n2)CC1	ZINC000853700935	FC	On-Demand	Anodyne	P2RY12	76	38
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(N2CCOC2=O)CC1	ZINC000853700943	FF	On-Demand	Anodyne	HTR1B	27	42
O=C(NCCCc1c[nH]c2ccccc12)N1CCC(N2CCOC2=O)CC1	ZINC000853700943	FF	On-Demand	Anodyne	MC5R	33	40
CC(C)(C)OC(=O)N1Cc2cnn(C3CCN(c4cc(C#N)cnn4)CC3)c2C1	ZINC000853700945	GF	On-Demand	Mild	GPR119	18	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(OC)c(C#N)ccc2=O)CC1	ZINC000853700963	FC	On-Demand	Mild	P2RY12	51	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(OC)c(C#N)ccc2=O)CC1	ZINC000853700964	FC	On-Demand	Mild	P2RY12	51	38
CNC(=O)c1n[nH]c(C2CCN(c3ccc(C)nn3)CC2)n1	ZINC000853700986	DC	On-Demand	Anodyne	SCD1	30	42
CNC(=O)c1n[nH]c(C2CCN(c3nccc4cc(OC)c(OC)cc34)CC2)n1	ZINC000853701002	GE	On-Demand	Anodyne	PDE3B	44	34
O=C(COc1cccc2cnoc12)Nc1ccc(N2CCOCC2)cc1	ZINC000853701003	FF	On-Demand	Anodyne	PIK3CA	44	37
O=C(COc1cccc2cnoc12)Nc1ccc(N2CCOCC2)cc1	ZINC000853701003	FF	On-Demand	Anodyne	JAK2	16	44
O=C(COc1cccc2cnoc12)Nc1ccc(N2CCOCC2)cc1	ZINC000853701003	FF	On-Demand	Anodyne	MTOR	66	37
O=C(COc1cccc2cnoc12)Nc1ccc(N2CCOCC2)cc1	ZINC000853701003	FF	On-Demand	Anodyne	STAT6	73	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(F)(F)F)nc2C)CC1	ZINC000853701026	GE	On-Demand	Anodyne	P2RY12	59	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(F)(F)F)nc2C)CC1	ZINC000853701027	GE	On-Demand	Anodyne	P2RY12	59	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(O)nnc2-c2ccccn2)CC1	ZINC000853701064	FC	On-Demand	Anodyne	P2RY12	138	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(O)nnc2-c2ccccn2)CC1	ZINC000853701065	FC	On-Demand	Anodyne	P2RY12	138	41
N#Cc1ncc(Br)cc1N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000853701077	GG	On-Demand	Mild	ADK	15	50
COc1ccc(-c2nccc(N3C[C@@H]4CCN(C(=O)OC(C)(C)C)C[C@@H]43)n2)cc1	ZINC000853701091	GH	On-Demand	Anodyne	GPR119	42	51
CCOc1cc(N2C[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)nc(C)n1	ZINC000853701104	EF	On-Demand	Anodyne	GPR119	47	48
Cc1ccc(N2CCC(n3ncc4c3CN(C(=O)OC(C)(C)C)C4)CC2)nn1	ZINC000853701105	GG	On-Demand	Anodyne	GPR119	33	41
COCc1cc(CNC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)ccc1F	ZINC000853701115	GG	On-Demand	Anodyne	GPR119	19	41
COCc1cc(CNC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)ccc1F	ZINC000853701116	GG	On-Demand	Anodyne	GPR119	19	41
CC(C)(C)OC(=O)N1Cc2cnn(C3CCN(c4cnccn4)CC3)c2C1	ZINC000853701117	FF	On-Demand	Anodyne	GPR119	24	63
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3cnc(F)cn3)[C@@H]2C1	ZINC000853701125	DE	On-Demand	Anodyne	GPR119	59	47
CC(C)(C)OC(=O)N1Cc2cnn(C3CCN(c4cc(F)ncn4)CC3)c2C1	ZINC000853701153	GF	On-Demand	Anodyne	GPR119	37	46
CN(C[C@@](C)(O)c1ccccc1)c1ccc(C(=O)C2CC2)cc1S(N)(=O)=O	ZINC000853701161	GE	On-Demand	Anodyne	AMY2	44	31
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3cnccn3)[C@@H]2C1	ZINC000853701164	CD	On-Demand	Anodyne	GPR119	55	69
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3nc4ncccc4cc3C#N)[C@@H]2C1	ZINC000853701167	FF	On-Demand	Mild	GPR119	43	46
CN(C[C@@](C)(O)c1ccccc1)c1nccnc1OC1CCC1	ZINC000853701169	DF	On-Demand	Anodyne	AMY2	44	31
Cc1ccc(N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)nn1	ZINC000853701248	CE	On-Demand	Anodyne	SCD	46	52
Cc1ccc(N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)nn1	ZINC000853701251	CE	On-Demand	Anodyne	SCD	46	52
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)COc2ccc3oc4ccccc4c3c2)CC1	ZINC000853701264	JG	On-Demand	Anodyne	P2RY12	100	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)COc2ccc3oc4ccccc4c3c2)CC1	ZINC000853701265	JG	On-Demand	Anodyne	P2RY12	100	39
COCCN(CCF)C(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000853701277	GD	On-Demand	Anodyne	SLC6A1	117	34
COCCN(CCF)C(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000853701277	GD	On-Demand	Anodyne	MBTPS1	20	40
COCCN(CCF)C(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000853701278	GD	On-Demand	Anodyne	SLC6A1	117	34
COCCN(CCF)C(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000853701278	GD	On-Demand	Anodyne	MBTPS1	20	40
CC(C)(C)OC(=O)NCCC(=O)Nc1ccccc1OCCN1CCCCC1	ZINC000853701300	GG	On-Demand	Anodyne	DRD2	23	48
CC(C)(C)OC(=O)NCCC(=O)Nc1ccccc1OCCN1CCCCC1	ZINC000853701300	GG	On-Demand	Anodyne	HRH2	37	47
CC(C)(C)OC(=O)NCCC(=O)Nc1ccccc1OCCN1CCCCC1	ZINC000853701300	GG	On-Demand	Anodyne	HNMT	66	35
CC(C)(C)OC(=O)NCCC(=O)Nc1ccccc1OCCN1CCCCC1	ZINC000853701300	GG	On-Demand	Anodyne	PSMB1	41	37
CCOC(=O)c1nccc(N2C[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)n1	ZINC000853701321	FE	On-Demand	Anodyne	GPR119	57	48
O=C(COc1ccc2oc3ccccc3c2c1)OCC(=O)N1CCN(c2cnccn2)CC1	ZINC000853701412	IF	On-Demand	Anodyne	HTR1D	15	41
O=C(COc1ccc2oc3ccccc3c2c1)OCC(=O)N1CCN(c2cnccn2)CC1	ZINC000853701412	IF	On-Demand	Anodyne	HTR1B	17	41
CN(C[C@@](C)(O)c1ccccc1)c1ccc(C(F)F)cc1[N+](=O)[O-]	ZINC000853701430	EH	On-Demand	Bother	COLA	48	35
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3ncnc(F)c3Br)[C@@H]2C1	ZINC000853701432	GF	On-Demand	Anodyne	GPR119	60	44
C=C(Cl)Cn1nc(C(F)(F)F)c(Cl)c1C	ZINC000853701479	CH	On-Demand	Mild	CCR1	20	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)CCCO3)CC1	ZINC000853701481	FE	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)CCCO3)CC1	ZINC000853701482	FE	On-Demand	Anodyne	P2RY12	43	35
CC(C)(C)OC(=O)NCCC(=O)Nc1ccccc1OCC1CCCC1	ZINC000853701513	FI	On-Demand	Anodyne	REN	45	38
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3cc(F)ncn3)[C@@H]2C1	ZINC000853701546	DE	On-Demand	Anodyne	GPR119	58	51
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3cc(C(C)(C)C)ncn3)[C@@H]2C1	ZINC000853701587	EG	On-Demand	Anodyne	GPR119	53	51
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(Cl)n2)CC1	ZINC000853701605	DC	On-Demand	Anodyne	P2RY12	61	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(Cl)n2)CC1	ZINC000853701609	DC	On-Demand	Anodyne	P2RY12	61	36
O=C(NCCOCC1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853701620	EG	On-Demand	Reactive	CSNK1D	38	43
O=C(NCCCN1C(=O)CNC1=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853701625	GD	On-Demand	Reactive	HRP1_PLAFA	56	33
O[C@@H]1CC[C@H]1Nc1ncnc2c1ncn2-c1ccccc1	ZINC000853701646	CD	On-Demand	Anodyne	ADORA1	51	44
O[C@@H]1CC[C@H]1Nc1ncnc2c1ncn2-c1ccccc1	ZINC000853701646	CD	On-Demand	Anodyne	ADORA3	35	43
COC(=O)c1nccc(N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C[C@@H]2C)n1	ZINC000853701655	GF	On-Demand	Anodyne	GPR119	34	41
COC(=O)c1nccc(N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C[C@H]2C)n1	ZINC000853701688	GF	On-Demand	Anodyne	GPR119	34	41
CCOC(=O)c1nccc(N(C)C[C@](C)(O)c2ccccc2)n1	ZINC000853701742	DD	On-Demand	Anodyne	AMY2	55	35
CCOC(=O)c1nccc(N(C)C[C@@](C)(O)c2ccccc2)n1	ZINC000853701743	DD	On-Demand	Anodyne	AMY2	55	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(CCO)cc2OCC)CC1	ZINC000853701748	GD	On-Demand	Anodyne	P2RY12	48	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(CCO)cc2OCC)CC1	ZINC000853701749	GD	On-Demand	Anodyne	P2RY12	48	36
CCOC(=O)c1nccc(N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)n1	ZINC000853701767	FE	On-Demand	Anodyne	SCD	15	44
CCOC(=O)c1nccc(N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)n1	ZINC000853701769	FE	On-Demand	Anodyne	SCD	15	44
CCOC(=O)c1nccc(N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)n1	ZINC000853701771	FE	On-Demand	Anodyne	SCD	15	44
CCOC(=O)c1nccc(N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)n1	ZINC000853701776	FE	On-Demand	Anodyne	SCD	15	44
CC[C@@](C)(NC(=O)NC[C@@H](C)OC)c1ccccc1	ZINC000853701777	CF	On-Demand	Anodyne	AMY2	54	31
CC[C@@](C)(NC(=O)NC[C@H](C)OC)c1ccccc1	ZINC000853701779	CF	On-Demand	Anodyne	AMY2	54	31
CC(C)(C)OC(=O)N1Cc2cnn(C3CCN(c4cnc(F)cn4)CC3)c2C1	ZINC000853701796	GF	On-Demand	Anodyne	GPR119	31	45
CC[C@@](C)(NC(=O)N[C@H]1COC(C)(C)C1)c1ccccc1	ZINC000853701801	CG	On-Demand	Anodyne	AMY2	44	31
CC[C@@](C)(NC(=O)N[C@@H]1COC(C)(C)C1)c1ccccc1	ZINC000853701803	CG	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C#N)ccc2=O)CC1	ZINC000853701834	EC	On-Demand	Mild	P2RY12	47	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C#N)ccc2=O)CC1	ZINC000853701838	EC	On-Demand	Mild	P2RY12	47	37
N#Cc1cnnc(N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000853701841	DD	On-Demand	Mild	SCD	15	44
N#Cc1cnnc(N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000853701844	DD	On-Demand	Mild	SCD	15	44
N#Cc1cnnc(N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000853701846	DD	On-Demand	Mild	SCD	15	44
N#Cc1cnnc(N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000853701848	DD	On-Demand	Mild	SCD	15	44
CNC(=O)c1n[nH]c(C2CCN(c3ncnc4ccc(C(C)C)cc34)CC2)n1	ZINC000853701886	GF	On-Demand	Anodyne	PDGFRB	43	41
CNC(=O)c1n[nH]c(C2CCN(c3ncnc4ccc(C(C)C)cc34)CC2)n1	ZINC000853701886	GF	On-Demand	Anodyne	PDE3B	41	36
CNC(=O)c1n[nH]c(C2CCN(c3ncnc4ccc(C(C)C)cc34)CC2)n1	ZINC000853701886	GF	On-Demand	Anodyne	SIRT3	60	33
CNC(=O)c1n[nH]c(C2CCN(c3ncnc4ccc(C(C)C)cc34)CC2)n1	ZINC000853701886	GF	On-Demand	Anodyne	SIRT2	52	33
CNC(=O)c1n[nH]c(C2CCN(c3ncnc4ccc(C(C)C)cc34)CC2)n1	ZINC000853701886	GF	On-Demand	Anodyne	SIRT1	51	31
COC(=O)c1nccc(N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)n1	ZINC000853701915	ED	On-Demand	Anodyne	SCD	15	46
COC(=O)c1nccc(N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)n1	ZINC000853701916	ED	On-Demand	Anodyne	SCD	15	46
COC(=O)c1nccc(N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)n1	ZINC000853701917	ED	On-Demand	Anodyne	SCD	15	46
COC(=O)c1nccc(N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)n1	ZINC000853701918	ED	On-Demand	Anodyne	SCD	15	46
CC[C@@](C)(NC(=O)N[C@@H]1C[C@@H](C(=O)OC)C1)c1ccccc1	ZINC000853701925	DF	On-Demand	Anodyne	AMY2	55	32
CC(C)(C)OC(=O)N1CCC(c2cc(CNc3cnccn3)on2)CC1	ZINC000853701977	FG	On-Demand	Anodyne	GPR119	46	48
Cn1nnc2c(N3C[C@@H]4CCN(C(=O)OC(C)(C)C)C[C@@H]43)ncnc21	ZINC000853701991	ED	On-Demand	Anodyne	GPR119	39	42
CC[C@@](C)(NC(=O)NCCOCCF)c1ccccc1	ZINC000853702003	CF	On-Demand	Anodyne	AMY2	53	35
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853702005	GF	On-Demand	Reactive	GPR119	16	40
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853702008	GF	On-Demand	Reactive	GPR119	16	40
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(N)=O)c3)[C@@H]2C1	ZINC000853702009	GE	On-Demand	Bother	GPR119	37	50
CCO[C@@H]1C[C@@H](NC(=O)N[C@](C)(CC)c2ccccc2)C1	ZINC000853702019	CG	On-Demand	Anodyne	AMY2	54	32
CCO[C@@H]1C[C@@H](NC(=O)N[C@@](C)(CC)c2ccccc2)C1	ZINC000853702021	CG	On-Demand	Anodyne	AMY2	54	32
CC(=O)c1ccnc(N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C[C@@H]2C)c1	ZINC000853702065	FH	On-Demand	Anodyne	GPR119	32	41
CC[C@@](C)(NC(=O)NC[C@H]1CCOC1(C)C)c1ccccc1	ZINC000853702069	DG	On-Demand	Anodyne	AMY2	44	30
CC(=O)c1ccnc(N2CC3(CCN(C(=O)OC(C)(C)C)CC3)C[C@H]2C)c1	ZINC000853702070	FH	On-Demand	Anodyne	GPR119	32	41
CC[C@@](C)(NC(=O)NC[C@@H]1CCOC1(C)C)c1ccccc1	ZINC000853702071	DG	On-Demand	Anodyne	AMY2	44	30
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNc3cc(C#N)cnn3)c2)C1	ZINC000853702087	GF	On-Demand	Mild	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNc3cc(C#N)cnn3)c2)C1	ZINC000853702090	GF	On-Demand	Mild	GPR119	47	42
COC(=O)Cc1ccnc(N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000853702091	FE	On-Demand	Anodyne	SCD	18	44
COC(=O)Cc1ccnc(N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000853702094	FE	On-Demand	Anodyne	SCD	18	44
COC(=O)Cc1ccnc(N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000853702097	FE	On-Demand	Anodyne	SCD	18	44
COC(=O)Cc1ccnc(N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000853702099	FE	On-Demand	Anodyne	SCD	18	44
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNc3cnccn3)c2)C1	ZINC000853702125	FF	On-Demand	Anodyne	GPR119	51	45
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNc3cnccn3)c2)C1	ZINC000853702126	FF	On-Demand	Anodyne	GPR119	51	45
CC[C@@](C)(NC(=O)NCC[C@@H](COC)OC)c1ccccc1	ZINC000853702138	DF	On-Demand	Anodyne	AMY2	53	31
CC[C@@](C)(NC(=O)NCC[C@H](COC)OC)c1ccccc1	ZINC000853702139	DF	On-Demand	Anodyne	AMY2	53	31
CC[C@@](C)(NC(=O)N[C@@H]1CCNC1=O)c1ccccc1	ZINC000853702156	CD	On-Demand	Anodyne	AMY2	45	31
CC[C@@](C)(NC(=O)N[C@H]1CCNC1=O)c1ccccc1	ZINC000853702157	CD	On-Demand	Anodyne	AMY2	45	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)CCNC3=O)CC1	ZINC000853702247	GD	On-Demand	Anodyne	P2RY12	53	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)CCNC3=O)CC1	ZINC000853702249	GD	On-Demand	Anodyne	P2RY12	53	35
CO[C@@H](Cn1nc(C(F)(F)F)c(Cl)c1C)C1CCC1	ZINC000853702263	CH	On-Demand	Anodyne	CCR1	18	41
CCCc1ccc(N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)nn1	ZINC000853702281	EF	On-Demand	Anodyne	SCD	49	51
CCCc1ccc(N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)nn1	ZINC000853702282	EF	On-Demand	Anodyne	SCD	49	51
CCCc1ccc(N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)nn1	ZINC000853702283	EF	On-Demand	Anodyne	SCD	49	51
CCCc1ccc(N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)nn1	ZINC000853702284	EF	On-Demand	Anodyne	SCD	49	51
CNC(=O)c1n[nH]c(C2CCN(c3ncnc4c3nnn4C)CC2)n1	ZINC000853702285	EB	On-Demand	Anodyne	SIRT3	41	30
CC(C)c1ccc2ncnc(N[C@@H]3CC[C@H]3O)c2c1	ZINC000853702298	CF	On-Demand	Anodyne	CD38	70	42
CC(C)(C)OC(=O)N1CC[C@@H]2CN(c3nc(C#N)c(Cl)s3)[C@@H]2C1	ZINC000853702322	FG	On-Demand	Mild	GPR119	20	42
COC(=O)c1nccc(N2C[C@@H]3CCN(C(=O)OC(C)(C)C)C[C@@H]32)n1	ZINC000853702328	ED	On-Demand	Anodyne	GPR119	51	51
NS(=O)(=O)c1ccc2nc(N[C@@H]3CC[C@H]3O)[nH]c2c1	ZINC000853702342	CC	On-Demand	Anodyne	NCE103	44	31
NS(=O)(=O)c1ccc2nc(N[C@@H]3CC[C@H]3O)[nH]c2c1	ZINC000853702342	CC	On-Demand	Anodyne	MTCA1	46	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000853702343	GE	On-Demand	Bother	P2RY12	45	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000853702345	GE	On-Demand	Bother	P2RY12	45	36
COC(=O)[C@@H](OC)c1ccccc1OCc1ccc(OC)cc1	ZINC000853702351	DG	On-Demand	Anodyne	LTA4H	15	43
COC(=O)[C@@H](OC)c1ccccc1OCc1ccc(OC)cc1	ZINC000853702351	DG	On-Demand	Anodyne	MTNR1B	16	42
COC(=O)[C@@H](OC)c1ccccc1OCc1ccc(OC)cc1	ZINC000853702351	DG	On-Demand	Anodyne	CAPN2	33	44
COC(=O)[C@@H](OC)c1ccccc1OCc1ccc(OC)cc1	ZINC000853702351	DG	On-Demand	Anodyne	FFAR1	24	43
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	BMP1	52	44
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	MMP2	18	44
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	MMP3	23	45
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	MMP8	18	44
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	NPY5R	22	40
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	MMP9	29	44
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	MMP12	24	45
COc1ccc(CN(C)S(=O)(=O)[C@@H](C)c2ccccc2)cc1	ZINC000853702384	DG	On-Demand	Anodyne	MMP1	25	44
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	BMP1	52	44
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	MMP2	18	44
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	MMP3	23	45
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	MMP8	18	44
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	NPY5R	22	40
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	MMP9	29	44
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	MMP12	24	45
COc1ccc(CN(C)S(=O)(=O)[C@H](C)c2ccccc2)cc1	ZINC000853702386	DG	On-Demand	Anodyne	MMP1	25	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C3CC3)n2)CC1	ZINC000853702391	DD	On-Demand	Anodyne	P2RY12	54	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C3CC3)n2)CC1	ZINC000853702392	DD	On-Demand	Anodyne	P2RY12	54	39
CC[C@@](C)(NC(=O)NC[C@@H]1CCCO[C@H]1c1ccnn1C)c1ccccc1	ZINC000853702405	FH	On-Demand	Anodyne	AMY2	45	31
CC[C@@](C)(NC(=O)NCCO[C@H]1CC1(F)F)c1ccccc1	ZINC000853702409	DG	On-Demand	Anodyne	AMY2	59	34
CC[C@@](C)(NC(=O)NCCO[C@@H]1CC1(F)F)c1ccccc1	ZINC000853702411	DG	On-Demand	Anodyne	AMY2	59	34
CC[C@@](C)(NC(=O)NCCC1CC(OC)C1)c1ccccc1	ZINC000853702423	DG	On-Demand	Anodyne	AMY2	52	31
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNc3cnc(F)cn3)c2)C1	ZINC000853702442	GG	On-Demand	Anodyne	GPR119	55	38
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNc3cnc(F)cn3)c2)C1	ZINC000853702443	GG	On-Demand	Anodyne	GPR119	55	38
O=C(COC(=O)COc1ccc2oc3ccccc3c2c1)NCCc1cccc2cccnc12	ZINC000853702460	JI	On-Demand	Anodyne	MTNR1A	70	43
O=C(COC(=O)COc1ccc2oc3ccccc3c2c1)NCCc1cccc2cccnc12	ZINC000853702460	JI	On-Demand	Anodyne	MTNR1B	46	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(-c3ccccc3)n2)CC1	ZINC000853702477	FD	On-Demand	Anodyne	P2RY12	218	49
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(-c3ccccc3)n2)CC1	ZINC000853702479	FD	On-Demand	Anodyne	P2RY12	218	49
CC[C@@](C)(NC(=O)NCC1(S(C)(=O)=O)CCCCC1)c1ccccc1	ZINC000853702492	FG	On-Demand	Anodyne	AMY2	44	31
Cc1c(NC(=O)[C@H](C)OC(=O)COc2ccc3oc4ccccc4c3c2)cccc1[N+](=O)[O-]	ZINC000853702496	IJ	On-Demand	Bother	COLA	37	40
Cc1c(NC(=O)[C@@H](C)OC(=O)COc2ccc3oc4ccccc4c3c2)cccc1[N+](=O)[O-]	ZINC000853702498	IJ	On-Demand	Bother	COLA	37	40
CNC(=O)c1n[nH]c(C2CCN(c3ccc(OCC(F)(F)F)nn3)CC2)n1	ZINC000853702502	GD	On-Demand	Anodyne	SCD1	43	39
O[C@H]1C[C@]2(CCN(c3cc(Cl)c4ncccc4n3)C2)Oc2ccccc21	ZINC000853702505	FH	On-Demand	Anodyne	SCD	15	41
O[C@H]1C[C@@]2(CCN(c3cc(Cl)c4ncccc4n3)C2)Oc2ccccc21	ZINC000853702506	FH	On-Demand	Anodyne	SCD	15	41
O[C@@H]1C[C@@]2(CCN(c3cc(Cl)c4ncccc4n3)C2)Oc2ccccc21	ZINC000853702507	FH	On-Demand	Anodyne	SCD	15	41
O[C@@H]1C[C@]2(CCN(c3cc(Cl)c4ncccc4n3)C2)Oc2ccccc21	ZINC000853702508	FH	On-Demand	Anodyne	SCD	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3cnoc23)CC1	ZINC000853702517	ED	On-Demand	Anodyne	P2RY12	72	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3cnoc23)CC1	ZINC000853702518	ED	On-Demand	Anodyne	P2RY12	72	39
CC(C)(C)OC(=O)N1CC[C@H](CCOc2cccc3cnoc23)C1	ZINC000853702545	EH	On-Demand	Anodyne	GPR119	46	39
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2cccc3cnoc23)C1	ZINC000853702546	EH	On-Demand	Anodyne	GPR119	46	39
CC(=O)c1ccnc(N2CC[C@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000853702547	DF	On-Demand	Anodyne	SCD	29	46
CC(=O)c1ccnc(N2CC[C@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000853702548	DF	On-Demand	Anodyne	SCD	29	46
CC(=O)c1ccnc(N2CC[C@@]3(C[C@H](O)c4ccccc4O3)C2)c1	ZINC000853702549	DF	On-Demand	Anodyne	SCD	29	46
CC(=O)c1ccnc(N2CC[C@@]3(C[C@@H](O)c4ccccc4O3)C2)c1	ZINC000853702550	DF	On-Demand	Anodyne	SCD	29	46
CC(C)(C)OC(=O)N1CC[C@H](Oc2ccnc(CNc3cc(F)ncn3)c2)C1	ZINC000853702581	GG	On-Demand	Anodyne	GPR119	67	38
CC(C)(C)OC(=O)N1CC[C@@H](Oc2ccnc(CNc3cc(F)ncn3)c2)C1	ZINC000853702582	GG	On-Demand	Anodyne	GPR119	67	38
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853702627	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853702628	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853702629	GE	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853702630	GE	On-Demand	Anodyne	CACNA1I	42	33
CC[C@@](C)(NC(=O)NCC1CCN(C2CCOCC2)CC1)c1ccccc1	ZINC000853702634	FH	On-Demand	Anodyne	HTR4	44	37
CC[C@@](C)(NC(=O)NCC1CCN(C2CCOCC2)CC1)c1ccccc1	ZINC000853702634	FH	On-Demand	Anodyne	AMY2	43	30
CC[C@@](C)(NC(=O)NCC1CCN(C2CCOCC2)CC1)c1ccccc1	ZINC000853702634	FH	On-Demand	Anodyne	CACNA1I	60	38
CC[C@@](C)(NC(=O)NCCN1C[C@@H]2CCCCN2C1=O)c1ccccc1	ZINC000853702636	FF	On-Demand	Anodyne	FKBP1A	22	41
CC[C@@](C)(NC(=O)NCCN1C[C@@H]2CCCCN2C1=O)c1ccccc1	ZINC000853702636	FF	On-Demand	Anodyne	AMY2	44	31
CC[C@@](C)(NC(=O)NCCN1C[C@H]2CCCCN2C1=O)c1ccccc1	ZINC000853702641	FF	On-Demand	Anodyne	FKBP1A	22	41
CC[C@@](C)(NC(=O)NCCN1C[C@H]2CCCCN2C1=O)c1ccccc1	ZINC000853702641	FF	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(N(C)C)cc(N(C)C)c2)CC1	ZINC000853702665	GD	On-Demand	Anodyne	P2RY12	51	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(N(C)C)cc(N(C)C)c2)CC1	ZINC000853702666	GD	On-Demand	Anodyne	P2RY12	51	44
COC(=O)C1(CONC(=N)c2cn(Cc3ccccc3)nn2)CC1	ZINC000853702670	ED	On-Demand	Anodyne	NPFFR1	41	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000853702672	GF	On-Demand	Mild	AR	35	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000853702672	GF	On-Demand	Mild	P2RY12	52	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000853702674	GF	On-Demand	Mild	AR	35	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000853702674	GF	On-Demand	Mild	P2RY12	52	39
O[C@@H]1C[C@@]2(CCN(c3ccc(OCC(F)(F)F)nn3)C2)Oc2ccccc21	ZINC000853702706	GF	On-Demand	Anodyne	SCD	45	48
O[C@@H]1C[C@]2(CCN(c3ccc(OCC(F)(F)F)nn3)C2)Oc2ccccc21	ZINC000853702707	GF	On-Demand	Anodyne	SCD	45	48
O[C@H]1C[C@]2(CCN(c3ccc(OCC(F)(F)F)nn3)C2)Oc2ccccc21	ZINC000853702708	GF	On-Demand	Anodyne	SCD	45	48
O[C@H]1C[C@@]2(CCN(c3ccc(OCC(F)(F)F)nn3)C2)Oc2ccccc21	ZINC000853702709	GF	On-Demand	Anodyne	SCD	45	48
CNC(=O)c1n[nH]c(C2CCN(c3nc4ccccc4n4cccc34)CC2)n1	ZINC000853702718	GE	On-Demand	Anodyne	HTR3A	27	42
COc1ccc(N2CCN(C(=O)COc3cccc4cnoc34)CC2)cc1	ZINC000853702731	FF	On-Demand	Clean	HTR1B	15	46
COc1ccc(N2CCN(C(=O)COc3cccc4cnoc34)CC2)cc1	ZINC000853702731	FF	On-Demand	Clean	SSTR1	45	34
CON(C)CCNC(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000853702744	GC	On-Demand	Anodyne	HRH2	31	45
CON(C)CCNC(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000853702744	GC	On-Demand	Anodyne	SLC6A1	84	33
CON(C)CCNC(=O)NCc1cccc(CN2CCC[C@H](C(N)=O)C2)c1	ZINC000853702744	GC	On-Demand	Anodyne	MBTPS1	21	42
CON(C)CCNC(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000853702745	GC	On-Demand	Anodyne	HRH2	31	45
CON(C)CCNC(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000853702745	GC	On-Demand	Anodyne	SLC6A1	84	33
CON(C)CCNC(=O)NCc1cccc(CN2CCC[C@@H](C(N)=O)C2)c1	ZINC000853702745	GC	On-Demand	Anodyne	MBTPS1	21	42
COC(=O)Cn1cc(Cn2nc(C(F)(F)F)c(Cl)c2C)nn1	ZINC000853702763	ED	On-Demand	Anodyne	CCR1	21	41
CC[C@@](C)(NC(=O)NCc1ccc(CNC(C)=O)cc1)c1ccccc1	ZINC000853702819	FG	On-Demand	Anodyne	PDS	44	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)nc2C#N)CC1	ZINC000853702841	FD	On-Demand	Mild	P2RY12	55	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)nc2C#N)CC1	ZINC000853702842	FD	On-Demand	Mild	P2RY12	55	36
CC[C@@](C)(NC(=O)NCc1cccnc1N1CCCC1)c1ccccc1	ZINC000853702873	FH	On-Demand	Anodyne	KCNQ2	48	33
CC[C@@](C)(NC(=O)NCc1cccnc1N1CCCC1)c1ccccc1	ZINC000853702873	FH	On-Demand	Anodyne	SCN2A	18	43
CC[C@@](C)(NC(=O)NCc1cccnc1N1CCCC1)c1ccccc1	ZINC000853702873	FH	On-Demand	Anodyne	SCN10A	29	43
CC[C@@](C)(NC(=O)NCCc1ccc(C#N)cc1)c1ccccc1	ZINC000853702893	DH	On-Demand	Mild	CTRB_BOVIN	50	39
C#C[C@H](NC(=O)N[C@@](C)(CC)c1ccccc1)C1CCOCC1	ZINC000853702920	DG	On-Demand	Mild	AMY2	45	31
C#C[C@@H](NC(=O)N[C@](C)(CC)c1ccccc1)C1CCOCC1	ZINC000853702921	DG	On-Demand	Mild	AMY2	45	31
C#C[C@@H](NC(=O)N[C@@](C)(CC)c1ccccc1)C1CCOCC1	ZINC000853702922	DG	On-Demand	Mild	AMY2	45	31
C#C[C@H](NC(=O)N[C@](C)(CC)c1ccccc1)C1CCOCC1	ZINC000853702923	DG	On-Demand	Mild	AMY2	45	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(C)(C)C)n2)CC1	ZINC000853702925	ED	On-Demand	Anodyne	P2RY12	55	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(C)(C)C)n2)CC1	ZINC000853702926	ED	On-Demand	Anodyne	P2RY12	55	40
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	CHRM1	15	48
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	DRD2	15	44
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	DRD4	34	44
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	ACHE	52	52
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	SLC6A3	16	41
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	HTR4	61	44
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	CHRM3	27	48
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	GRIN2B	24	40
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	SIGMAR1	41	42
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	SSTR5	56	35
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	CCR3	46	42
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	CACNA1G	41	43
CC[C@@](C)(NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccccc1	ZINC000853702972	GH	On-Demand	Anodyne	CACNA1I	74	42
COC(=O)[C@@H](OC)c1ccccc1OCc1nonc1C	ZINC000853702989	CD	On-Demand	Anodyne	CACNA1D	19	51
CON(C)CCNC(=O)NCCc1ccc(Br)cc1F	ZINC000853703025	ED	On-Demand	Anodyne	MTNR1A	42	41
CON(C)CCNC(=O)NCCc1ccc(Br)cc1F	ZINC000853703025	ED	On-Demand	Anodyne	MTNR1B	20	44
O=C(c1ccccc1)N1CC[C@H](CN2C(=O)OC3(CCCC3)C2=O)C1	ZINC000853703041	EE	On-Demand	Anodyne	L3MBTL3	50	35
O=C(c1ccccc1)N1CC[C@@H](CN2C(=O)OC3(CCCC3)C2=O)C1	ZINC000853703042	EE	On-Demand	Anodyne	L3MBTL3	50	35
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2ccc(Br)cc2F)C1	ZINC000853703054	FE	On-Demand	Anodyne	MTNR1B	16	44
O=C(NCC1CCC(c2ccccc2)CC1)N1CCC(N2CCOC2=O)CC1	ZINC000853703064	GH	On-Demand	Anodyne	SMO	16	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@H](O)c2cccs2)CC1	ZINC000853703103	GD	On-Demand	Anodyne	P2RY12	75	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@@H](O)c2cccs2)CC1	ZINC000853703104	GD	On-Demand	Anodyne	P2RY12	75	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccnc2[C@H](O)c2cccs2)CC1	ZINC000853703105	GD	On-Demand	Anodyne	P2RY12	75	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccnc2[C@@H](O)c2cccs2)CC1	ZINC000853703106	GD	On-Demand	Anodyne	P2RY12	75	36
CC[C@@](C)(NC(=O)NC[C@]12OCCC[C@H]1C2(F)F)c1ccccc1	ZINC000853703127	EG	On-Demand	Anodyne	AMY2	48	34
CC[C@@](C)(NC(=O)NCc1cnc(C(F)(F)F)nc1)c1ccccc1	ZINC000853703135	FH	On-Demand	Anodyne	PDS	50	36
CC[C@@](C)(NC(=O)N[C@@H]1C=CCC1)c1ccccc1	ZINC000853703136	CG	On-Demand	Anodyne	AMY2	54	32
CC[C@@](C)(NC(=O)N[C@H]1C=CCC1)c1ccccc1	ZINC000853703137	CG	On-Demand	Anodyne	AMY2	54	32
COC(=O)N1C[C@H]2CC[C@H]1[C@@H](Nc1ncnc3c1ncn3-c1ccccc1)C2	ZINC000853703143	GF	On-Demand	Anodyne	ADORA1	24	42
COC(=O)N1C[C@H]2CC[C@H]1[C@H](Nc1ncnc3c1ncn3-c1ccccc1)C2	ZINC000853703144	GF	On-Demand	Anodyne	ADORA1	24	42
CC[C@@](C)(NC(=O)NCc1ccc(N2CCC(O)CC2)cc1)c1ccccc1	ZINC000853703155	GH	On-Demand	Clean	CACNA1G	45	34
CN(C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853703159	GF	On-Demand	Anodyne	TRY1_BOVIN	41	38
CN(C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853703159	GF	On-Demand	Anodyne	PREP	43	37
CN(C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853703159	GF	On-Demand	Anodyne	AMY2	44	30
CN(C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853703160	GF	On-Demand	Anodyne	TRY1_BOVIN	41	38
CN(C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853703160	GF	On-Demand	Anodyne	PREP	43	37
CN(C(=O)NC[C@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853703160	GF	On-Demand	Anodyne	AMY2	44	30
CN(C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853703161	GF	On-Demand	Anodyne	TRY1_BOVIN	41	38
CN(C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853703161	GF	On-Demand	Anodyne	PREP	43	37
CN(C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853703161	GF	On-Demand	Anodyne	AMY2	44	30
CN(C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853703162	GF	On-Demand	Anodyne	TRY1_BOVIN	41	38
CN(C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853703162	GF	On-Demand	Anodyne	PREP	43	37
CN(C(=O)NC[C@@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853703162	GF	On-Demand	Anodyne	AMY2	44	30
N#Cc1cc(OCCOC(F)F)ccc1C(F)(F)F	ZINC000853703178	CG	On-Demand	Mild	AR	25	40
C#CCCN(CCOC)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000853703180	FE	On-Demand	Mild	HCN1	55	34
C#CCCN(CCOC)C(=O)NCC1(N2CCC(OC)CC2)CCCC1	ZINC000853703180	FE	On-Demand	Mild	HCN4	53	34
C=CCOCCCNC(=O)N[C@@](C)(CC)c1ccccc1	ZINC000853703194	CG	On-Demand	Mild	AMY2	56	32
C=CCOCCCNC(=O)N[C@](C)(CC)c1ccccc1	ZINC000853703195	CG	On-Demand	Mild	AMY2	56	32
CCc1ncn(Cc2nc3ccccc3s2)n1	ZINC000853703233	BE	On-Demand	Anodyne	AKR1B1	25	41
Cc1ccccc1CN1CCC(NC(=O)CN2C(=O)OC3(CCCC3)C2=O)CC1	ZINC000853703297	GE	On-Demand	Anodyne	SIGMAR1	17	48
Cc1ccccc1CN1CCC(NC(=O)CN2C(=O)OC3(CCCC3)C2=O)CC1	ZINC000853703297	GE	On-Demand	Anodyne	MCHR1	19	42
COc1ccc(N2CCN(C(=O)Cn3c(OC)c(C#N)ccc3=O)CC2)cc1	ZINC000853703304	GD	On-Demand	Mild	CCR1	20	40
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	CHRM2	19	41
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	CHRM1	22	41
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	ACHE	22	43
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	HTR4	63	36
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	CHRM4	26	41
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	CHRM5	15	41
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	CHRM3	38	42
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	SIGMAR1	24	45
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	AMY2	45	32
CC[C@@](C)(NC(=O)NCC1CCN(CC2CC2)CC1)c1ccccc1	ZINC000853703318	EH	On-Demand	Anodyne	CACNA1I	71	43
CC(C)(C)OC(=O)N1CCC[C@H]1CNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853703323	GG	On-Demand	Mild	LGMN	56	37
CC(C)(C)OC(=O)N1CCC[C@@H]1CNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853703324	GG	On-Demand	Mild	LGMN	56	37
CC[C@@](C)(NC(=O)NCCN(C)C(=O)OC)c1ccccc1	ZINC000853703381	DE	On-Demand	Anodyne	AMY2	57	35
CC[C@@](C)(NC(=O)NCC1SCCS1)c1ccccc1	ZINC000853703383	DG	On-Demand	Anodyne	AMY2	53	33
CC[C@@](C)(NC(=O)NCc1ccc(F)c(S(N)(=O)=O)c1)c1ccccc1	ZINC000853703388	GF	On-Demand	Anodyne	CA2	26	41
CC[C@@](C)(NC(=O)NCc1ccc(F)c(S(N)(=O)=O)c1)c1ccccc1	ZINC000853703388	GF	On-Demand	Anodyne	CA1	20	40
CC[C@@](C)(NC(=O)NCc1ccc(F)c(S(N)(=O)=O)c1)c1ccccc1	ZINC000853703388	GF	On-Demand	Anodyne	TRPV1	21	43
CC[C@@](C)(NC(=O)NCc1ccc(F)c(S(N)(=O)=O)c1)c1ccccc1	ZINC000853703388	GF	On-Demand	Anodyne	CA4	24	40
CC[C@@](C)(NC(=O)NCc1ccc(F)c(S(N)(=O)=O)c1)c1ccccc1	ZINC000853703388	GF	On-Demand	Anodyne	CA9	15	41
CCc1ncn(CCCC2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853703414	DG	On-Demand	Anodyne	GPR119	54	45
N#Cc1ccc(CCN2C(=O)O[C@]3(CCCc4ccccc43)C2=O)cc1	ZINC000853703460	EG	On-Demand	Mild	KCNJ1	20	40
N#Cc1ccc(CCN2C(=O)O[C@@]3(CCCc4ccccc43)C2=O)cc1	ZINC000853703461	EG	On-Demand	Mild	KCNJ1	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(CC)n2)CC1	ZINC000853703485	DC	On-Demand	Anodyne	P2RY12	57	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(CC)n2)CC1	ZINC000853703486	DC	On-Demand	Anodyne	P2RY12	57	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(Br)cccc2=O)CC1	ZINC000853703544	GD	On-Demand	Anodyne	P2RY12	92	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(Br)cccc2=O)CC1	ZINC000853703545	GD	On-Demand	Anodyne	P2RY12	92	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C(C)=O)ccc2OC)CC1	ZINC000853703639	GD	On-Demand	Anodyne	P2RY12	54	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C(C)=O)ccc2OC)CC1	ZINC000853703640	GD	On-Demand	Anodyne	P2RY12	54	39
CC[C@@](C)(NC(=O)N[C@H](COC)C1CCOCC1)c1ccccc1	ZINC000853703727	EG	On-Demand	Anodyne	AMY2	59	35
CC[C@@](C)(NC(=O)N[C@@H](COC)C1CCOCC1)c1ccccc1	ZINC000853703729	EG	On-Demand	Anodyne	AMY2	59	35
CC[C@@](C)(NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O)c1ccccc1	ZINC000853703734	FG	On-Demand	Anodyne	PYGL	34	48
CC[C@@](C)(NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O)c1ccccc1	ZINC000853703734	FG	On-Demand	Anodyne	PYGM	31	48
CC[C@@](C)(NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)c1ccccc1	ZINC000853703735	FG	On-Demand	Anodyne	PYGL	34	48
CC[C@@](C)(NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)c1ccccc1	ZINC000853703735	FG	On-Demand	Anodyne	PYGM	31	48
O=Cc1cc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc(C(F)(F)F)c1	ZINC000853703982	GI	On-Demand	Anodyne	CCR2	21	40
O=Cc1cc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc(C(F)(F)F)c1	ZINC000853703982	GI	On-Demand	Anodyne	LIPG	48	35
O=Cc1cc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc(C(F)(F)F)c1	ZINC000853703983	GI	On-Demand	Anodyne	CCR2	21	40
O=Cc1cc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc(C(F)(F)F)c1	ZINC000853703983	GI	On-Demand	Anodyne	LIPG	48	35
O=C(NCCc1ccc(Br)cc1F)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853704052	GG	On-Demand	Anodyne	CPT1A	55	35
O=C(NCCc1ccc(Br)cc1F)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853704053	GG	On-Demand	Anodyne	CPT1A	55	35
CCCOc1cccc(CN2C(=O)OC3(CCCC3)C2=O)c1	ZINC000853704062	DG	On-Demand	Anodyne	HRH2	25	40
CCc1ncn(Cc2cc(Cl)ccc2OCC#N)n1	ZINC000853704075	CE	On-Demand	Mild	PTGER1	34	40
COC(=O)CCN(CCOC(F)F)S(=O)(=O)c1ccc(C)cc1	ZINC000853704084	FD	On-Demand	Anodyne	BMP1	26	41
CCc1ncn(CC2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853704104	CE	On-Demand	Anodyne	GPR119	56	46
COC(=O)CCN(CCc1cncn1C)S(=O)(=O)c1ccc(C)cc1	ZINC000853704117	FD	On-Demand	Anodyne	BMP1	17	41
COc1cccc(C2(CNC(=O)N3CC[C@H](N4CCOC4=O)C3)CCCC2)c1	ZINC000853704122	GF	On-Demand	Anodyne	KCNA3	40	34
COc1cccc(C2(CNC(=O)N3CC[C@H](N4CCOC4=O)C3)CCCC2)c1	ZINC000853704122	GF	On-Demand	Anodyne	SOAT1	16	43
COc1cccc(C2(CNC(=O)N3CC[C@@H](N4CCOC4=O)C3)CCCC2)c1	ZINC000853704123	GF	On-Demand	Anodyne	KCNA3	40	34
COc1cccc(C2(CNC(=O)N3CC[C@@H](N4CCOC4=O)C3)CCCC2)c1	ZINC000853704123	GF	On-Demand	Anodyne	SOAT1	16	43
COc1ccc([C@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704124	JD	On-Demand	Mild	MMP13	26	44
COc1ccc([C@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704124	JD	On-Demand	Mild	MMP2	24	44
COc1ccc([C@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704124	JD	On-Demand	Mild	MMP8	15	44
COc1ccc([C@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704124	JD	On-Demand	Mild	MMP9	15	44
COc1ccc([C@@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704125	JD	On-Demand	Mild	MMP13	26	44
COc1ccc([C@@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704125	JD	On-Demand	Mild	MMP2	24	44
COc1ccc([C@@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704125	JD	On-Demand	Mild	MMP8	15	44
COc1ccc([C@@H](NC(=O)COC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000853704125	JD	On-Demand	Mild	MMP9	15	44
CCc1ncn(CC(=O)c2cc(C)n(Cc3ccccc3)c2C)n1	ZINC000853704134	DG	On-Demand	Anodyne	PLA2G2A	65	35
CCc1ncn(CC(=O)c2cc(C)n(Cc3ccccc3)c2C)n1	ZINC000853704134	DG	On-Demand	Anodyne	PLA2G2D	41	32
CCc1ncn(CC(=O)c2cc(C)n(Cc3ccccc3)c2C)n1	ZINC000853704134	DG	On-Demand	Anodyne	PLA2G5	41	32
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(-c3ccccc3)ncc2=O)CC1	ZINC000853704164	GD	On-Demand	Anodyne	P2RY12	228	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(-c3ccccc3)ncc2=O)CC1	ZINC000853704166	GD	On-Demand	Anodyne	P2RY12	228	48
CNC(=O)c1n[nH]c(C2CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC2)n1	ZINC000853704223	GE	On-Demand	Bother	SERPINE1	23	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)n(C)c(=O)n3C)CC1	ZINC000853704308	GC	On-Demand	Anodyne	P2RY12	64	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)n(C)c(=O)n3C)CC1	ZINC000853704309	GC	On-Demand	Anodyne	P2RY12	64	38
CCc1ncn(CC(=O)Nc2ccc(N3CCCC3)cc2)n1	ZINC000853704333	CE	On-Demand	Anodyne	KCNQ2	16	45
CCc1ncn(CC(=O)Nc2ccc(N3CCCC3)cc2)n1	ZINC000853704333	CE	On-Demand	Anodyne	PRNP	40	38
CCc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853704369	DD	On-Demand	Anodyne	PIK3CA	37	40
CCc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853704369	DD	On-Demand	Anodyne	MTOR	76	40
CCc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853704369	DD	On-Demand	Anodyne	EPHX2	15	44
CCc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853704369	DD	On-Demand	Anodyne	STAT6	61	35
CON(C)CCNC(=O)NCc1ccccc1Oc1cccc(F)c1	ZINC000853704370	EF	On-Demand	Anodyne	TSPO	45	36
COC(=O)c1cncc(C(F)(F)F)c1OCc1cc(C)nc(Cl)c1	ZINC000853704379	FH	On-Demand	Anodyne	ATF1	43	32
COC(=O)c1cncc(C(F)(F)F)c1OCc1cc(C)nc(Cl)c1	ZINC000853704379	FH	On-Demand	Anodyne	NFKB1	40	32
CCCCC[C@@H](C)NC(=O)Cn1cnc(CC)n1	ZINC000853704387	CD	On-Demand	Anodyne	NOD1	41	33
C#CCCN(CCOC)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000853704390	FG	On-Demand	Mild	DRD4	40	31
C#CCCN(CCOC)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000853704390	FG	On-Demand	Mild	KCNA3	41	33
C#CCCN(CCOC)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000853704390	FG	On-Demand	Mild	SOAT1	17	42
CC(C)(C)OC(=O)Cc1ccccc1OCc1csc(Cl)n1	ZINC000853704418	EI	On-Demand	Anodyne	PTGER1	28	40
CCc1ncn(CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000853704436	CE	On-Demand	Anodyne	GPR119	47	43
CCc1ncn(CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)n1	ZINC000853704437	CE	On-Demand	Anodyne	GPR119	47	43
COCCN(CCF)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000853704439	FG	On-Demand	Anodyne	DRD4	40	31
COCCN(CCF)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000853704439	FG	On-Demand	Anodyne	KCNA3	44	35
COCCN(CCF)C(=O)NCC1(c2cccc(OC)c2)CCCC1	ZINC000853704439	FG	On-Demand	Anodyne	SOAT1	17	44
COC(=O)c1cncc(C(F)(F)F)c1OCCOc1cccc(F)c1	ZINC000853704460	FG	On-Demand	Anodyne	NR1H3	50	35
COC(=O)c1cncc(C(F)(F)F)c1OCCOc1cccc(F)c1	ZINC000853704460	FG	On-Demand	Anodyne	NR1H2	60	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C(C)(C)C)n2)CC1	ZINC000853704461	EE	On-Demand	Anodyne	P2RY12	61	45
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C(C)(C)C)n2)CC1	ZINC000853704462	EE	On-Demand	Anodyne	P2RY12	61	45
COC(=O)CCN(C[C@H](OC)C1CCC1)S(=O)(=O)c1ccc(C)cc1	ZINC000853704477	FE	On-Demand	Anodyne	BMP1	26	43
COC(=O)CCN(C[C@@H](OC)C1CCC1)S(=O)(=O)c1ccc(C)cc1	ZINC000853704478	FE	On-Demand	Anodyne	BMP1	26	43
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ccc(C(C)(C)C)n2)C1	ZINC000853704510	DH	On-Demand	Anodyne	GPR119	54	43
CC(C)(C)OC(=O)N1CC[C@H](CCn2ccc(C(C)(C)C)n2)C1	ZINC000853704511	DH	On-Demand	Anodyne	GPR119	54	43
CCc1ncn(CC(=O)NCc2ccc(N3CCOCC3)c(F)c2)n1	ZINC000853704534	ED	On-Demand	Clean	NPY2R	45	33
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)Cn1cnc(CC)n1	ZINC000853704535	GG	On-Demand	Anodyne	PRKCZ	34	40
CCc1ncn(CC(=O)N2CCN(c3ccc(OC)cc3)CC2)n1	ZINC000853704555	ED	On-Demand	Clean	CCR1	24	43
COc1cccc(C2(CNC(=O)NCCc3nnc(S)n3C)CCCC2)c1	ZINC000853704632	GE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2(CNC(=O)NCCc3nnc(S)n3C)CCCC2)c1	ZINC000853704632	GE	On-Demand	Anodyne	MTNR1A	40	40
COc1cccc(C2(CNC(=O)NCCc3nnc(S)n3C)CCCC2)c1	ZINC000853704632	GE	On-Demand	Anodyne	MTNR1B	33	40
COc1cccc(C2(CNC(=O)NCCc3nnc(S)n3C)CCCC2)c1	ZINC000853704632	GE	On-Demand	Anodyne	SOAT1	19	45
N#Cc1ccc(S(=O)(=O)NCC(=O)OCC(=O)Nc2ccc(N3CCCCC3)nc2)cc1	ZINC000853704646	JD	On-Demand	Mild	FASN	17	41
COc1cccc(C2(CNC(=O)N3CCC4=C(CCC(=O)N4)C3)CCCC2)c1	ZINC000853704656	GG	On-Demand	Anodyne	SOAT1	16	42
CCCCCCCCn1cnc(CC)n1	ZINC000853704659	BG	On-Demand	Mild	ADA	28	44
CCc1ncn(Cc2ccc(OC)cc2)n1	ZINC000853704662	BD	On-Demand	Anodyne	PROKR1	60	37
CCCCCCn1cnc(CC)n1	ZINC000853704716	AE	On-Demand	Anodyne	ADA	28	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc3ccccc3nc2C)CC1	ZINC000853704731	FF	On-Demand	Anodyne	P2RY12	202	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc3ccccc3nc2C)CC1	ZINC000853704732	FF	On-Demand	Anodyne	P2RY12	202	43
CCc1ncn(CCCOc2ccc(C#N)cc2)n1	ZINC000853704741	CE	On-Demand	Mild	HRH3	32	44
CCc1ncn(CCCOc2ccc(C#N)cc2)n1	ZINC000853704741	CE	On-Demand	Mild	MEN1	40	37
CCc1ncn(CCOc2cccc(F)c2)n1	ZINC000853704742	BE	On-Demand	Anodyne	CHRNA10	29	42
CCc1ncn(Cc2ccc(Cl)nc2)n1	ZINC000853704757	BD	On-Demand	Anodyne	CHRNA4	16	45
CCc1ncn(Cc2ccc(Cl)nc2)n1	ZINC000853704757	BD	On-Demand	Anodyne	Q8WSF8_APLCA	45	45
CCc1ncn(Cc2ccc(Cl)nc2)n1	ZINC000853704757	BD	On-Demand	Anodyne	NACHRBETA2	58	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C)cnc2=O)CC1	ZINC000853704758	DC	On-Demand	Anodyne	P2RY12	44	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C)cnc2=O)CC1	ZINC000853704759	DC	On-Demand	Anodyne	P2RY12	44	38
C#CCOCCN(CCC(=O)OC)S(=O)(=O)c1ccc(C)cc1	ZINC000853704764	ED	On-Demand	Mild	BMP1	18	40
Cc1c(NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)cccc1[N+](=O)[O-]	ZINC000853704767	ID	On-Demand	Mild	COLA	99	36
Cc1c(NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)cccc1[N+](=O)[O-]	ZINC000853704768	ID	On-Demand	Mild	COLA	99	36
COc1cccc(C2(CNC(=O)NCCN(C)OC)CCCC2)c1	ZINC000853704783	EE	On-Demand	Anodyne	DRD4	41	31
COc1cccc(C2(CNC(=O)NCCN(C)OC)CCCC2)c1	ZINC000853704783	EE	On-Demand	Anodyne	KCNA3	45	36
COc1cccc(C2(CNC(=O)NCCN(C)OC)CCCC2)c1	ZINC000853704783	EE	On-Demand	Anodyne	MTNR1A	56	39
COc1cccc(C2(CNC(=O)NCCN(C)OC)CCCC2)c1	ZINC000853704783	EE	On-Demand	Anodyne	MTNR1B	50	39
COc1cccc(C2(CNC(=O)NCCN(C)OC)CCCC2)c1	ZINC000853704783	EE	On-Demand	Anodyne	SOAT1	19	47
COc1cc(CNC(=O)Cn2c(Cl)cncc2=O)cc(OC)c1OC	ZINC000853704825	FD	On-Demand	Anodyne	F2	19	40
COc1ccc(OC)c([C@H]2CCCN2C(=O)Cn2c(Cl)cncc2=O)c1	ZINC000853704829	GE	On-Demand	Anodyne	FKBP1A	36	42
COc1ccc(OC)c([C@H]2CCCN2C(=O)Cn2c(Cl)cncc2=O)c1	ZINC000853704829	GE	On-Demand	Anodyne	CPT1A	35	41
CC(C)(C)OC(=O)N1CCC(Cn2c(Cl)cncc2=O)CC1	ZINC000853704840	EF	On-Demand	Anodyne	GPR119	57	45
CCOc1ccc([C@@H]2CCCN2C(=O)Cn2c(Cl)cncc2=O)cc1	ZINC000853704857	FF	On-Demand	Anodyne	CPT1A	95	37
CON(C)CCNC(=O)NCCCc1cccc(Br)c1	ZINC000853704864	EE	On-Demand	Anodyne	MTNR1A	35	47
CON(C)CCNC(=O)NCCCc1cccc(Br)c1	ZINC000853704864	EE	On-Demand	Anodyne	MTNR1B	31	47
CON(C)CCNC(=O)NCCCc1cccc(Br)c1	ZINC000853704864	EE	On-Demand	Anodyne	CRTM	48	37
CCCCCNC(=O)Cn1c(Cl)cncc1=O	ZINC000853704867	CD	On-Demand	Anodyne	ASAH1	94	39
O=C(Cn1c(Cl)cncc1=O)Nc1ccccc1N1CCCC1=O	ZINC000853704871	ED	On-Demand	Anodyne	KCNQ2	57	41
O=C(Cn1c(Cl)cncc1=O)NCCOc1ccc2c(c1)OCO2	ZINC000853704872	FC	On-Demand	Anodyne	NOS2	65	31
Cc1ccccc1CN1CCC(NC(=O)Cn2c(Cl)cncc2=O)CC1	ZINC000853704876	FD	On-Demand	Anodyne	DRD4	30	52
Cc1ccccc1CN1CCC(NC(=O)Cn2c(Cl)cncc2=O)CC1	ZINC000853704876	FD	On-Demand	Anodyne	SIGMAR1	21	49
Cc1ccccc1CN1CCC(NC(=O)Cn2c(Cl)cncc2=O)CC1	ZINC000853704876	FD	On-Demand	Anodyne	SSTR5	42	40
Cc1ccccc1CN1CCC(NC(=O)Cn2c(Cl)cncc2=O)CC1	ZINC000853704876	FD	On-Demand	Anodyne	CCR3	15	40
Cc1ccccc1CN1CCC(NC(=O)Cn2c(Cl)cncc2=O)CC1	ZINC000853704876	FD	On-Demand	Anodyne	MCHR1	27	40
O=C(Cn1c(Cl)cncc1=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853704877	FD	On-Demand	Anodyne	MAPK14	39	42
O=C(Cn1c(Cl)cncc1=O)N[C@@H]1CCOc2ccccc21	ZINC000853704879	DD	On-Demand	Anodyne	BDKRB1	22	41
O=C(Cn1c(Cl)cncc1=O)N[C@@H]1CCOc2ccccc21	ZINC000853704879	DD	On-Demand	Anodyne	LUXR	65	39
O=C(Cn1c(Cl)cncc1=O)N[C@@H]1CCOc2ccccc21	ZINC000853704879	DD	On-Demand	Anodyne	TRAR	78	38
O=C(Cn1c(Cl)cncc1=O)N[C@@H]1CCOc2ccccc21	ZINC000853704879	DD	On-Demand	Anodyne	LASR	43	37
O=C(Cn1c(Cl)cncc1=O)N[C@H]1CCOc2ccccc21	ZINC000853704880	DD	On-Demand	Anodyne	BDKRB1	22	41
O=C(Cn1c(Cl)cncc1=O)N[C@H]1CCOc2ccccc21	ZINC000853704880	DD	On-Demand	Anodyne	LUXR	65	39
O=C(Cn1c(Cl)cncc1=O)N[C@H]1CCOc2ccccc21	ZINC000853704880	DD	On-Demand	Anodyne	TRAR	78	38
O=C(Cn1c(Cl)cncc1=O)N[C@H]1CCOc2ccccc21	ZINC000853704880	DD	On-Demand	Anodyne	LASR	43	37
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853704897	JD	On-Demand	Mild	DRD4	27	44
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853704897	JD	On-Demand	Mild	SIGMAR1	26	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853704897	JD	On-Demand	Mild	CCR5	15	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853704897	JD	On-Demand	Mild	BIRC2	34	42
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853704898	JD	On-Demand	Mild	DRD4	27	44
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853704898	JD	On-Demand	Mild	SIGMAR1	26	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853704898	JD	On-Demand	Mild	CCR5	15	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853704898	JD	On-Demand	Mild	BIRC2	34	42
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853704936	JD	On-Demand	Mild	CCKAR	19	43
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853704936	JD	On-Demand	Mild	CTSL	20	40
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853704936	JD	On-Demand	Mild	NMBR	31	45
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853704936	JD	On-Demand	Mild	MMP2	23	43
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853704936	JD	On-Demand	Mild	GRPR	52	35
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853704936	JD	On-Demand	Mild	ALOX15	34	51
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853704936	JD	On-Demand	Mild	MMP9	19	43
CC(=O)Cc1ccc(OCCO[Si](C)(C)C(C)(C)C)cc1	ZINC000853704943	DI	On-Demand	Reactive	PLA2G4B	40	37
CC(C)(C)OC(=O)N1CCC(CCCn2ccc(C(C)(C)C)nc2=O)CC1	ZINC000853704944	GH	On-Demand	Anodyne	GPR119	57	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(CC(C)=O)cc2)CC1	ZINC000853704987	FD	On-Demand	Anodyne	P2RY12	44	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(CC(C)=O)cc2)CC1	ZINC000853704988	FD	On-Demand	Anodyne	P2RY12	44	37
O=C(Cn1c(Cl)cncc1=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853704998	FD	On-Demand	Anodyne	NAMPT	17	44
CC[C@@H](NC(=O)Cn1c(Cl)cncc1=O)c1ccc(Cl)cc1	ZINC000853705006	EF	On-Demand	Anodyne	UTS2	42	33
CC[C@H](NC(=O)Cn1c(Cl)cncc1=O)c1ccc(Cl)cc1	ZINC000853705007	EF	On-Demand	Anodyne	UTS2	42	33
CN(Cc1cnn(C)c1)C(=O)Cn1c(Cl)cncc1=O	ZINC000853705047	CC	On-Demand	Anodyne	PLA2G7	50	40
CCCN(Cc1ccc(C)cc1)C(=O)Cn1c(Cl)cncc1=O	ZINC000853705050	EF	On-Demand	Anodyne	PLA2G7	51	36
CCN(Cc1cccc(F)c1)C(=O)Cn1c(Cl)cncc1=O	ZINC000853705091	DE	On-Demand	Anodyne	PLA2G7	42	34
C#CCOCCOc1ccc(CC(C)=O)cc1	ZINC000853705096	BD	On-Demand	Mild	PLA2G4B	56	41
N#Cc1ccc(S(=O)(=O)NCC(=O)OCC(=O)NCC2(c3ccccc3)CC2)cc1	ZINC000853705128	ID	On-Demand	Mild	KCNA3	41	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)nc(C)c2C)CC1	ZINC000853705147	EE	On-Demand	Anodyne	P2RY12	156	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(C)nc(C)c2C)CC1	ZINC000853705147	EE	On-Demand	Anodyne	GPR119	16	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)nc(C)c2C)CC1	ZINC000853705148	EE	On-Demand	Anodyne	P2RY12	156	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(C)nc(C)c2C)CC1	ZINC000853705148	EE	On-Demand	Anodyne	GPR119	16	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(N)c(C)c2=O)CC1	ZINC000853705151	EB	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(N)c(C)c2=O)CC1	ZINC000853705152	EB	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(Cl)cncc2=O)CC1	ZINC000853705158	EC	On-Demand	Anodyne	P2RY12	133	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(Cl)cncc2=O)CC1	ZINC000853705159	EC	On-Demand	Anodyne	P2RY12	133	41
CN1CCC[C@H](CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)C1	ZINC000853705172	FE	On-Demand	Anodyne	CACNA1I	54	39
O=c1cncc(Cl)n1Cc1cccc(CN2CCCCC2)c1	ZINC000853705187	DF	On-Demand	Anodyne	HRH3	23	41
O=c1cncc(Cl)n1Cc1cccc(CN2CCCCC2)c1	ZINC000853705187	DF	On-Demand	Anodyne	SIGMAR1	25	41
O=c1cncc(Cl)n1Cc1cccc(CN2CCCCC2)c1	ZINC000853705187	DF	On-Demand	Anodyne	NOX1	56	37
O=c1cncc(Cl)n1Cc1cccc(CN2CCCCC2)c1	ZINC000853705187	DF	On-Demand	Anodyne	NOX5	52	37
COc1ccc(N2CCN(C(=O)Cn3c(Cl)cncc3=O)CC2)cc1	ZINC000853705189	FD	On-Demand	Clean	CCR1	26	42
CC(=O)Cc1ccc(OCCCCC2(C)OCCO2)cc1	ZINC000853705192	CG	On-Demand	Anodyne	PLA2G4B	69	41
CCCCN(CCCC)C(=O)Cn1c(Cl)cncc1=O	ZINC000853705196	CE	On-Demand	Anodyne	TSPO	25	45
O=C(Cn1c(Cl)cncc1=O)N1CCN(c2ccccc2F)CC1	ZINC000853705203	FD	On-Demand	Anodyne	PLA2G7	18	40
O=C(Cn1c(Cl)cncc1=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853705228	GH	On-Demand	Anodyne	KCNA5	17	40
O=C(Cn1c(Cl)cncc1=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853705228	GH	On-Demand	Anodyne	UTS2R	28	44
O=C(Cn1c(Cl)cncc1=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853705229	GH	On-Demand	Anodyne	KCNA5	17	40
O=C(Cn1c(Cl)cncc1=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853705229	GH	On-Demand	Anodyne	UTS2R	28	44
O=c1cncc(Cl)n1CCCOc1cccc(C(F)(F)F)c1	ZINC000853705255	EG	On-Demand	Anodyne	GALR3	72	40
O=c1cncc(Cl)n1CCCOc1cccc(C(F)(F)F)c1	ZINC000853705255	EG	On-Demand	Anodyne	PDS	46	39
O=C(Cn1c(Cl)cncc1=O)NCCOc1ccc(C(F)(F)F)cc1	ZINC000853705265	GE	On-Demand	Anodyne	F2	23	43
O=c1cncc(Cl)n1CCCCOc1cccc(C(F)(F)F)c1	ZINC000853705272	EH	On-Demand	Anodyne	GALR3	72	38
O=c1cncc(Cl)n1CCCCOc1cccc(C(F)(F)F)c1	ZINC000853705272	EH	On-Demand	Anodyne	PDS	48	41
COc1ccc(CN(C)C(=O)Cn2c(Cl)cncc2=O)cc1	ZINC000853705275	DD	On-Demand	Anodyne	PROKR1	58	31
O=C(Cn1c(Cl)cncc1=O)NCc1ccccc1OC1CCCC1	ZINC000853705279	FF	On-Demand	Anodyne	F2	33	40
O=c1cncc(Cl)n1CCCCc1ccccc1	ZINC000853705290	CF	On-Demand	Anodyne	SIGMAR1	26	40
O=c1cncc(Cl)n1CCCCc1ccccc1	ZINC000853705290	CF	On-Demand	Anodyne	FAAH	64	43
O=c1cncc(Cl)n1CCCCc1ccccc1	ZINC000853705290	CF	On-Demand	Anodyne	CES1	65	38
O=c1cncc(Cl)n1CCCCc1ccccc1	ZINC000853705290	CF	On-Demand	Anodyne	CES1D	44	32
COc1ccc([C@@H]2CCCN2C(=O)Cn2c(Cl)cncc2=O)c(OC)c1	ZINC000853705291	GE	On-Demand	Anodyne	CPT1A	50	37
CON(C)CCNC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705302	FD	On-Demand	Anodyne	HCN1	58	36
CON(C)CCNC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705302	FD	On-Demand	Anodyne	HCN4	54	35
O=c1cncc(Cl)n1Cc1cccc(CN2CCOCC2)c1	ZINC000853705311	DD	On-Demand	Anodyne	SIGMAR1	17	42
COC(=O)N(C)CCNC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705313	GD	On-Demand	Anodyne	HCN1	53	32
COC(=O)N(C)CCNC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705313	GD	On-Demand	Anodyne	HCN4	51	32
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705319	JD	On-Demand	Mild	DRD4	26	43
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705319	JD	On-Demand	Mild	ACHE	23	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705319	JD	On-Demand	Mild	SIGMAR1	35	47
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705319	JD	On-Demand	Mild	MCHR1	27	44
CC(C)(C)OC(=O)N1CCC(Cn2ccc(C(C)(C)C)nc2=O)CC1	ZINC000853705342	EG	On-Demand	Anodyne	GPR119	57	46
COc1ccc(N2CCN(C(=O)Cn3ccc(C(C)(C)C)nc3=O)CC2)cc1	ZINC000853705348	GD	On-Demand	Clean	CCR1	26	42
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N(C)Cc1ccc(Br)cc1	ZINC000853705356	JE	On-Demand	Mild	IDO1	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C(C)(C)C)nc2=O)CC1	ZINC000853705379	FD	On-Demand	Anodyne	P2RY12	60	43
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C(C)(C)C)nc2=O)CC1	ZINC000853705380	FD	On-Demand	Anodyne	P2RY12	60	43
COC(=O)c1ccc(OCCNC(=O)N2CCOc3ccc(O)cc3C2)cc1	ZINC000853705474	GE	On-Demand	Anodyne	ESR1	41	35
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Cn1c(Cl)cncc1=O	ZINC000853705491	EF	On-Demand	Anodyne	UTS2	43	34
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Cn1c(Cl)cncc1=O	ZINC000853705492	EF	On-Demand	Anodyne	UTS2	43	34
CCCCC[C@@H](C)NC(=O)COc1ccc2c(c1)nc(C)n2C	ZINC000853705551	DG	On-Demand	Anodyne	PLA2G4B	57	32
CCCCCCn1c(=O)ccn1C	ZINC000853705554	AD	On-Demand	Anodyne	ASAH1	41	45
CCCCCCn1c(=O)ccn1C	ZINC000853705554	AD	On-Demand	Anodyne	OXER1	55	32
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCCC4)cc3)ccc2n1C	ZINC000853705565	GH	On-Demand	Anodyne	ADORA2B	45	38
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCCC4)cc3)ccc2n1C	ZINC000853705565	GH	On-Demand	Anodyne	ACOX1	48	37
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCCC4)cc3)ccc2n1C	ZINC000853705565	GH	On-Demand	Anodyne	PRNP	45	33
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCCC4)cc3)ccc2n1C	ZINC000853705565	GH	On-Demand	Anodyne	MCHR1	30	51
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCCC4)cc3)ccc2n1C	ZINC000853705565	GH	On-Demand	Anodyne	MCHR2	36	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)ccn2C)CC1	ZINC000853705576	DC	On-Demand	Anodyne	P2RY12	73	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)ccn2C)CC1	ZINC000853705577	DC	On-Demand	Anodyne	P2RY12	73	40
COc1ccc(N2CCN(C(=O)COc3ccc4c(c3)nc(C)n4C)CC2)cc1	ZINC000853705578	GF	On-Demand	Clean	HTR1D	20	45
COc1ccc(N2CCN(C(=O)COc3ccc4c(c3)nc(C)n4C)CC2)cc1	ZINC000853705578	GF	On-Demand	Clean	HTR1B	19	45
COc1ccc(N2CCN(C(=O)COc3ccc4c(c3)nc(C)n4C)CC2)cc1	ZINC000853705578	GF	On-Demand	Clean	HPGD	16	42
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853705590	JD	On-Demand	Mild	SLC6A9	22	45
CCCCNC(=O)Cn1cc(C(=O)OCC)c(I)n1	ZINC000853705595	GD	On-Demand	Anodyne	ASAH1	57	38
Cc1cc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c(C)c(C)n1	ZINC000853705630	EG	On-Demand	Anodyne	GPR119	48	43
Cc1cc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c(C)c(C)n1	ZINC000853705631	EG	On-Demand	Anodyne	GPR119	48	43
CC(=O)Cc1ccc(OCCOC(F)F)cc1	ZINC000853705635	BE	On-Demand	Anodyne	PLA2G4B	76	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(S(C)(=O)=O)ccc2=O)CC1	ZINC000853705637	GC	On-Demand	Anodyne	P2RY12	43	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(S(C)(=O)=O)ccc2=O)CC1	ZINC000853705637	GC	On-Demand	Anodyne	F13A1	15	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(S(C)(=O)=O)ccc2=O)CC1	ZINC000853705639	GC	On-Demand	Anodyne	P2RY12	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(S(C)(=O)=O)ccc2=O)CC1	ZINC000853705639	GC	On-Demand	Anodyne	F13A1	15	40
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	CHRM2	22	47
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	CHRM1	23	47
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	DRD2	27	50
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	DRD4	52	50
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	ACHE	50	46
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	DRD3	17	50
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	SLC6A3	16	40
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	KCNH2	17	44
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	HTR4	23	41
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	CHRM3	32	47
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	LTA4H	30	43
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	SIGMAR1	55	58
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	SSTR5	55	37
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	CCR3	31	44
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	SLC6A5	23	43
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	MCHR1	55	49
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	CACNA1G	38	43
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	CCR8	33	45
C[C@@H](ONC(=O)CC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853705719	GF	On-Demand	Anodyne	BIRC2	46	39
CC(C)(C)CC(=O)NOCCc1ccc(C#N)cc1	ZINC000853705739	CF	On-Demand	Mild	CTRB_BOVIN	49	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C=O)c2Cl)CC1	ZINC000853705750	FE	On-Demand	Anodyne	P2RY12	42	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C=O)c2Cl)CC1	ZINC000853705751	FE	On-Demand	Anodyne	P2RY12	42	38
CC(C)(C)OC(=O)N1CCO[C@@H](COn2cccn2)C1	ZINC000853705766	CC	On-Demand	Anodyne	GPR119	28	40
CC(C)(C)OC(=O)N1CCO[C@H](COn2cccn2)C1	ZINC000853705767	CC	On-Demand	Anodyne	GPR119	28	40
O=C(COc1cccc(-c2ccncc2)c1)N1CCC2(CC1)OCCO2	ZINC000853705793	FE	On-Demand	Anodyne	FABP4	43	34
O=C(COc1cccc(-c2ccncc2)c1)N1CCC2(CC1)OCCO2	ZINC000853705793	FE	On-Demand	Anodyne	CPT1A	66	39
C[C@@H](NC(=O)Cn1c(Cl)cncc1=O)C(=O)N1CCCCC1	ZINC000853705807	EC	On-Demand	Anodyne	DPP7	49	35
O=C(Cn1c(Cl)cncc1=O)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000853705812	GD	On-Demand	Clean	SCN10A	20	41
O=c1cncc(Cl)n1C[C@H]1CCCO1	ZINC000853705827	BD	On-Demand	Anodyne	PDE8B	41	36
O=c1cncc(Cl)n1C[C@@H]1CCCO1	ZINC000853705828	BD	On-Demand	Anodyne	PDE8B	41	36
COCCCCCn1c(Cl)cncc1=O	ZINC000853705851	BD	On-Demand	Anodyne	POLC	22	44
COc1ccc([C@@H]2CCCCCN2C(=O)Cn2c(Cl)cncc2=O)cc1	ZINC000853705853	GG	On-Demand	Anodyne	CPT1A	109	42
CCCOc1cccc(CNC(=O)Cn2c(Cl)cncc2=O)c1	ZINC000853705855	EE	On-Demand	Anodyne	F2	35	46
CCCOc1cccc(CNC(=O)Cn2c(Cl)cncc2=O)c1	ZINC000853705855	EE	On-Demand	Anodyne	AVPR1B	57	39
CCCOc1cccc(CNC(=O)Cn2c(Cl)cncc2=O)c1	ZINC000853705855	EE	On-Demand	Anodyne	ROCK1	19	40
CCCOc1cccc(CNC(=O)Cn2c(Cl)cncc2=O)c1	ZINC000853705855	EE	On-Demand	Anodyne	MTNR1A	27	42
CCCOc1cccc(CNC(=O)Cn2c(Cl)cncc2=O)c1	ZINC000853705855	EE	On-Demand	Anodyne	PDS	70	37
O=c1cncc(Cl)n1Cc1cc(Cl)ccc1OCC1CC1	ZINC000853705856	EG	On-Demand	Anodyne	PTGER1	15	46
COCCOc1ccc(CNC(=O)Cn2c(Cl)cncc2=O)cc1	ZINC000853705863	FD	On-Demand	Anodyne	PROKR1	47	32
O=C(NCCCn1c(Cl)cncc1=O)C1CCCC1	ZINC000853705879	CD	On-Demand	Anodyne	TBK1	78	36
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1	ZINC000853705900	JE	On-Demand	Mild	FPR1	23	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1	ZINC000853705901	JE	On-Demand	Mild	FPR1	23	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705905	JF	On-Demand	Mild	BMP1	63	43
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705905	JF	On-Demand	Mild	MMP13	26	43
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705905	JF	On-Demand	Mild	MMP2	18	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705905	JF	On-Demand	Mild	MMP8	15	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705905	JF	On-Demand	Mild	MMP9	20	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705905	JF	On-Demand	Mild	MMP12	19	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705905	JF	On-Demand	Mild	MMP1	17	40
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705906	JF	On-Demand	Mild	BMP1	63	43
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705906	JF	On-Demand	Mild	MMP13	26	43
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705906	JF	On-Demand	Mild	MMP2	18	40
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705906	JF	On-Demand	Mild	MMP8	15	40
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705906	JF	On-Demand	Mild	MMP9	20	40
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705906	JF	On-Demand	Mild	MMP12	19	40
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c3ccc(C#N)cc3)ccc2c1	ZINC000853705906	JF	On-Demand	Mild	MMP1	17	40
C#CCCN(CCOC)C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705916	GE	On-Demand	Mild	HCN1	50	30
C#CCCN(CCOC)C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705916	GE	On-Demand	Mild	HCN4	48	30
CC(C)(C)OC(=O)N1CC[C@H](CCn2ccc(C(C)(C)C)nc2=O)C1	ZINC000853705919	EG	On-Demand	Anodyne	GPR119	51	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ccc(C(C)(C)C)nc2=O)C1	ZINC000853705920	EG	On-Demand	Anodyne	GPR119	51	41
COc1ccc(NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c(OC)c1	ZINC000853705938	ID	On-Demand	Mild	MMP2	15	40
CCOc1ccc(-n2c(C)cc(C(=O)Cn3c(=O)ccn3C)c2C)cc1	ZINC000853705949	FF	On-Demand	Clean	CACNA2D1	51	38
COCCN(CCF)C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705950	FE	On-Demand	Anodyne	HCN1	49	32
COCCN(CCF)C(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000853705950	FE	On-Demand	Anodyne	HCN4	47	32
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2ccc(C(C)(C)C)nc2=O)CC1	ZINC000853705952	GH	On-Demand	Anodyne	ACACB	16	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2ccc(C(C)(C)C)nc2=O)CC1	ZINC000853705952	GH	On-Demand	Anodyne	CACNA1I	45	32
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(-c3ccncc3)c2)C1	ZINC000853705961	FH	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(-c3ccncc3)c2)C1	ZINC000853705963	FH	On-Demand	Anodyne	GPR119	33	44
Cc1nc2cc(OCC3CCS(=O)(=O)CC3)ccc2n1C	ZINC000853705965	DE	On-Demand	Anodyne	CHRNA10	45	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c1	ZINC000853705993	ID	On-Demand	Mild	IDO1	35	42
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c1	ZINC000853705996	ID	On-Demand	Mild	IDO1	35	42
CC(=O)Cc1ccc(OC[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853706049	EF	On-Demand	Anodyne	GPR119	32	42
CC(=O)Cc1ccc(OC[C@H]2CN(C(=O)OC(C)(C)C)CCO2)cc1	ZINC000853706051	EF	On-Demand	Anodyne	GPR119	32	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccccc2F)CC1	ZINC000853706057	FD	On-Demand	Anodyne	P2RY12	171	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccccc2F)CC1	ZINC000853706060	FD	On-Demand	Anodyne	P2RY12	171	40
O=C(Cn1c(Cl)cncc1=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853706069	DD	On-Demand	Anodyne	EPHX2	67	39
CCCCC[C@@H](C)NC(=O)Cn1c(=O)c(Br)cn(C)c1=O	ZINC000853706122	FD	On-Demand	Anodyne	ASAH1	47	31
O=C(Cn1c(Cl)cncc1=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000853706141	GE	On-Demand	Anodyne	F2	37	49
O=C(Cn1c(Cl)cncc1=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000853706141	GE	On-Demand	Anodyne	CTRC	43	39
O=C(Cn1c(Cl)cncc1=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000853706141	GE	On-Demand	Anodyne	PDS	50	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3ccncc3)c2)CC1	ZINC000853706183	GF	On-Demand	Anodyne	P2RY12	188	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3ccncc3)c2)CC1	ZINC000853706183	GF	On-Demand	Anodyne	FAAH	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3ccncc3)c2)CC1	ZINC000853706187	GF	On-Demand	Anodyne	P2RY12	188	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3ccncc3)c2)CC1	ZINC000853706187	GF	On-Demand	Anodyne	FAAH	15	41
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1F	ZINC000853706204	EF	On-Demand	Anodyne	SLC6A1	41	37
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1F	ZINC000853706204	EF	On-Demand	Anodyne	L3MBTL3	43	33
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1F	ZINC000853706205	EF	On-Demand	Anodyne	SLC6A1	41	37
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)c1ccccc1F	ZINC000853706205	EF	On-Demand	Anodyne	L3MBTL3	43	33
O=C(Cn1c(Cl)cncc1=O)NCC1(c2ccccc2)CCCCC1	ZINC000853706212	FF	On-Demand	Anodyne	NPFFR1	15	40
CC(C)(C)OC(=O)N1CC[C@H](CCn2c(Cl)cncc2=O)C1	ZINC000853706227	EF	On-Demand	Anodyne	GPR119	49	42
CC(C)(C)OC(=O)N1CC[C@@H](CCn2c(Cl)cncc2=O)C1	ZINC000853706228	EF	On-Demand	Anodyne	GPR119	49	42
COc1cc2c(cc1OC)CN(C(=O)Cn1c(Cl)cncc1=O)CC2	ZINC000853706230	FD	On-Demand	Anodyne	ABCB1B	60	36
COc1cc2c(cc1OC)CN(C(=O)Cn1c(Cl)cncc1=O)CC2	ZINC000853706230	FD	On-Demand	Anodyne	ABCB1	22	50
CC(C)(C)CC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853706234	DF	On-Demand	Anodyne	GRIN2B	41	39
CC(C)(C)CC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853706234	DF	On-Demand	Anodyne	CACNA1I	43	36
CC(C)(C)CC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853706234	DF	On-Demand	Anodyne	L3MBTL3	41	33
CC(C)(C)CC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853706235	DF	On-Demand	Anodyne	GRIN2B	41	39
CC(C)(C)CC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853706235	DF	On-Demand	Anodyne	CACNA1I	43	36
CC(C)(C)CC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853706235	DF	On-Demand	Anodyne	L3MBTL3	41	33
O=C(Cn1c(Cl)cncc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853706241	ED	On-Demand	Anodyne	MTOR	65	39
O=C(Cn1c(Cl)cncc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853706241	ED	On-Demand	Anodyne	PIK3CB	15	44
O=C(Cn1c(Cl)cncc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853706241	ED	On-Demand	Anodyne	STAT6	57	37
O=c1cncc(Cl)n1CCCN1CCCCC1	ZINC000853706245	CD	On-Demand	Anodyne	HRH3	42	40
O=c1cncc(Cl)n1CCCN1CCCCC1	ZINC000853706245	CD	On-Demand	Anodyne	SIGMAR1	17	42
O=c1cncc(Cl)n1CCCN1CCCCC1	ZINC000853706245	CD	On-Demand	Anodyne	HNMT	55	32
O=C(c1cccc(Cn2c(Cl)cncc2=O)c1)N1CCCCC1	ZINC000853706254	EF	On-Demand	Anodyne	FABI	40	34
O=C(c1cccc(Cn2c(Cl)cncc2=O)c1)N1CCCCC1	ZINC000853706254	EF	On-Demand	Anodyne	PARP1	15	43
O=C(Cn1c(Cl)cncc1=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000853706262	GE	On-Demand	Anodyne	F2	25	45
O=C(Cn1c(Cl)cncc1=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000853706262	GE	On-Demand	Anodyne	GALR3	59	33
O=C(Cn1c(Cl)cncc1=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000853706262	GE	On-Demand	Anodyne	PDS	50	43
Cc1ccccc1CCNC(=O)Cn1c(Cl)cncc1=O	ZINC000853706282	DD	On-Demand	Anodyne	F2	37	41
COc1ccc(N2CCN(C(=O)Cn3ccc(C(C)(C)C)n3)CC2)cc1	ZINC000853706307	FF	On-Demand	Clean	CCR1	28	47
O=c1cncc(Cl)n1Cc1ccc(CN2CCCCC2)cc1	ZINC000853706308	DF	On-Demand	Anodyne	HRH3	30	49
O=c1cncc(Cl)n1Cc1ccc(CN2CCCCC2)cc1	ZINC000853706308	DF	On-Demand	Anodyne	NOX1	46	36
O=c1cncc(Cl)n1Cc1ccc(CN2CCCCC2)cc1	ZINC000853706308	DF	On-Demand	Anodyne	NOX5	40	34
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000853706344	ID	On-Demand	Mild	BDKRB1	27	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000853706346	ID	On-Demand	Mild	BDKRB1	27	41
C[C@@H](OC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853706358	JD	On-Demand	Mild	VIPR1	28	43
O=C(Cn1c(Cl)cncc1=O)N[C@@H]1CCCc2ccccc21	ZINC000853706381	DE	On-Demand	Anodyne	BDKRB1	54	41
O=C(Cn1c(Cl)cncc1=O)N[C@H]1CCCc2ccccc21	ZINC000853706383	DE	On-Demand	Anodyne	BDKRB1	54	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2c(Cl)cncc2=O)C1	ZINC000853706389	ED	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2c(Cl)cncc2=O)C1	ZINC000853706392	ED	On-Demand	Anodyne	GPR119	32	40
C[C@@H]1Cc2ccccc2N1C(=O)Cn1c(Cl)cncc1=O	ZINC000853706396	DD	On-Demand	Anodyne	DRD4	31	53
C[C@@H]1Cc2ccccc2N1C(=O)Cn1c(Cl)cncc1=O	ZINC000853706396	DD	On-Demand	Anodyne	TPP2	60	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(C=O)ccc3ccccc23)CC1	ZINC000853706418	GF	On-Demand	Anodyne	P2RY12	100	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(C=O)ccc3ccccc23)CC1	ZINC000853706418	GF	On-Demand	Anodyne	TRY2_BOVIN	42	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(C=O)ccc3ccccc23)CC1	ZINC000853706421	GF	On-Demand	Anodyne	P2RY12	100	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(C=O)ccc3ccccc23)CC1	ZINC000853706421	GF	On-Demand	Anodyne	TRY2_BOVIN	42	40
CC(C)(C)OC(=O)N1CCC(CCCn2c(Cl)cncc2=O)CC1	ZINC000853706432	FG	On-Demand	Anodyne	GPR119	59	46
CC(C)(C)CC(=O)NOCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853706489	CF	On-Demand	Bother	COLA	66	36
O=C(Cn1c(Cl)cncc1=O)Nc1ccc2c(c1)OCCCO2	ZINC000853706490	ED	On-Demand	Anodyne	IMDH_CRYPV	31	45
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)CC(C)(C)C)CC1	ZINC000853706496	GF	On-Demand	Anodyne	DRD4	21	53
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)CC(C)(C)C)CC1	ZINC000853706496	GF	On-Demand	Anodyne	SIGMAR1	20	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)CC(C)(C)C)CC1	ZINC000853706496	GF	On-Demand	Anodyne	SSTR5	39	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)CC(C)(C)C)CC1	ZINC000853706496	GF	On-Demand	Anodyne	CCR2	15	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)CC(C)(C)C)CC1	ZINC000853706496	GF	On-Demand	Anodyne	MCHR1	28	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)CC(C)(C)C)CC1	ZINC000853706496	GF	On-Demand	Anodyne	CCR8	64	36
C#CCN1CCN(C(=O)COc2ccc3c(c2)nc(C)n3C)CC1	ZINC000853706509	ED	On-Demand	Mild	ACOX1	48	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(C)nc3c2CCCC3)CC1	ZINC000853706561	ED	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(C)nc3c2CCCC3)CC1	ZINC000853706562	ED	On-Demand	Anodyne	P2RY12	44	35
CCCCCCn1c(=O)c(Br)cn(C)c1=O	ZINC000853706687	CD	On-Demand	Anodyne	ASAH1	68	36
CCCCCNC(=O)Cn1cc(C(=O)OCC)c(I)n1	ZINC000853706712	GD	On-Demand	Anodyne	ASAH1	82	40
O=C(Cn1c(Cl)cncc1=O)N1CCC(Cc2ccccc2)CC1	ZINC000853706784	EE	On-Demand	Anodyne	GRIN2B	82	47
O=C(Cn1c(Cl)cncc1=O)N1CCC(Cc2ccccc2)CC1	ZINC000853706784	EE	On-Demand	Anodyne	CCR3	28	42
C#CCCN(CCOC)C(=O)NCCCc1cccc(Br)c1	ZINC000853706809	FG	On-Demand	Mild	CRTM	48	37
COc1ccc(Cn2c(=O)ccn2C)cc1	ZINC000853706815	BD	On-Demand	Anodyne	PROKR1	62	35
CCCCCCCCn1c(=O)ccn1C	ZINC000853706816	BF	On-Demand	Mild	ASAH1	41	45
CCCCCCCCn1c(=O)ccn1C	ZINC000853706816	BF	On-Demand	Mild	OXER1	55	32
CCCCCCCCCn1c(=O)ccn1C	ZINC000853706825	BF	On-Demand	Mild	ASAH1	41	45
CCCCCCCCCn1c(=O)ccn1C	ZINC000853706825	BF	On-Demand	Mild	OXER1	55	32
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	ADORA2B	47	46
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	ACOX1	49	38
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	JAK2	15	42
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	MTOR	61	37
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	PIK3CB	19	42
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	MCHR1	26	51
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	AURKA	17	40
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	EPHB4	64	32
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCOCC4)cc3)ccc2n1C	ZINC000853706828	GF	On-Demand	Anodyne	STAT6	60	35
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	CHRM1	21	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	DRD4	27	54
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	SLC6A1	47	37
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	SIGMAR1	23	59
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	SSTR5	41	36
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	CCR3	30	45
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	CCR2	15	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	MCHR1	33	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2ccccc2F)CC1	ZINC000853706853	GF	On-Demand	Anodyne	CCR8	55	34
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2ccccc2F)C1	ZINC000853706875	FE	On-Demand	Anodyne	CCR8	48	38
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2ccccc2F)C1	ZINC000853706875	FE	On-Demand	Anodyne	GPR119	25	42
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2ccccc2F)C1	ZINC000853706876	FE	On-Demand	Anodyne	CCR8	48	38
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2ccccc2F)C1	ZINC000853706876	FE	On-Demand	Anodyne	GPR119	25	42
O=C(Cn1c(Cl)cncc1=O)Nc1ccc2c(c1)CCC2	ZINC000853706907	DE	On-Demand	Anodyne	CALCRL	42	37
O=C(Cn1c(Cl)cncc1=O)NCCCc1ccccc1	ZINC000853706918	DD	On-Demand	Anodyne	CRTM	37	40
O=S1(=O)CCC(COc2cccc(-c3ccncc3)c2)CC1	ZINC000853706925	DF	On-Demand	Anodyne	CHRNA10	52	33
CC(C)(C)CC(=O)NOCc1cncs1	ZINC000853706937	BE	On-Demand	Anodyne	CYP3A4	28	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)On2cccn2)CC1	ZINC000853706943	CC	On-Demand	Anodyne	P2RY12	99	40
CCOC(=O)N1CCN(C(=O)[C@H](C)On2cccn2)CC1	ZINC000853706945	CC	On-Demand	Anodyne	P2RY12	99	40
Fc1ncnc(NC[C@@H]2CCCO[C@H]2c2cc[nH]n2)c1Br	ZINC000853706957	FF	On-Demand	Anodyne	TNK2	54	36
CCCCC[C@@H](C)NC(=O)Cn1c(=O)ccn1C	ZINC000853706997	CD	On-Demand	Anodyne	NOD1	46	34
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCC4)cc3)ccc2n1C	ZINC000853707012	FG	On-Demand	Anodyne	ADORA2B	48	39
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCC4)cc3)ccc2n1C	ZINC000853707012	FG	On-Demand	Anodyne	ACOX1	52	37
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCC4)cc3)ccc2n1C	ZINC000853707012	FG	On-Demand	Anodyne	PRNP	45	34
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCC4)cc3)ccc2n1C	ZINC000853707012	FG	On-Demand	Anodyne	MCHR1	30	52
Cc1nc2cc(OCC(=O)Nc3ccc(N4CCCC4)cc3)ccc2n1C	ZINC000853707012	FG	On-Demand	Anodyne	MCHR2	36	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)nc(C)n3C)CC1	ZINC000853707026	FD	On-Demand	Anodyne	P2RY12	94	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)nc(C)n3C)CC1	ZINC000853707027	FD	On-Demand	Anodyne	P2RY12	94	38
CN(C)C(=O)CCN1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853707038	GE	On-Demand	Reactive	CXCR3	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(-c3ccc(F)cn3)n2)CC1	ZINC000853707058	GD	On-Demand	Anodyne	P2RY12	62	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(-c3ccc(F)cn3)n2)CC1	ZINC000853707059	GD	On-Demand	Anodyne	P2RY12	62	37
Fc1cc(N2CC[C@H](Oc3ccccc3)C2)ncn1	ZINC000853707064	CE	On-Demand	Anodyne	PDE3A	50	47
Fc1cc(N2CC[C@H](Oc3ccccc3)C2)ncn1	ZINC000853707064	CE	On-Demand	Anodyne	DCK	62	51
Fc1cc(N2CC[C@H](Oc3ccccc3)C2)ncn1	ZINC000853707064	CE	On-Demand	Anodyne	PDE3B	55	47
Fc1ncnc(N2CC[C@H](Oc3ccccc3)C2)c1Br	ZINC000853707105	EG	On-Demand	Anodyne	PDE3A	51	48
Fc1ncnc(N2CC[C@H](Oc3ccccc3)C2)c1Br	ZINC000853707105	EG	On-Demand	Anodyne	DCK	55	42
Fc1ncnc(N2CC[C@H](Oc3ccccc3)C2)c1Br	ZINC000853707105	EG	On-Demand	Anodyne	PDE3B	56	48
CC(C)(C)OC(=O)N1CC[C@H](CCn2cc3c(n2)CCOC3)C1	ZINC000853707109	DF	On-Demand	Anodyne	GPR119	40	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc3c(n2)CCOC3)C1	ZINC000853707110	DF	On-Demand	Anodyne	GPR119	40	41
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@H](Oc2ccccc2)C1	ZINC000853707119	GF	On-Demand	Anodyne	LIPG	49	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Oc3cccnc3)cc2)CC1	ZINC000853707124	GF	On-Demand	Anodyne	P2RY12	68	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Oc3cccnc3)cc2)CC1	ZINC000853707125	GF	On-Demand	Anodyne	P2RY12	68	38
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	DRD2	16	46
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	DRD4	40	46
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	ACHE	19	45
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	HRH2	22	44
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	KCNH2	18	46
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	HTR4	37	45
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	SIGMAR1	40	57
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	SSTR5	88	50
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	CCR3	56	46
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	UTS2R	31	55
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	EPHX2	15	42
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	PDK1	54	42
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	CXCR3	47	39
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000853707131	GF	On-Demand	Anodyne	MCHR1	68	62
C#CCN1CCN(C(=O)COc2cccc(-c3ccncc3)c2)CC1	ZINC000853707179	ED	On-Demand	Mild	CPT1A	74	39
CC(C)(C)CC(=O)NOCCOCc1ccccc1	ZINC000853707217	CF	On-Demand	Anodyne	CTSK	15	40
O=C(Cn1c(Cl)cncc1=O)NC1CCCCC1	ZINC000853707228	CD	On-Demand	Anodyne	CNR1	21	45
Cc1cc(N2CCC[C@H](NC(=O)NCCc3nnc(S)n3C)C2)nc(C)n1	ZINC000853707268	GD	On-Demand	Anodyne	GPBAR1	22	41
CC(C)(C)OC(=O)Cn1cc(Nc2ccc3c(c2)S(=O)(=O)N=C3Cl)cn1	ZINC000853707269	GF	On-Demand	Anodyne	PANC	41	34
O=C(Cn1c(Cl)cncc1=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853707276	GC	On-Demand	Anodyne	TGM2	66	38
O=C(Cn1c(Cl)cncc1=O)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853707276	GC	On-Demand	Anodyne	F13A1	75	41
CC(C)(C)OC(=O)N1CCC(CCCn2cc3c(n2)CCOC3)CC1	ZINC000853707306	EG	On-Demand	Anodyne	GPR119	48	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc(-c3ccncn3)n2)CC1	ZINC000853707315	FB	On-Demand	Anodyne	P2RY12	58	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc(-c3ccncn3)n2)CC1	ZINC000853707316	FB	On-Demand	Anodyne	P2RY12	58	38
C[C@@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853707431	JE	On-Demand	Mild	VIPR1	26	42
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853707432	JE	On-Demand	Mild	VIPR1	26	42
CC(C)(C)OC(=O)N1CCC(CCn2cc3c(n2)CCOC3)CC1	ZINC000853707491	EF	On-Demand	Anodyne	GPR119	50	45
O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[C@H](Oc2ccccc2)C1	ZINC000853707505	EI	On-Demand	Bother	LIPG	45	41
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853707590	JE	On-Demand	Mild	CCKAR	37	43
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853707590	JE	On-Demand	Mild	NMBR	24	45
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853707590	JE	On-Demand	Mild	GRPR	46	30
C[C@@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853707591	JE	On-Demand	Mild	CCKAR	37	43
C[C@@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853707591	JE	On-Demand	Mild	NMBR	24	45
C[C@@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853707591	JE	On-Demand	Mild	GRPR	46	30
N#Cc1ncc(Br)cc1N1CC[C@H](Oc2ccccc2)C1	ZINC000853707628	EG	On-Demand	Mild	PDE3B	42	39
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853707649	JD	On-Demand	Mild	DRD4	22	41
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853707649	JD	On-Demand	Mild	SIGMAR1	17	40
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853707650	JD	On-Demand	Mild	DRD4	22	41
C[C@H](OC(=O)CCC/N=C1/NS(=O)(=O)c2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853707650	JD	On-Demand	Mild	SIGMAR1	17	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc3c(n2)CCOC3)CC1	ZINC000853707778	EC	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc3c(n2)CCOC3)CC1	ZINC000853707779	EC	On-Demand	Anodyne	P2RY12	43	35
Fc1cnc(N2CC[C@H](Oc3ccccc3)C2)cn1	ZINC000853707850	CE	On-Demand	Anodyne	DCK	45	42
Fc1cnc(N2CC[C@H](Oc3ccccc3)C2)cn1	ZINC000853707850	CE	On-Demand	Anodyne	PDE3B	45	38
CC(C)(C)OC(=O)N1CCC(Cn2cc3c(n2)CCOC3)CC1	ZINC000853707861	DF	On-Demand	Anodyne	GPR119	48	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-n3ccccc3=O)c2)CC1	ZINC000853707872	GD	On-Demand	Anodyne	P2RY12	167	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-n3ccccc3=O)c2)CC1	ZINC000853707873	GD	On-Demand	Anodyne	P2RY12	167	41
C#CC[C@@H]1CCCN(c2ncc(C(=O)OCC)s2)C1	ZINC000853708012	CF	On-Demand	Mild	PARE	29	40
C#CC[C@H]1CCCN(c2ncc(C(=O)OCC)s2)C1	ZINC000853708013	CF	On-Demand	Mild	PARE	29	40
C#CC[C@@H]1CCCN(c2ccnc(C(=O)OC)n2)C1	ZINC000853708029	CD	On-Demand	Mild	SORD	73	41
C#CC[C@@H]1CCCN(c2ccnc(C(=O)OC)n2)C1	ZINC000853708029	CD	On-Demand	Mild	GPBAR1	15	40
C#CC[C@H]1CCCN(c2ccnc(C(=O)OC)n2)C1	ZINC000853708030	CD	On-Demand	Mild	SORD	73	41
C#CC[C@H]1CCCN(c2ccnc(C(=O)OC)n2)C1	ZINC000853708030	CD	On-Demand	Mild	GPBAR1	15	40
O=C(Cn1cc2c(n1)CCOC2)Nc1ccc(N2CCOCC2)cc1	ZINC000853708052	ED	On-Demand	Anodyne	MTOR	46	36
O=C(Cn1cc2c(n1)CCOC2)Nc1ccc(N2CCOCC2)cc1	ZINC000853708052	ED	On-Demand	Anodyne	STAT6	52	32
CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc4c(n3)CCOC4)c2C)cc1	ZINC000853708089	GH	On-Demand	Clean	CACNA2D1	58	34
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)CC1	ZINC000853708225	JC	On-Demand	Mild	P2RY12	43	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)CC1	ZINC000853708226	JC	On-Demand	Mild	P2RY12	43	35
Fc1cc(N[C@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)ncn1	ZINC000853708236	DH	On-Demand	Anodyne	KCNN3	36	40
Fc1cc(N[C@@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)ncn1	ZINC000853708237	DH	On-Demand	Anodyne	KCNN3	36	40
Fc1cc(N[C@H]2CCC[C@H](c3nc4ccccc4[nH]3)C2)ncn1	ZINC000853708238	DH	On-Demand	Anodyne	KCNN3	36	40
Fc1cc(N[C@@H]2CCC[C@@H](c3nc4ccccc4[nH]3)C2)ncn1	ZINC000853708239	DH	On-Demand	Anodyne	KCNN3	36	40
CC(C)c1ccc2ncnc(N3CC(N4CC[C@H](O)C4)C3)c2c1	ZINC000853708353	DE	On-Demand	Anodyne	PDE3A	42	42
CC(C)c1ccc2ncnc(N3CC(N4CC[C@H](O)C4)C3)c2c1	ZINC000853708353	DE	On-Demand	Anodyne	PDE3B	46	42
CON(C)CCNC(=O)NCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000853708373	FD	On-Demand	Anodyne	UTS2	41	33
CC[C@@H](Nc1cc(Cl)nc2cc(C)nn12)C(=O)NCc1cccs1	ZINC000853708409	FG	On-Demand	Anodyne	KCNN1	15	45
CC[C@H](Nc1cc(Cl)nc2cc(C)nn12)C(=O)NCc1cccs1	ZINC000853708410	FG	On-Demand	Anodyne	KCNN1	15	45
O[C@H]1CCN(C2CN(c3nc(NCc4ccccc4)c4ccccc4n3)C2)C1	ZINC000853708411	GE	On-Demand	Anodyne	CCR4	20	41
O[C@H]1CCN(C2CN(c3nc(NCc4ccccc4)c4ccccc4n3)C2)C1	ZINC000853708411	GE	On-Demand	Anodyne	STAT6	17	42
CCOC(=O)c1nccc(N2C[C@H](C)N(CCOC)[C@H](C)C2)n1	ZINC000853708450	DD	On-Demand	Anodyne	SORD	67	46
C#CC[C@@H]1CCCN(c2ccnc(C(=O)OCC)n2)C1	ZINC000853708452	CD	On-Demand	Mild	SORD	72	40
C#CC[C@H]1CCCN(c2ccnc(C(=O)OCC)n2)C1	ZINC000853708453	CD	On-Demand	Mild	SORD	72	40
COc1cc(N(C)CCNC(C)=O)c([N+](=O)[O-])cc1C	ZINC000853708515	CD	On-Demand	Bother	NQO2	42	38
COc1cc(N(C)CCNC(C)=O)c([N+](=O)[O-])cc1C	ZINC000853708515	CD	On-Demand	Bother	MTNR1A	17	44
COc1cc(N(C)CCNC(C)=O)c([N+](=O)[O-])cc1C	ZINC000853708515	CD	On-Demand	Bother	MTNR1B	20	44
C#CCCCOc1cccnc1N(C)CCNC(C)=O	ZINC000853708518	CD	On-Demand	Mild	MTNR1A	24	46
C#CCCCOc1cccnc1N(C)CCNC(C)=O	ZINC000853708518	CD	On-Demand	Mild	MTNR1B	25	46
CC(=O)NCCN(C)c1ccc(C(C)=O)cc1I	ZINC000853708538	FE	On-Demand	Anodyne	MTNR1A	24	42
CC(=O)NCCN(C)c1ccc(C(C)=O)cc1I	ZINC000853708538	FE	On-Demand	Anodyne	MTNR1B	20	42
C#Cc1cccnc1N(C)CCNC(C)=O	ZINC000853708551	BC	On-Demand	Mild	MTNR1A	20	43
C#Cc1cccnc1N(C)CCNC(C)=O	ZINC000853708551	BC	On-Demand	Mild	MTNR1B	17	43
C#Cc1cccnc1N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000853708569	DE	On-Demand	Mild	EPHX2	18	47
C#Cc1cccnc1N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000853708569	DE	On-Demand	Mild	GPBAR1	16	41
C#Cc1cccnc1N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000853708569	DE	On-Demand	Mild	SCD	19	41
C#Cc1cccnc1N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000853708570	DE	On-Demand	Mild	EPHX2	18	47
C#Cc1cccnc1N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000853708570	DE	On-Demand	Mild	GPBAR1	16	41
C#Cc1cccnc1N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000853708570	DE	On-Demand	Mild	SCD	19	41
C#CC1CCN(c2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853708720	CG	On-Demand	Mild	PDE3A	48	41
C#CC1CCN(c2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853708720	CG	On-Demand	Mild	PDE3B	53	41
C#CC1CCN(c2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853708720	CG	On-Demand	Mild	PDE10A	22	41
C#CC1CCN(c2nccc3cc(OC)c(OC)cc23)CC1	ZINC000853708720	CG	On-Demand	Mild	EHMT2	55	34
CCNS(=O)(=O)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853708737	GD	On-Demand	Reactive	CSNK1D	42	45
O=S1(=O)NCCCN1Cc1nc2ccccc2s1	ZINC000853708773	CD	On-Demand	Anodyne	AKR1B1	21	41
CCCCCCn1c(=O)c(C)cn(C)c1=O	ZINC000853708777	BD	On-Demand	Anodyne	CNR2	21	40
CCCCCCn1c(=O)c(C)cn(C)c1=O	ZINC000853708777	BD	On-Demand	Anodyne	ASAH1	69	37
COc1ccc(N2CCN(C(=O)Cn3c(=O)c(C)cn(C)c3=O)CC2)cc1	ZINC000853708791	FC	On-Demand	Clean	HTR7	16	41
COc1ccc(N2CCN(C(=O)Cn3c(=O)c(C)cn(C)c3=O)CC2)cc1	ZINC000853708791	FC	On-Demand	Clean	CCR1	24	40
CC(C)c1ccc2ncnc(NCCn3cnnn3)c2c1	ZINC000853708813	CD	On-Demand	Anodyne	CLK4	53	33
C[C@@H](CNC(=O)NC1CCN(CCS(C)(=O)=O)CC1)c1ccccn1	ZINC000853708825	FC	On-Demand	Anodyne	EPHX2	21	41
CCNS(=O)(=O)CCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853708857	GB	On-Demand	Anodyne	CCR3	20	40
CCNS(=O)(=O)CCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853708869	GB	On-Demand	Anodyne	CCR3	20	40
CC(C)(C)OC(=O)NCc1ccc(CNc2nc3ncccc3cc2C#N)cc1	ZINC000853708900	GI	On-Demand	Mild	SUCNR1	53	38
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c1	ZINC000853708903	IF	On-Demand	Anodyne	KCNK3	55	33
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)c1	ZINC000853708904	IF	On-Demand	Anodyne	KCNK3	55	33
CC(C)(C)OC(=O)NCc1ccc(CNc2cc(CO)c(F)cn2)cc1	ZINC000853708928	FG	On-Demand	Anodyne	TRPV1	16	40
C#CC1CCN(c2ccnc(C(=O)OC)n2)CC1	ZINC000853708943	BD	On-Demand	Mild	SORD	65	41
CCNS(=O)(=O)CCNC(=O)NCC[C@H](C)N(C)C	ZINC000853708967	CB	On-Demand	Anodyne	CHRNA4	17	40
CCNS(=O)(=O)CCNC(=O)NCC[C@@H](C)N(C)C	ZINC000853708969	CB	On-Demand	Anodyne	CHRNA4	17	40
CC(C)(C)OC(=O)NCc1ccc(CNc2nccc3c(N)cccc23)cc1	ZINC000853708979	GI	On-Demand	Anodyne	PDS	43	32
COc1ccc(N2CCN(C(=O)Cn3cc4c(n3)CCOC4)CC2)cc1	ZINC000853709053	FD	On-Demand	Clean	CCR1	21	43
CON(C)CCNC(=O)NCCCc1cccc(F)c1	ZINC000853709115	CD	On-Demand	Anodyne	MTNR1A	36	47
CON(C)CCNC(=O)NCCCc1cccc(F)c1	ZINC000853709115	CD	On-Demand	Anodyne	MTNR1B	32	47
CON(C)CCNC(=O)NCCCc1cccc(F)c1	ZINC000853709115	CD	On-Demand	Anodyne	CRTM	52	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(Cl)ccc2=O)CC1	ZINC000853709122	ED	On-Demand	Anodyne	P2RY12	104	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(Cl)ccc2=O)CC1	ZINC000853709122	ED	On-Demand	Anodyne	MC4R	53	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(Cl)ccc2=O)CC1	ZINC000853709122	ED	On-Demand	Anodyne	CCR1	44	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(Cl)ccc2=O)CC1	ZINC000853709123	ED	On-Demand	Anodyne	P2RY12	104	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(Cl)ccc2=O)CC1	ZINC000853709123	ED	On-Demand	Anodyne	MC4R	53	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(Cl)ccc2=O)CC1	ZINC000853709123	ED	On-Demand	Anodyne	CCR1	44	38
COc1ccc(Cn2c(=O)cc(C)c3cc(OC)c(OC)cc32)cc1	ZINC000853709155	EG	On-Demand	Anodyne	PROKR1	62	34
COc1ccc(Cn2c(=O)cc(C)c3cc(OC)c(OC)cc32)cc1	ZINC000853709155	EG	On-Demand	Anodyne	NPBWR1	36	42
COc1ccc(Cn2c(=O)cc(C)c3cc(OC)c(OC)cc32)cc1	ZINC000853709155	EG	On-Demand	Anodyne	IDH1	23	41
C[C@@H]1N(C(=O)NC2CCN(CCS(C)(=O)=O)CC2)c2ccccc2C1(C)C	ZINC000853709185	GE	On-Demand	Anodyne	DRD4	20	44
CN(C(=O)NC1CCN(CCS(C)(=O)=O)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853709203	GC	On-Demand	Anodyne	SIGMAR1	24	44
CN(C(=O)NC1CCN(CCS(C)(=O)=O)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853709203	GC	On-Demand	Anodyne	CCR5	40	42
C#CC1CCN(c2ccnc(C(=O)OCC)n2)CC1	ZINC000853709206	CD	On-Demand	Mild	SORD	62	39
CN(C(=O)NC1CCN(CCS(C)(=O)=O)CC1)[C@H](CO)Cc1ccccc1	ZINC000853709210	GC	On-Demand	Anodyne	SIGMAR1	24	44
CN(C(=O)NC1CCN(CCS(C)(=O)=O)CC1)[C@H](CO)Cc1ccccc1	ZINC000853709210	GC	On-Demand	Anodyne	CCR5	40	42
CCNS(=O)(=O)CCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853709211	FB	On-Demand	Anodyne	L3MBTL3	48	36
CCNS(=O)(=O)CCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853709213	FB	On-Demand	Anodyne	L3MBTL3	48	36
COc1cc(N2CC[C@H](C(=O)NCc3ccccc3)C2)c([N+](=O)[O-])cc1C	ZINC000853709231	FG	On-Demand	Bother	EPHX2	18	47
C#CC[C@@H]1CCCN(c2cc(CC(=O)OC)ccn2)C1	ZINC000853709238	CE	On-Demand	Mild	GPBAR1	18	41
COc1cc(N2CC[C@@H](C(=O)NCc3ccccc3)C2)c([N+](=O)[O-])cc1C	ZINC000853709239	FG	On-Demand	Bother	EPHX2	18	47
C#CC[C@H]1CCCN(c2cc(CC(=O)OC)ccn2)C1	ZINC000853709241	CE	On-Demand	Mild	GPBAR1	18	41
C#CC[C@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709251	DG	On-Demand	Mild	PDE3A	47	45
C#CC[C@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709251	DG	On-Demand	Mild	PDE3B	52	39
C#CC[C@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709251	DG	On-Demand	Mild	PDE10A	17	45
C#CC[C@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709251	DG	On-Demand	Mild	EHMT2	54	31
C#CC[C@@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709255	DG	On-Demand	Mild	PDE3A	47	45
C#CC[C@@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709255	DG	On-Demand	Mild	PDE3B	52	39
C#CC[C@@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709255	DG	On-Demand	Mild	PDE10A	17	45
C#CC[C@@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853709255	DG	On-Demand	Mild	EHMT2	54	31
O=C(Cn1cc2c(n1)CCOC2)NC1CCCCCCC1	ZINC000853709257	CE	On-Demand	Anodyne	WNT3A	45	32
CCNS(=O)(=O)CCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853709262	EC	On-Demand	Anodyne	MME	45	43
CCNS(=O)(=O)CCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853709262	EC	On-Demand	Anodyne	NPY5R	19	42
CCNS(=O)(=O)CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853709263	EC	On-Demand	Anodyne	MME	45	43
CCNS(=O)(=O)CCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853709263	EC	On-Demand	Anodyne	NPY5R	19	42
CCNS(=O)(=O)CCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853709341	FC	On-Demand	Anodyne	MTNR1A	44	40
CCNS(=O)(=O)CCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853709341	FC	On-Demand	Anodyne	MTNR1B	38	40
CCNS(=O)(=O)CCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853709343	FC	On-Demand	Anodyne	MTNR1A	44	40
CCNS(=O)(=O)CCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853709343	FC	On-Demand	Anodyne	MTNR1B	38	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)N[C@@H]2CCOc3ccc(F)cc32)C1	ZINC000853709378	GG	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)N[C@H]2CCOc3ccc(F)cc32)C1	ZINC000853709382	GG	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)N[C@@H]2CCOc3ccc(F)cc32)C1	ZINC000853709385	GG	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)N[C@H]2CCOc3ccc(F)cc32)C1	ZINC000853709388	GG	On-Demand	Anodyne	GPR119	15	41
COc1cccc(Nc2nc(N3CC(N4CC[C@H](O)C4)C3)nc3[nH]cnc23)c1	ZINC000853709406	GD	On-Demand	Anodyne	CCR4	27	40
COc1cccc(Nc2nc(N3CC(N4CC[C@H](O)C4)C3)nc3[nH]cnc23)c1	ZINC000853709406	GD	On-Demand	Anodyne	PDPK1	15	44
COc1cccc(Nc2nc(N3CC(N4CC[C@H](O)C4)C3)nc3[nH]cnc23)c1	ZINC000853709406	GD	On-Demand	Anodyne	TTK	38	40
O=C(NCc1ccccc1)[C@@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709445	DD	On-Demand	Anodyne	PREP	16	41
O=C(NCc1ccccc1)[C@@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709445	DD	On-Demand	Anodyne	EPHX2	17	48
O=C(NCc1ccccc1)[C@@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709445	DD	On-Demand	Anodyne	CACNA1G	39	41
O=C(NCc1ccccc1)[C@@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709445	DD	On-Demand	Anodyne	GPBAR1	20	42
O=C(NCc1ccccc1)[C@@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709445	DD	On-Demand	Anodyne	NAMPT	41	34
O=C(NCc1ccccc1)[C@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709448	DD	On-Demand	Anodyne	PREP	16	41
O=C(NCc1ccccc1)[C@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709448	DD	On-Demand	Anodyne	EPHX2	17	48
O=C(NCc1ccccc1)[C@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709448	DD	On-Demand	Anodyne	CACNA1G	39	41
O=C(NCc1ccccc1)[C@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709448	DD	On-Demand	Anodyne	GPBAR1	20	42
O=C(NCc1ccccc1)[C@H]1CCN(c2cnc(F)cn2)C1	ZINC000853709448	DD	On-Demand	Anodyne	NAMPT	41	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cc(OC)ncn2)CC1	ZINC000853709550	GC	On-Demand	Anodyne	P2RY12	79	38
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cc(OC)ncn2)CC1	ZINC000853709551	GC	On-Demand	Anodyne	P2RY12	79	38
CC(C)(C)OC(=O)NCc1ccc(CNc2cc(F)ncn2)cc1	ZINC000853709555	EG	On-Demand	Anodyne	PDS	44	34
C#CCCCOc1cccnc1N1CCc2cccc(C(=O)OC)c2C1	ZINC000853709581	FG	On-Demand	Mild	BCL2L1	41	33
COCC1(NC(=O)NC2CCN(CCS(C)(=O)=O)CC2)CCCC1	ZINC000853709582	FC	On-Demand	Anodyne	EPHX2	16	40
N#Cc1cnnc(NC[C@@H]2CCCCN2C(=O)C(F)(F)F)c1	ZINC000853709610	DD	On-Demand	Mild	DPP4	15	42
N#Cc1cnnc(NC[C@H]2CCCCN2C(=O)C(F)(F)F)c1	ZINC000853709614	DD	On-Demand	Mild	DPP4	15	42
CCNc1nccnc1NCc1ccc(CNC(=O)OC(C)(C)C)cc1	ZINC000853709674	FH	On-Demand	Anodyne	PDS	51	35
C=C(C)Cc1cccc(C(=O)OC)c1OCc1cnn(C)n1	ZINC000853709676	DE	On-Demand	Mild	MT-CYB	47	31
CCNS(=O)(=O)CCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853709693	EB	On-Demand	Anodyne	CPT1A	40	34
CCNS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853709700	EB	On-Demand	Anodyne	CPT1A	40	34
O=C(NCc1ccccc1)[C@@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853709706	GF	On-Demand	Anodyne	SIRT3	41	32
O=C(NCc1ccccc1)[C@@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853709706	GF	On-Demand	Anodyne	LIMK2	23	41
O=C(NCc1ccccc1)[C@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853709707	GF	On-Demand	Anodyne	SIRT3	41	32
O=C(NCc1ccccc1)[C@H]1CCN(c2ncnc(F)c2Br)C1	ZINC000853709707	GF	On-Demand	Anodyne	LIMK2	23	41
O=C(COC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)NC1CCN(C2CC2)CC1	ZINC000853709709	HD	On-Demand	Anodyne	CCR2	24	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3ccccc3c2OC)CC1	ZINC000853709810	GF	On-Demand	Anodyne	P2RY12	113	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3ccccc3c2OC)CC1	ZINC000853709810	GF	On-Demand	Anodyne	NCEH1	22	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3ccccc3c2OC)CC1	ZINC000853709811	GF	On-Demand	Anodyne	P2RY12	113	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3ccccc3c2OC)CC1	ZINC000853709811	GF	On-Demand	Anodyne	NCEH1	22	44
N#Cc1ncc(Br)cc1N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000853709869	GF	On-Demand	Mild	EPHX2	15	43
N#Cc1ncc(Br)cc1N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000853709870	GF	On-Demand	Mild	EPHX2	15	43
CCNS(=O)(=O)CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853709878	EC	On-Demand	Anodyne	PRSS2	52	33
CCNS(=O)(=O)CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853709878	EC	On-Demand	Anodyne	EPHX2	23	45
C#CC1CCN(c2ccc(C)nn2)CC1	ZINC000853709900	BD	On-Demand	Mild	SCD1	44	38
CCCCC[C@@H](C)NC(=O)Cn1c(=O)c(C)cn(C)c1=O	ZINC000853710033	CC	On-Demand	Anodyne	ASAH1	43	32
CCCCC[C@@H](C)NC(=O)Cn1c(=O)c(C)cn(C)c1=O	ZINC000853710033	CC	On-Demand	Anodyne	NOD1	51	34
O=C1N[C@@H]2CN(c3nc(NCc4ccccc4)c4ccccc4n3)CC[C@H]2CO1	ZINC000853710043	GG	On-Demand	Anodyne	HRH4	16	42
C#CCCCOc1cccnc1N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000853710054	FG	On-Demand	Mild	SCD	26	43
C#CCCCOc1cccnc1N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000853710055	FG	On-Demand	Mild	SCD	26	43
O=C(NCc1ccccc1)[C@@H]1CCN(c2cc(F)ncn2)C1	ZINC000853710084	DD	On-Demand	Anodyne	EPHX2	20	47
O=C(NCc1ccccc1)[C@@H]1CCN(c2cc(F)ncn2)C1	ZINC000853710084	DD	On-Demand	Anodyne	CACNA1G	44	39
O=C(NCc1ccccc1)[C@@H]1CCN(c2cc(F)ncn2)C1	ZINC000853710084	DD	On-Demand	Anodyne	GPBAR1	20	41
O=C(NCc1ccccc1)[C@H]1CCN(c2cc(F)ncn2)C1	ZINC000853710085	DD	On-Demand	Anodyne	EPHX2	20	47
O=C(NCc1ccccc1)[C@H]1CCN(c2cc(F)ncn2)C1	ZINC000853710085	DD	On-Demand	Anodyne	CACNA1G	44	39
O=C(NCc1ccccc1)[C@H]1CCN(c2cc(F)ncn2)C1	ZINC000853710085	DD	On-Demand	Anodyne	GPBAR1	20	41
CC(C)c1ccc2ncnc(N3CC[C@@H]4COC(=O)N[C@H]4C3)c2c1	ZINC000853710104	EF	On-Demand	Anodyne	PDE3A	43	42
CC(C)c1ccc2ncnc(N3CC[C@@H]4COC(=O)N[C@H]4C3)c2c1	ZINC000853710104	EF	On-Demand	Anodyne	PDE3B	48	42
CC(=O)NCCN(C)c1cnc(F)cn1	ZINC000853710129	BC	On-Demand	Anodyne	MTNR1A	18	41
CC(=O)NCCN(C)c1cnc(F)cn1	ZINC000853710129	BC	On-Demand	Anodyne	MTNR1B	15	41
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853710148	JD	On-Demand	Anodyne	CA2	44	41
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853710148	JD	On-Demand	Anodyne	CA1	27	41
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853710148	JD	On-Demand	Anodyne	CA4	23	41
N#Cc1cnnc(N2CC[C@H]3COC(=O)N[C@@H]3C2)c1	ZINC000853710193	CC	On-Demand	Mild	CHRNA3	23	41
CC(C)(C)OC(=O)N1CCC(CCCN2CCCNS2(=O)=O)CC1	ZINC000853710221	FD	On-Demand	Anodyne	GPR119	28	46
CC(C)(C)OC(=O)N1CC[C@H](CCN2CCCNS2(=O)=O)C1	ZINC000853710282	ED	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CC[C@@H](CCN2CCCNS2(=O)=O)C1	ZINC000853710283	ED	On-Demand	Anodyne	GPR119	28	41
COc1ccc(Cn2c(=O)c(C)cn(C)c2=O)cc1	ZINC000853710302	CC	On-Demand	Anodyne	PROKR1	86	42
COc1ccc(Cn2c(=O)c(C)cn(C)c2=O)cc1	ZINC000853710302	CC	On-Demand	Anodyne	NPBWR1	73	45
Cc1ccc(CC2CN(C(=O)NC3CCN(CCS(C)(=O)=O)CC3)C2)cc1	ZINC000853710308	GD	On-Demand	Anodyne	DRD4	17	40
Cc1ccc(CC2CN(C(=O)NC3CCN(CCS(C)(=O)=O)CC3)C2)cc1	ZINC000853710308	GD	On-Demand	Anodyne	CCR3	48	41
O=C1N[C@H]2CN(c3ccc4c(c3)S(=O)(=O)N=C4Cl)CC[C@@H]2CO1	ZINC000853710322	FD	On-Demand	Anodyne	CHRNA3	42	35
NC(=O)c1cc(N2CC[C@@H]3COC(=O)N[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000853710338	DC	On-Demand	Bother	CHRNA3	33	41
NC(=O)c1cc(N2CC[C@@H]3COC(=O)N[C@H]3C2)ccc1[N+](=O)[O-]	ZINC000853710338	DC	On-Demand	Bother	CHRNA4	15	41
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NCCCc2cccc(F)c2)C3)cn1	ZINC000853710352	GF	On-Demand	Anodyne	MAPK1	15	42
O=C1N[C@@H]2CN(c3cnc(N4CC[C@@H]5COC(=O)N[C@H]5C4)cn3)CC[C@H]2CO1	ZINC000853710375	GC	On-Demand	Anodyne	CHRNA3	44	37
O=C1N[C@@H]2CN(c3nc4ccccc4n4cccc34)CC[C@H]2CO1	ZINC000853710377	DE	On-Demand	Anodyne	HTR3A	24	40
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000853710415	IE	On-Demand	Anodyne	DPP7	20	43
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(=O)(=O)C(F)F)cc2)C1	ZINC000853710442	IE	On-Demand	Anodyne	DPP7	20	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(CCS(C)(=O)=O)CC2)C1	ZINC000853710483	FB	On-Demand	Anodyne	HTR4	19	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(CCS(C)(=O)=O)CC2)C1	ZINC000853710483	FB	On-Demand	Anodyne	EPHX2	18	42
C#CCCN(CCOC)C(=O)NCCCc1cccc(F)c1	ZINC000853710578	DE	On-Demand	Mild	CRTM	52	37
CCCCCCCCn1c(=O)c(C)cn(C)c1=O	ZINC000853710641	CE	On-Demand	Mild	CNR2	21	40
CCCCCCCCn1c(=O)c(C)cn(C)c1=O	ZINC000853710641	CE	On-Demand	Mild	ASAH1	69	37
O=C1N[C@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@@H]2CO1	ZINC000853710724	EF	On-Demand	Bother	CHRNA3	21	40
CN(C)S(=O)(=O)c1ccccc1N1CCC[C@@](O)(c2ccc(Cl)cc2)C1	ZINC000853710835	GG	On-Demand	Anodyne	CCR1	48	45
CN(C)S(=O)(=O)c1ccccc1N1CCC[C@](O)(c2ccc(Cl)cc2)C1	ZINC000853710836	GG	On-Demand	Anodyne	CCR1	48	45
CON(C)CCNC(=O)NCC1(Sc2ccccc2)CCCC1	ZINC000853710843	EF	On-Demand	Anodyne	HCN1	49	30
CON(C)CCNC(=O)NCC1(Sc2ccccc2)CCCC1	ZINC000853710843	EF	On-Demand	Anodyne	HCN4	47	30
Cn1nnc2c(N3C[C@@H]4CCC[C@]4(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853710874	FD	On-Demand	Anodyne	SIRT3	36	41
Cn1nnc2c(N3C[C@@H]4CCC[C@]4(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853710874	FD	On-Demand	Anodyne	SIRT2	32	41
Cn1nnc2c(N3C[C@@H]4CCC[C@]4(CNC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853710874	FD	On-Demand	Anodyne	SIRT1	29	41
CCCCC[C@@H](C)NC(=O)CN1CCCNS1(=O)=O	ZINC000853710896	CC	On-Demand	Anodyne	NOD1	56	35
CCOc1ccc(-n2c(C)cc(C(=O)CN3CCCNS3(=O)=O)c2C)cc1	ZINC000853710914	GE	On-Demand	Clean	CACNA2D1	49	35
COC(=O)c1cccc(NNC(=O)NC2CCN(CC(=O)N(C)C)CC2)c1C	ZINC000853710985	GC	On-Demand	Reactive	CCR8	47	33
CCNc1nccnc1N1CCC[C@@](O)(c2ccc(Cl)cc2)C1	ZINC000853711008	EG	On-Demand	Anodyne	CCR1	46	35
CCNc1nccnc1N1CCC[C@](O)(c2ccc(Cl)cc2)C1	ZINC000853711009	EG	On-Demand	Anodyne	CCR1	46	35
CN1CCCN(CC2CCN(C(=O)OC(C)(C)C)CC2)S1(=O)=O	ZINC000853711016	ED	On-Demand	Anodyne	GPR119	33	43
CN1CCCN(CCC2CCN(C(=O)OC(C)(C)C)CC2)S1(=O)=O	ZINC000853711032	FD	On-Demand	Anodyne	GPR119	42	44
Cn1ncnc1N1CCC[C@@](O)(c2ccc(Cl)cc2)C1	ZINC000853711039	CD	On-Demand	Anodyne	CCR1	48	36
Cn1ncnc1N1CCC[C@](O)(c2ccc(Cl)cc2)C1	ZINC000853711040	CD	On-Demand	Anodyne	CCR1	48	36
CC(C)(C)OC(=O)N1CCC(CCN2CCCNS2(=O)=O)CC1	ZINC000853711066	ED	On-Demand	Anodyne	GPR119	32	45
COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccc(OC)cc4)CC3)C2)cc1	ZINC000853711067	GG	On-Demand	Clean	EPHX2	19	41
COc1ccc(N2CC[C@H](NC(=O)NC3(c4ccc(OC)cc4)CC3)C2)cc1	ZINC000853711067	GG	On-Demand	Clean	NPBWR1	55	32
COC(=O)Cc1ccnc(N2CCC[C@@](O)(c3ccc(Cl)cc3)C2)c1	ZINC000853711079	FF	On-Demand	Anodyne	CCR1	41	36
COC(=O)Cc1ccnc(N2CCC[C@](O)(c3ccc(Cl)cc3)C2)c1	ZINC000853711080	FF	On-Demand	Anodyne	CCR1	41	36
O=C(CN1CCCNS1(=O)=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853711122	FC	On-Demand	Anodyne	MTOR	40	36
O=C(CN1CCCNS1(=O)=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853711122	FC	On-Demand	Anodyne	STAT6	50	31
O=S1(=O)NCCCN1CCOc1cccc(F)c1	ZINC000853711194	CC	On-Demand	Anodyne	CHRNA10	56	46
O=C(CN1CCCNS1(=O)=O)Nc1ccc2ccccc2c1	ZINC000853711307	DD	On-Demand	Anodyne	IMDH_CRYPV	27	43
CCOC(Cn1cnc2[nH]c3ccccc3c2c1=O)OCC	ZINC000853711315	DE	On-Demand	Anodyne	PTK6	19	40
N#Cc1nc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)sc1Cl	ZINC000853711317	FG	On-Demand	Mild	CTSL	18	43
N#Cc1nc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)sc1Cl	ZINC000853711320	FG	On-Demand	Mild	CTSL	18	43
O=C(N[C@@H]1[C@H]2C[C@H]1N(c1cnc(F)cn1)C2)OCc1ccccc1	ZINC000853711331	EE	On-Demand	Anodyne	CTSK	17	40
O=C(N[C@@H]1[C@H]2C[C@H]1N(c1cnc(F)cn1)C2)OCc1ccccc1	ZINC000853711331	EE	On-Demand	Anodyne	CTSL	20	40
O=C(N[C@H]1[C@H]2C[C@H]1N(c1cnc(F)cn1)C2)OCc1ccccc1	ZINC000853711334	EE	On-Demand	Anodyne	CTSK	17	40
O=C(N[C@H]1[C@H]2C[C@H]1N(c1cnc(F)cn1)C2)OCc1ccccc1	ZINC000853711334	EE	On-Demand	Anodyne	CTSL	20	40
O=c1c2c(ncn1CC1OCCO1)[nH]c1ccccc12	ZINC000853711344	CD	On-Demand	Anodyne	UTS2R	18	40
CN1CCCN(CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)S1(=O)=O	ZINC000853711414	ED	On-Demand	Anodyne	GPR119	31	40
CN1CCCN(CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)S1(=O)=O	ZINC000853711416	ED	On-Demand	Anodyne	GPR119	31	40
CON(C)CCNC(=O)NC1CCN(CCO)CC1	ZINC000853711528	CB	On-Demand	Anodyne	HTR4	19	45
CON(C)CCNC(=O)NC1CCN(CCO)CC1	ZINC000853711528	CB	On-Demand	Anodyne	SLC6A5	21	41
CCCCC[C@@H](C)NC(=O)CN1CCCN(C)S1(=O)=O	ZINC000853711557	DC	On-Demand	Anodyne	NOD1	56	35
CC(C)(C)OC(=O)N1CCC(CN2CCCNS2(=O)=O)CC1	ZINC000853711573	ED	On-Demand	Anodyne	GPR119	29	42
Cc1cc(N2CCC[C@@](O)(c3ccc(Cl)cc3)C2)cc(C#N)c1[N+](=O)[O-]	ZINC000853711584	FH	On-Demand	Mild	CCR1	41	37
CN1CCCN(CCCC2CCN(C(=O)OC(C)(C)C)CC2)S1(=O)=O	ZINC000853711635	GE	On-Demand	Anodyne	GPR119	32	45
COC(=O)c1nccc(N2CCC[C@@](O)(c3ccc(Cl)cc3)C2)n1	ZINC000853711665	EE	On-Demand	Anodyne	CCR1	43	38
COC(=O)c1nccc(N2CCC[C@](O)(c3ccc(Cl)cc3)C2)n1	ZINC000853711667	EE	On-Demand	Anodyne	CCR1	43	38
CCOC(=O)c1nccc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)n1	ZINC000853711751	GE	On-Demand	Anodyne	CAPN2	52	35
CCOC(=O)c1nccc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)n1	ZINC000853711752	GE	On-Demand	Anodyne	CAPN2	52	35
Fc1cnc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@H]32)cn1	ZINC000853711753	EE	On-Demand	Anodyne	DRD4	26	40
Fc1cnc(N2CCO[C@H]3CCN(Cc4ccccc4)C[C@@H]32)cn1	ZINC000853711754	EE	On-Demand	Anodyne	DRD4	26	40
Fc1cnc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@H]32)cn1	ZINC000853711755	EE	On-Demand	Anodyne	DRD4	26	40
Fc1cnc(N2CCO[C@@H]3CCN(Cc4ccccc4)C[C@@H]32)cn1	ZINC000853711756	EE	On-Demand	Anodyne	DRD4	26	40
CCCCCNC(=O)Cn1nc(Br)nc1C	ZINC000853711795	CD	On-Demand	Anodyne	ASAH1	91	37
CCCCC[C@@H](C)NC(=O)Cn1cnc2[nH]c3ccccc3c2c1=O	ZINC000853711819	EF	On-Demand	Anodyne	UTS2R	15	41
C[Si](C)(C)c1ccc(CNC(=O)NC2CCN(CCO)CC2)cc1	ZINC000853711824	ED	On-Demand	Anodyne	CCR3	26	41
C[Si](C)(C)c1ccc(CNC(=O)NC2CCN(CCO)CC2)cc1	ZINC000853711824	ED	On-Demand	Anodyne	SLC6A5	30	46
C[Si](C)(C)c1ccc(CNC(=O)NC2CCN(CCO)CC2)cc1	ZINC000853711824	ED	On-Demand	Anodyne	MCHR1	28	52
O=c1c2c(ncn1CC1CCS(=O)(=O)CC1)[nH]c1ccccc12	ZINC000853711846	ED	On-Demand	Anodyne	UTS2R	15	43
CC(=O)Nc1cnn(CCO[Si](C)(C)C(C)(C)C)c1	ZINC000853711881	CF	On-Demand	Reactive	PANC	52	33
O=C(COc1ccnnc1)Nc1ccc(N2CCCC2)cc1	ZINC000853711889	CE	On-Demand	Anodyne	KCNQ2	16	43
O=C(COc1ccnnc1)Nc1ccc(N2CCCC2)cc1	ZINC000853711889	CE	On-Demand	Anodyne	PRNP	43	37
O=C(COc1ccnnc1)Nc1ccc(N2CCCC2)cc1	ZINC000853711889	CE	On-Demand	Anodyne	MCHR1	19	44
CC(C)(C)OC(=O)N1CCC(CCCOc2ccnnc2)CC1	ZINC000853711895	DG	On-Demand	Anodyne	GPR119	77	57
CC(=O)Nc1cnn(CCOC(F)F)c1	ZINC000853711982	BD	On-Demand	Anodyne	PANC	41	32
CC(C)(C)OC(=O)NCc1ccc(CNc2cc(CO)c(F)cn2)c(F)c1	ZINC000853712005	GG	On-Demand	Anodyne	TRPV1	17	42
CC(C)(C)OC(=O)N1CCC(CCn2cnc3[nH]c4ccccc4c3c2=O)CC1	ZINC000853712038	GH	On-Demand	Anodyne	GPR119	46	43
O=C(N[C@@H]1[C@H]2C[C@H]1N(c1cc(F)ncn1)C2)OCc1ccccc1	ZINC000853712094	EE	On-Demand	Anodyne	CTSK	16	42
O=C(N[C@@H]1[C@H]2C[C@H]1N(c1cc(F)ncn1)C2)OCc1ccccc1	ZINC000853712094	EE	On-Demand	Anodyne	CTSL	19	42
O=C(N[C@H]1[C@H]2C[C@H]1N(c1cc(F)ncn1)C2)OCc1ccccc1	ZINC000853712095	EE	On-Demand	Anodyne	CTSK	16	42
O=C(N[C@H]1[C@H]2C[C@H]1N(c1cc(F)ncn1)C2)OCc1ccccc1	ZINC000853712095	EE	On-Demand	Anodyne	CTSL	19	42
CCNc1nccnc1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853712097	FE	On-Demand	Anodyne	CAPN2	45	32
CCNc1nccnc1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853712097	FE	On-Demand	Anodyne	NAAA	40	39
CCNc1nccnc1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853712098	FE	On-Demand	Anodyne	CAPN2	45	32
CCNc1nccnc1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853712098	FE	On-Demand	Anodyne	NAAA	40	39
O=C(N[C@@H]1[C@H]2C[C@H]1N(c1nccnc1OC1CCC1)C2)OCc1ccccc1	ZINC000853712127	GF	On-Demand	Anodyne	CTSL	20	42
O=C(N[C@H]1[C@H]2C[C@H]1N(c1nccnc1OC1CCC1)C2)OCc1ccccc1	ZINC000853712128	GF	On-Demand	Anodyne	CTSL	20	42
Cc1cc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)cc(C#N)c1[N+](=O)[O-]	ZINC000853712140	GG	On-Demand	Mild	CTSK	17	40
Cc1cc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)cc(C#N)c1[N+](=O)[O-]	ZINC000853712140	GG	On-Demand	Mild	CTSL	16	40
Cc1cc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)cc(C#N)c1[N+](=O)[O-]	ZINC000853712141	GG	On-Demand	Mild	CTSK	17	40
Cc1cc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)cc(C#N)c1[N+](=O)[O-]	ZINC000853712141	GG	On-Demand	Mild	CTSL	16	40
COC(=O)c1nccc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)n1	ZINC000853712158	FD	On-Demand	Anodyne	NAAA	40	39
COC(=O)c1nccc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)n1	ZINC000853712159	FD	On-Demand	Anodyne	NAAA	40	39
CN1CCCN(CCOc2cccc(F)c2)S1(=O)=O	ZINC000853712167	CD	On-Demand	Anodyne	CHRNA10	67	50
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853712188	DC	On-Demand	Anodyne	DRD4	17	46
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853712188	DC	On-Demand	Anodyne	SIGMAR1	21	47
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853712188	DC	On-Demand	Anodyne	SLC6A5	23	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853712188	DC	On-Demand	Anodyne	EPHX2	27	43
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853712193	DC	On-Demand	Anodyne	DRD4	17	46
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853712193	DC	On-Demand	Anodyne	SIGMAR1	21	47
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853712193	DC	On-Demand	Anodyne	SLC6A5	23	41
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853712193	DC	On-Demand	Anodyne	EPHX2	27	43
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853712195	DC	On-Demand	Anodyne	DRD4	17	46
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853712195	DC	On-Demand	Anodyne	SIGMAR1	21	47
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853712195	DC	On-Demand	Anodyne	SLC6A5	23	41
O=C(NC1CCN(CCO)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853712195	DC	On-Demand	Anodyne	EPHX2	27	43
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853712197	DC	On-Demand	Anodyne	DRD4	17	46
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853712197	DC	On-Demand	Anodyne	SIGMAR1	21	47
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853712197	DC	On-Demand	Anodyne	SLC6A5	23	41
O=C(NC1CCN(CCO)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853712197	DC	On-Demand	Anodyne	EPHX2	27	43
CCCCNC(=O)Cn1nc(Br)nc1C	ZINC000853712203	CD	On-Demand	Anodyne	ASAH1	56	33
CC(C)(C)OC(=O)N1CCC(COc2ccnnc2)CC1	ZINC000853712211	CF	On-Demand	Anodyne	GRIN2B	24	40
CC(C)(C)OC(=O)N1CCC(COc2ccnnc2)CC1	ZINC000853712211	CF	On-Demand	Anodyne	GPR119	84	52
CC(C)(C)OC(=O)N1CCC(CCOc2ccnnc2)CC1	ZINC000853712214	DF	On-Demand	Anodyne	GRIN2B	28	40
CC(C)(C)OC(=O)N1CCC(CCOc2ccnnc2)CC1	ZINC000853712214	DF	On-Demand	Anodyne	GPR119	77	51
CCCCCCCCOc1ccnnc1	ZINC000853712231	BG	On-Demand	Mild	PLA2G4B	90	40
CCCCCCCCOc1ccnnc1	ZINC000853712231	BG	On-Demand	Mild	CYP1A2	15	44
CCCCCCCCOc1ccnnc1	ZINC000853712231	BG	On-Demand	Mild	CYP2C19	18	44
Cc1ccc(NC(=O)Cn2nc(Br)nc2C)cc1C	ZINC000853712244	DF	On-Demand	Anodyne	ENPP1	56	34
Cc1ccc(NC(=O)Cn2nc(Br)nc2C)cc1C	ZINC000853712244	DF	On-Demand	Anodyne	IMDH_CRYPV	49	39
CC(C)(C)OC(=O)N1CCC(Cn2cnc3[nH]c4ccccc4c3c2=O)CC1	ZINC000853712312	GH	On-Demand	Anodyne	GPR119	44	42
CCONC(=O)CNc1nccc2cc(OC)c(OC)cc12	ZINC000853712332	DD	On-Demand	Anodyne	KDR	42	35
CCONC(=O)CNc1nccc2cc(OC)c(OC)cc12	ZINC000853712332	DD	On-Demand	Anodyne	PDGFRA	40	35
CCONC(=O)CNc1nccc2cc(OC)c(OC)cc12	ZINC000853712332	DD	On-Demand	Anodyne	ENPP1	68	33
CCONC(=O)CNc1nccc2cc(OC)c(OC)cc12	ZINC000853712332	DD	On-Demand	Anodyne	DRTS_TRYCR	44	32
Cc1ccc(NC(=O)Cn2nc(Br)nc2C)cc1Cl	ZINC000853712336	EF	On-Demand	Anodyne	IMDH_CRYPV	52	39
O=C(COc1ccnnc1)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000853712338	ED	On-Demand	Clean	STAT6	44	34
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccnnc2)C1	ZINC000853712340	CD	On-Demand	Anodyne	GPR119	51	44
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccnnc2)C1	ZINC000853712341	CD	On-Demand	Anodyne	GPR119	51	44
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712363	GD	On-Demand	Anodyne	HTR4	21	42
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712363	GD	On-Demand	Anodyne	ADRB3	16	42
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712363	GD	On-Demand	Anodyne	TACR2	62	42
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712363	GD	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712363	GD	On-Demand	Anodyne	TACR3	40	35
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712363	GD	On-Demand	Anodyne	EPHX2	21	44
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712364	GD	On-Demand	Anodyne	HTR4	21	42
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712364	GD	On-Demand	Anodyne	ADRB3	16	42
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712364	GD	On-Demand	Anodyne	TACR2	62	42
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712364	GD	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712364	GD	On-Demand	Anodyne	TACR3	40	35
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)NC1CCN(CCO)CC1	ZINC000853712364	GD	On-Demand	Anodyne	EPHX2	21	44
Cc1ccc(NC(=O)Cn2nc(Br)nc2C)cc1F	ZINC000853712367	EE	On-Demand	Anodyne	IMDH_CRYPV	47	35
COC(=O)c1cccc(NNC(=O)NC2CCN(CCO)CC2)c1C	ZINC000853712368	FC	On-Demand	Reactive	HTR4	32	43
COC(=O)c1cccc(NNC(=O)NC2CCN(CCO)CC2)c1C	ZINC000853712368	FC	On-Demand	Reactive	SLC6A5	24	40
CC(=O)Nc1cnn(Cc2nonc2C)c1	ZINC000853712371	BC	On-Demand	Anodyne	PANC	53	34
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	DRD2	18	40
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	DRD4	43	35
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	DRD3	24	40
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	HTR4	33	46
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	LTA4H	15	41
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	SIGMAR1	29	48
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	CCR3	28	41
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	MTNR1A	15	48
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	MTNR1B	16	48
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	SLC6A5	33	45
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	EPHX2	28	46
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	PDK1	41	34
COc1ccc(N2CC[C@H](NC(=O)NC3CCN(CCO)CC3)C2)cc1	ZINC000853712372	FD	On-Demand	Clean	MCHR1	28	43
CON(C)CCNC(=O)NCC1(Sc2ccccc2)CC1	ZINC000853712478	DE	On-Demand	Anodyne	KCNA3	40	34
O=C(N[C@@H]1[C@H]2C[C@H]1N(c1cnc(N3CCCC3=O)cn1)C2)OCc1ccccc1	ZINC000853712485	GE	On-Demand	Anodyne	CTSL	20	41
O=C(N[C@H]1[C@H]2C[C@H]1N(c1cnc(N3CCCC3=O)cn1)C2)OCc1ccccc1	ZINC000853712486	GE	On-Demand	Anodyne	CTSL	20	41
CCONC(=O)CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000853712496	DB	On-Demand	Bother	CA2	30	43
CCONC(=O)CNc1ccc(S(N)(=O)=O)c([N+](=O)[O-])c1	ZINC000853712496	DB	On-Demand	Bother	CA12	15	43
CON(C)CCNC(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000853712528	EC	On-Demand	Anodyne	DRD3	16	44
CON(C)CCNC(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000853712528	EC	On-Demand	Anodyne	FOLH1	22	43
COc1ccc(CCn2nc(Br)nc2C)cc1	ZINC000853712540	CF	On-Demand	Anodyne	KCNA5	17	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NC2CCN(CCO)CC2)C1	ZINC000853712595	FD	On-Demand	Anodyne	EPHX2	17	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NC2CCN(CCO)CC2)C1	ZINC000853712596	FD	On-Demand	Anodyne	EPHX2	17	48
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](COc2ccnnc2)CC1	ZINC000853712618	DG	On-Demand	Anodyne	GRIN2B	16	43
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](COc2ccnnc2)CC1	ZINC000853712618	DG	On-Demand	Anodyne	ACACB	21	44
CC(C)(C)OC(=O)N1CCc2ccc(COc3ccnnc3)cc2C1	ZINC000853712626	EG	On-Demand	Anodyne	GPR119	42	48
CC[C@@H](C)c1ccc(NC(=O)Cn2nc(Br)nc2C)cc1	ZINC000853712659	FH	On-Demand	Anodyne	SCN2A	18	45
COc1ccc(OCCCn2nc(Br)nc2C)cc1	ZINC000853712675	EF	On-Demand	Anodyne	HRH3	24	41
COC(=O)N(C)CCNC(=O)NC1CCN(CCO)CC1	ZINC000853712684	DB	On-Demand	Anodyne	HTR4	15	42
CC[C@@H](NC(=O)Cn1nc(Br)nc1C)c1ccc(Cl)cc1	ZINC000853712717	FG	On-Demand	Anodyne	UTS2	41	33
CC[C@H](NC(=O)Cn1nc(Br)nc1C)c1ccc(Cl)cc1	ZINC000853712718	FG	On-Demand	Anodyne	UTS2	41	33
O=C(NNc1ccc(Cl)cc1Br)NC1CCN(CCO)CC1	ZINC000853712734	GE	On-Demand	Reactive	HTR4	15	41
O=C(NNc1ccc(Cl)cc1Br)NC1CCN(CCO)CC1	ZINC000853712734	GE	On-Demand	Reactive	SIGMAR1	15	42
O=C(NNc1ccc(Cl)cc1Br)NC1CCN(CCO)CC1	ZINC000853712734	GE	On-Demand	Reactive	SLC6A5	23	42
Cn1ncnc1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853712744	DD	On-Demand	Anodyne	CTSK	23	40
Cn1ncnc1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853712744	DD	On-Demand	Anodyne	CTSL	29	40
Cn1ncnc1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853712744	DD	On-Demand	Anodyne	NAAA	46	36
Cn1ncnc1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853712746	DD	On-Demand	Anodyne	CTSK	23	40
Cn1ncnc1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853712746	DD	On-Demand	Anodyne	CTSL	29	40
Cn1ncnc1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853712746	DD	On-Demand	Anodyne	NAAA	46	36
CCCCCCn1cnc2[nH]c3ccccc3c2c1=O	ZINC000853712750	CG	On-Demand	Anodyne	CNR2	34	45
CCCCCCn1cnc2[nH]c3ccccc3c2c1=O	ZINC000853712750	CG	On-Demand	Anodyne	UTS2R	25	50
CCCCCCn1cnc2[nH]c3ccccc3c2c1=O	ZINC000853712750	CG	On-Demand	Anodyne	ASAH1	47	33
O=C(Cn1cnc2[nH]c3ccccc3c2c1=O)NC1CCCCCCC1	ZINC000853712755	FG	On-Demand	Anodyne	CNR2	21	40
O=C(Cn1cnc2[nH]c3ccccc3c2c1=O)NC1CCCCCCC1	ZINC000853712755	FG	On-Demand	Anodyne	GRIN2D	46	31
CN1CCCN(CC(=O)Nc2ccc(-c3ccccc3)cc2)S1(=O)=O	ZINC000853712789	FE	On-Demand	Anodyne	LTA4H	17	40
CN1CCCN(CC(=O)Nc2ccc(-c3ccccc3)cc2)S1(=O)=O	ZINC000853712789	FE	On-Demand	Anodyne	PRNP	45	44
CN1CCCN(CC(=O)Nc2ccc(-c3ccccc3)cc2)S1(=O)=O	ZINC000853712789	FE	On-Demand	Anodyne	SLC1A2	22	41
Cc1ccccc1CNC(=O)Cn1nc(Br)nc1C	ZINC000853712828	DD	On-Demand	Anodyne	P2RX7	30	45
CCONC(=O)CNc1nc2ccc(N)cc2s1	ZINC000853712894	CD	On-Demand	Anodyne	CA2	17	40
CCONC(=O)CNc1nc2ccc(N)cc2s1	ZINC000853712894	CD	On-Demand	Anodyne	CSNK1D	46	43
CCONC(=O)CNc1nc2ccc(N)cc2s1	ZINC000853712894	CD	On-Demand	Anodyne	PIK3CA	15	40
CCONC(=O)CNc1ncnc2ccc(C(C)C)cc12	ZINC000853712906	CE	On-Demand	Anodyne	CLK4	40	41
CCONC(=O)CNc1cc(C)nc(NCC(=O)NOCC)c1C#N	ZINC000853712943	FC	On-Demand	Mild	RPS27	52	33
C=C(Cl)Cn1cc(NC(C)=O)cn1	ZINC000853712995	AD	On-Demand	Mild	PANC	45	32
CC(=O)Nc1cnn(Cc2ccc(CO[Si](C)(C)C(C)(C)C)cc2)c1	ZINC000853713052	FI	On-Demand	Reactive	ITK	15	40
CC(=O)Nc1cnn(Cc2ccc(CO[Si](C)(C)C(C)(C)C)cc2)c1	ZINC000853713052	FI	On-Demand	Reactive	PANC	65	44
COc1ccc(N2CCN(C(=O)Cn3nc(Br)nc3C)CC2)cc1	ZINC000853713057	GD	On-Demand	Clean	CCR1	30	51
COc1ccc(N2CCN(C(=O)COc3ccnnc3)CC2)cc1	ZINC000853713068	ED	On-Demand	Clean	HTR1D	18	43
COc1ccc(N2CCN(C(=O)COc3ccnnc3)CC2)cc1	ZINC000853713068	ED	On-Demand	Clean	HTR1B	18	43
COc1ccc(N2CCN(C(=O)COc3ccnnc3)CC2)cc1	ZINC000853713068	ED	On-Demand	Clean	CCKAR	23	41
O=C(COc1ccnnc1)NC1CCCCCCC1	ZINC000853713098	CE	On-Demand	Anodyne	EPHX2	18	45
O=c1c2c(ncn1CC1CC(F)(F)C1)[nH]c1ccccc12	ZINC000853713100	CF	On-Demand	Anodyne	UTS2R	15	41
O=C(COc1ccnnc1)Nc1ccc(N2CCCCC2)cc1	ZINC000853713124	DE	On-Demand	Anodyne	MCHR1	18	43
O=C(NC1CCN(CCO)CC1)N[C@@H]1C=CCC1	ZINC000853713134	CC	On-Demand	Anodyne	SLC6A5	20	42
O=C(NC1CCN(CCO)CC1)N[C@H]1C=CCC1	ZINC000853713135	CC	On-Demand	Anodyne	SLC6A5	20	42
CC(C)(C)OC(=O)N1CC[C@H](CCOc2ccnnc2)C1	ZINC000853713151	CF	On-Demand	Anodyne	GPR119	65	46
CN1CCCN(CC(=O)Nc2ccc3ccccc3c2)S1(=O)=O	ZINC000853713152	ED	On-Demand	Anodyne	IMDH_CRYPV	35	43
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2ccnnc2)C1	ZINC000853713153	CF	On-Demand	Anodyne	GPR119	65	46
C#Cc1cccnc1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853713154	EF	On-Demand	Mild	CTSL	19	40
C#Cc1cccnc1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853713157	EF	On-Demand	Mild	CTSL	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(NC(C)=O)cn2)CC1	ZINC000853713170	EC	On-Demand	Anodyne	P2RY12	83	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(NC(C)=O)cn2)CC1	ZINC000853713172	EC	On-Demand	Anodyne	P2RY12	83	37
O=C(NCC[S@@](=O)CC(F)(F)F)NC1CCN(CCO)CC1	ZINC000853713175	EC	On-Demand	Anodyne	SLC6A5	20	43
O=C(NCC[S@](=O)CC(F)(F)F)NC1CCN(CCO)CC1	ZINC000853713180	EC	On-Demand	Anodyne	SLC6A5	20	43
COc1ccc(C)cc1NC(=O)Cn1nc(Br)nc1C	ZINC000853713181	EE	On-Demand	Anodyne	ENPP1	55	32
Cc1cc(CO)cc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)n1	ZINC000853713211	FE	On-Demand	Anodyne	KLK3	40	30
Cc1cc(CO)cc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)n1	ZINC000853713212	FE	On-Demand	Anodyne	KLK3	40	30
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713235	FD	On-Demand	Anodyne	DRD4	22	49
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713235	FD	On-Demand	Anodyne	HTR2A	15	49
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713235	FD	On-Demand	Anodyne	HTR4	44	34
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713235	FD	On-Demand	Anodyne	CHRM3	15	40
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713235	FD	On-Demand	Anodyne	SIGMAR1	18	49
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713235	FD	On-Demand	Anodyne	SLC6A5	24	40
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713236	FD	On-Demand	Anodyne	DRD4	22	49
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713236	FD	On-Demand	Anodyne	HTR2A	15	49
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713236	FD	On-Demand	Anodyne	HTR4	44	34
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713236	FD	On-Demand	Anodyne	CHRM3	15	40
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713236	FD	On-Demand	Anodyne	SIGMAR1	18	49
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(CCO)CC1	ZINC000853713236	FD	On-Demand	Anodyne	SLC6A5	24	40
Cn1ncc(C#N)c1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853713247	ED	On-Demand	Mild	CTSK	19	45
Cn1ncc(C#N)c1N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853713247	ED	On-Demand	Mild	CTSL	23	45
Cn1ncc(C#N)c1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853713248	ED	On-Demand	Mild	CTSK	19	45
Cn1ncc(C#N)c1N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853713248	ED	On-Demand	Mild	CTSL	23	45
CN(C)S(=O)(=O)c1ccccc1NCC[C@@]1(C)C[C@@]1(F)Cl	ZINC000853713263	EG	On-Demand	Anodyne	ICMT	41	35
CN(C)S(=O)(=O)c1ccccc1NCC[C@]1(C)C[C@@]1(F)Cl	ZINC000853713264	EG	On-Demand	Anodyne	ICMT	41	35
CN(C)S(=O)(=O)c1ccccc1NCC[C@@]1(C)C[C@]1(F)Cl	ZINC000853713265	EG	On-Demand	Anodyne	ICMT	41	35
CN(C)S(=O)(=O)c1ccccc1NCC[C@]1(C)C[C@]1(F)Cl	ZINC000853713266	EG	On-Demand	Anodyne	ICMT	41	35
CCCOc1cccc(CNC(=O)Cn2nc(Br)nc2C)c1	ZINC000853713370	FE	On-Demand	Anodyne	PDS	50	37
CC(=O)Nc1cccc(Cn2nc(Br)nc2C)c1	ZINC000853713428	DE	On-Demand	Anodyne	HTR1D	21	42
CC(C)(C)OC(=O)NCc1ccc(CNc2cnc(F)cn2)c(F)c1	ZINC000853713434	FG	On-Demand	Anodyne	TRPV1	15	40
CC(=O)c1ccnc(NCc2ccc(CNC(=O)OC(C)(C)C)cc2F)c1	ZINC000853713445	FI	On-Demand	Anodyne	BDKRB1	22	42
CCCCC[C@@H](C)NC(=O)COc1ccnnc1	ZINC000853713467	CD	On-Demand	Anodyne	PLA2G4B	61	33
CCCCC[C@@H](C)NC(=O)COc1ccnnc1	ZINC000853713467	CD	On-Demand	Anodyne	NOD1	48	31
O=C1C=CC=N/C1=C(/O)NCCNC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853713471	GC	On-Demand	Mild	CASR	46	36
O=C1C=CC=N/C1=C(\O)NCCNC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853713473	GC	On-Demand	Mild	CASR	46	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1CCN(CCO)CC1	ZINC000853713513	GC	On-Demand	Clean	SLC6A5	21	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1CCN(CCO)CC1	ZINC000853713513	GC	On-Demand	Clean	MCHR1	15	48
CC(=O)Nc1cnn(C[C@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853713515	DD	On-Demand	Anodyne	PANC	56	38
CC(=O)Nc1cnn(C[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)c1	ZINC000853713516	DD	On-Demand	Anodyne	PANC	56	38
CCOC(=O)c1nc(=N[C@H]2Cc3ccccc3N(C(=O)OC(C)(C)C)C2)cc[nH]1	ZINC000853713546	GF	On-Demand	Anodyne	TPP2	47	37
CCOC(=O)c1nc(=N[C@@H]2Cc3ccccc3N(C(=O)OC(C)(C)C)C2)cc[nH]1	ZINC000853713547	GF	On-Demand	Anodyne	TPP2	47	37
Cc1cccc(NC(=O)Cn2nc(Br)nc2C)c1	ZINC000853713554	DE	On-Demand	Anodyne	IMDH_CRYPV	46	36
Cc1cccc(NC(=O)Cn2nc(Br)nc2C)c1	ZINC000853713554	DE	On-Demand	Anodyne	KCNK3	60	40
Cc1cccc(NC(=O)Cn2nc(Br)nc2C)c1	ZINC000853713554	DE	On-Demand	Anodyne	KCNK9	45	40
CCOc1ccc(-n2c(C)cc(C(=O)COc3ccnnc3)c2C)cc1	ZINC000853713571	FH	On-Demand	Clean	CACNA2D1	77	40
CN1CCCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)S1(=O)=O	ZINC000853713628	FC	On-Demand	Anodyne	MTOR	55	38
CN1CCCN(CC(=O)Nc2ccc(N3CCOCC3)cc2)S1(=O)=O	ZINC000853713628	FC	On-Demand	Anodyne	STAT6	51	31
CN1CCCN(CCOc2ccccc2C(=O)OC(C)(C)C)S1(=O)=O	ZINC000853713633	FD	On-Demand	Anodyne	HCN1	53	35
Nc1ccc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)nc1[N+](=O)[O-]	ZINC000853713634	FE	On-Demand	Bother	CTSL	16	40
Nc1ccc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)nc1[N+](=O)[O-]	ZINC000853713635	FE	On-Demand	Bother	CTSL	16	40
CCCc1ccc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)nn1	ZINC000853713654	FF	On-Demand	Anodyne	CAPN2	41	36
CCCc1ccc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)nn1	ZINC000853713654	FF	On-Demand	Anodyne	NAAA	46	34
CCCc1ccc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)nn1	ZINC000853713655	FF	On-Demand	Anodyne	CAPN2	41	36
CCCc1ccc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)nn1	ZINC000853713655	FF	On-Demand	Anodyne	NAAA	46	34
N#Cc1cnnc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)c1	ZINC000853713663	ED	On-Demand	Mild	CTSK	16	44
N#Cc1cnnc(N2C[C@H]3C[C@H]2[C@@H]3NC(=O)OCc2ccccc2)c1	ZINC000853713663	ED	On-Demand	Mild	CTSL	23	44
N#Cc1cnnc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)c1	ZINC000853713666	ED	On-Demand	Mild	CTSK	16	44
N#Cc1cnnc(N2C[C@H]3C[C@H]2[C@H]3NC(=O)OCc2ccccc2)c1	ZINC000853713666	ED	On-Demand	Mild	CTSL	23	44
O=c1c2c(ncn1CCCCCCO)[nH]c1ccccc12	ZINC000853713683	CE	On-Demand	Anodyne	TK	17	45
O=c1c2c(ncn1CCC1OCCCO1)[nH]c1ccccc12	ZINC000853713695	CE	On-Demand	Anodyne	UTS2R	15	40
CCONC(=O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853713714	FD	On-Demand	Anodyne	PDPK1	18	47
CCONC(=O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853713714	FD	On-Demand	Anodyne	SYK	30	48
CCONC(=O)CNc1nc(Nc2cccc(OC)c2)c2nc[nH]c2n1	ZINC000853713714	FD	On-Demand	Anodyne	CDK1	16	46
CCONC(=O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853713750	DB	On-Demand	Anodyne	CA2	49	36
CCONC(=O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853713750	DB	On-Demand	Anodyne	CA7	40	35
CCONC(=O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853713750	DB	On-Demand	Anodyne	CA5B	53	32
CCONC(=O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853713750	DB	On-Demand	Anodyne	CA4	40	36
CCONC(=O)CNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853713750	DB	On-Demand	Anodyne	CA5A	56	32
COC(=O)C1CCN(C(=O)Cn2nc(Br)nc2C)CC1	ZINC000853713772	EC	On-Demand	Anodyne	PTR1	45	32
COc1ccccc1Cn1nc(Br)nc1C	ZINC000853713777	CE	On-Demand	Anodyne	NPBWR1	17	43
COC(=O)c1ccc(Oc2ccc(NC(=O)OC(C)C)cc2Cl)nn1	ZINC000853713811	FH	On-Demand	Anodyne	GRM4	18	42
CCCCN(CCCC)C(=O)Cn1nc(Br)nc1C	ZINC000853713859	EF	On-Demand	Anodyne	TSPO	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnnc2)CC1	ZINC000853713897	DC	On-Demand	Anodyne	P2RY12	97	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnnc2)CC1	ZINC000853713900	DC	On-Demand	Anodyne	P2RY12	97	38
O=C1C=CC=N/C1=C(/O)NCCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853713995	FD	On-Demand	Mild	EPHX2	16	42
Cc1cccc(C(C)C)c1NC(=O)Cn1nc(Br)nc1C	ZINC000853713996	FG	On-Demand	Anodyne	SOAT1	49	42
N#Cc1ccc(Br)c(NNC(=O)NC2CCN(CCO)CC2)c1	ZINC000853714022	GD	On-Demand	Reactive	SLC6A5	20	40
CCONC(=O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853714033	DB	On-Demand	Anodyne	CA2	47	36
CCONC(=O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853714033	DB	On-Demand	Anodyne	NCE103	54	33
CCONC(=O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853714033	DB	On-Demand	Anodyne	MTCA1	46	31
CCONC(=O)CNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853714033	DB	On-Demand	Anodyne	P96878_MYCTU	41	31
CSc1ccc(NC(=O)Cn2nc(Br)nc2C)cc1	ZINC000853714102	EF	On-Demand	Anodyne	IMDH_CRYPV	29	46
COc1cc2c(cc1OC)CN(C(=O)Cn1nc(Br)nc1C)CC2	ZINC000853714111	GD	On-Demand	Anodyne	CCR1	23	41
COc1cc2c(cc1OC)CN(C(=O)Cn1nc(Br)nc1C)CC2	ZINC000853714111	GD	On-Demand	Anodyne	ABCB1B	60	35
COc1cc2c(cc1OC)CN(C(=O)Cn1nc(Br)nc1C)CC2	ZINC000853714111	GD	On-Demand	Anodyne	ABCB1	21	52
CC(=O)Nc1cnn(Cc2oc(C)nc2C)c1	ZINC000853714129	BD	On-Demand	Anodyne	PANC	50	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3[nH]c4ccccc4c3c2=O)CC1	ZINC000853714142	GD	On-Demand	Anodyne	P2RY12	99	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3[nH]c4ccccc4c3c2=O)CC1	ZINC000853714143	GD	On-Demand	Anodyne	P2RY12	99	37
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc3[nH]c4ccccc4c3c2=O)C1	ZINC000853714159	GH	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc3[nH]c4ccccc4c3c2=O)C1	ZINC000853714160	GH	On-Demand	Anodyne	GPR119	41	39
CCCCC[C@@H](C)NC(=O)Cn1nc(Br)nc1C	ZINC000853714259	DE	On-Demand	Anodyne	NOD1	42	33
CCOc1ccc([C@@H](C)NC(=O)Cn2nc(Br)nc2C)cc1OC	ZINC000853714297	GF	On-Demand	Anodyne	ENPP1	51	32
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	PIK3CA	42	45
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	JAK2	18	48
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	MAPKAPK5	44	37
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	MTOR	76	45
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	EPHX2	22	43
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	PIK3CG	34	45
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	MCHR1	16	49
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	EPHB4	55	32
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	STAT6	75	39
O=C(COc1ccnnc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853714351	DD	On-Demand	Anodyne	DGAT1	17	40
CC(=O)Nc1cnn(Cc2cccc3c2CCN(C(=O)OC(C)(C)C)C3)c1	ZINC000853714352	FG	On-Demand	Anodyne	PANC	61	41
CC(C)(C)OC(=O)N1CCc2c(COc3ccnnc3)cccc2C1	ZINC000853714366	EG	On-Demand	Anodyne	GPR119	42	46
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CCO)CC1	ZINC000853714375	ED	On-Demand	Reactive	SIGMAR1	15	40
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CCO)CC1	ZINC000853714375	ED	On-Demand	Reactive	SLC6A5	20	41
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CCO)CC1	ZINC000853714375	ED	On-Demand	Reactive	EPHX2	21	43
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(CCO)CC1	ZINC000853714375	ED	On-Demand	Reactive	CXCR3	15	44
Cc1ccc(NC(=O)Cn2nc(Br)nc2C)cc1	ZINC000853714378	DE	On-Demand	Anodyne	IMDH_CRYPV	42	38
O=C(NCCN/C(O)=C1\N=CC=CC1=O)NCC1CCN(CC2CC2)CC1	ZINC000853714383	GC	On-Demand	Mild	CACNA1I	42	33
O=C(NCCN/C(O)=C1/N=CC=CC1=O)NCC1CCN(CC2CC2)CC1	ZINC000853714385	GC	On-Demand	Mild	CACNA1I	42	33
COC(=O)c1nccc(Oc2ccc(NC(=O)OC(C)C)cc2Cl)n1	ZINC000853714388	FH	On-Demand	Anodyne	GRM4	19	43
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC(S(C)(=O)=O)C2)C1	ZINC000853714517	EC	On-Demand	Anodyne	GPR119	41	40
COC(=O)c1ccc(CN(C(C)C)S(C)(=O)=O)c(F)c1	ZINC000853714531	DD	On-Demand	Anodyne	TRPV1	43	31
COC(=O)Cn1cc(CN(C(C)C)S(C)(=O)=O)nn1	ZINC000853714554	CB	On-Demand	Anodyne	MMP13	22	42
COC(=O)Cn1cc(CN(C(C)C)S(C)(=O)=O)nn1	ZINC000853714554	CB	On-Demand	Anodyne	MMP8	38	46
COC(=O)Cn1cc(CN(C(C)C)S(C)(=O)=O)nn1	ZINC000853714554	CB	On-Demand	Anodyne	MMP9	20	46
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)C1	ZINC000853714565	FE	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)C1	ZINC000853714566	FE	On-Demand	Anodyne	WNT3	41	35
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853714611	DF	On-Demand	Anodyne	GPR119	21	41
C#CCCN(CCOC)C(=O)NCCCNC(=O)c1ccc(F)cc1	ZINC000853714650	ED	On-Demand	Mild	DRD3	17	43
N#Cc1cccc(CN2CCC(Nc3cc(F)ncn3)CC2)c1	ZINC000853714658	DF	On-Demand	Mild	SIGMAR1	24	49
N#Cc1cccc(CN2CCC(Nc3cc(F)ncn3)CC2)c1	ZINC000853714658	DF	On-Demand	Mild	SSTR5	63	37
N#Cc1cccc(CN2CCC(Nc3cc(F)ncn3)CC2)c1	ZINC000853714658	DF	On-Demand	Mild	CCR3	31	44
N#Cc1cccc(CN2CCC(Nc3cc(F)ncn3)CC2)c1	ZINC000853714658	DF	On-Demand	Mild	MCHR1	24	41
C#CCCCOc1cccnc1N1CCC(Oc2ncc(C)cn2)CC1	ZINC000853714660	FG	On-Demand	Mild	DCK	50	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000853714692	GD	On-Demand	Mild	DRD4	41	32
N#Cc1cccc(CN2CCC(Nc3cnc(F)cn3)CC2)c1	ZINC000853714769	DF	On-Demand	Mild	DRD4	15	49
N#Cc1cccc(CN2CCC(Nc3cnc(F)cn3)CC2)c1	ZINC000853714769	DF	On-Demand	Mild	SIGMAR1	26	50
N#Cc1cccc(CN2CCC(Nc3cnc(F)cn3)CC2)c1	ZINC000853714769	DF	On-Demand	Mild	SSTR5	70	38
N#Cc1cccc(CN2CCC(Nc3cnc(F)cn3)CC2)c1	ZINC000853714769	DF	On-Demand	Mild	CCR3	26	44
N#Cc1cccc(CN2CCC(Nc3cnc(F)cn3)CC2)c1	ZINC000853714769	DF	On-Demand	Mild	MCHR1	32	42
CC(C)(C)OC(=O)N1CC[C@H](CCn2ncc3ncccc32)C1	ZINC000853714777	DG	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ncc3ncccc32)C1	ZINC000853714779	DG	On-Demand	Anodyne	GPR119	51	46
CC(C)(C)OC(=O)N1CC2(CCN(c3cnccn3)CC2)C1	ZINC000853714786	DE	On-Demand	Anodyne	GPR119	23	66
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	PIK3CA	42	43
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	PRNP	41	35
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	MAPKAPK5	41	35
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	MTOR	71	42
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	PIK3CG	27	42
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	PIK3CB	15	40
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	STAT6	78	38
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853714791	ED	On-Demand	Anodyne	IMDH_CRYPV	38	41
O=C(Cn1ncc2ncccc21)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000853714792	FD	On-Demand	Clean	STAT6	44	33
C[C@H](O)c1ccc(OCc2cc(F)ccc2OC(F)F)cc1	ZINC000853714865	DI	On-Demand	Anodyne	PDE4A	24	44
CCCc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853714867	EH	On-Demand	Anodyne	SIRT3	58	39
CCCc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853714867	EH	On-Demand	Anodyne	SIRT2	61	48
CCCc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853714867	EH	On-Demand	Anodyne	SIRT1	58	48
CCCc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853714867	EH	On-Demand	Anodyne	SCD1	38	44
CCCc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853714867	EH	On-Demand	Anodyne	SCD	20	44
CC(C)(C)OC(=O)NCCC1CCN(c2nccc3c(N)cccc23)CC1	ZINC000853714899	FH	On-Demand	Anodyne	ACACB	15	45
CC(C)(C)OC(=O)NCCC1CCN(c2nccc3c(N)cccc23)CC1	ZINC000853714899	FH	On-Demand	Anodyne	SIRT3	70	52
CC(C)(C)OC(=O)NCCC1CCN(c2nccc3c(N)cccc23)CC1	ZINC000853714899	FH	On-Demand	Anodyne	SIRT2	67	52
CC(C)(C)OC(=O)NCCC1CCN(c2nccc3c(N)cccc23)CC1	ZINC000853714899	FH	On-Demand	Anodyne	SIRT1	65	52
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCCN1CC	ZINC000853714905	CD	On-Demand	Mild	DRD2	33	41
C#CCCN(CCOC)C(=O)NC[C@H]1CCCCN1CC	ZINC000853714908	CD	On-Demand	Mild	DRD2	33	41
COC(=O)c1nccc(N2C[C@H]3[C@H](C2)C3(F)F)n1	ZINC000853714909	CC	On-Demand	Anodyne	SORD	30	41
Cn1nnc2c(NCCC3CCN(C(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853714915	FE	On-Demand	Anodyne	SIRT3	44	41
Cn1nnc2c(NCCC3CCN(C(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853714915	FE	On-Demand	Anodyne	SIRT2	41	41
Cn1nnc2c(NCCC3CCN(C(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853714915	FE	On-Demand	Anodyne	SIRT1	43	41
Cn1nnc2c(NCCC3CCN(C(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853714915	FE	On-Demand	Anodyne	GPR119	54	47
CN(CCN1CCCCC1)c1cc(Br)cnc1C#N	ZINC000853714921	DF	On-Demand	Mild	HNMT	17	44
COC(=O)c1nccc(N2C[C@@H]3[C@H](C2)C3(F)F)n1	ZINC000853714933	CC	On-Demand	Anodyne	SORD	30	41
COC(=O)c1nccc(N2C[C@@H]3[C@@H](C2)C3(F)F)n1	ZINC000853714936	CC	On-Demand	Anodyne	SORD	30	41
C#C[C@@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853714956	CG	On-Demand	Mild	PDE3A	48	44
C#C[C@@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853714956	CG	On-Demand	Mild	PDE3B	53	39
C#C[C@@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853714956	CG	On-Demand	Mild	PDE10A	18	44
O=C(NC[C@@H]1CCc2ccccc21)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853714957	DG	On-Demand	Anodyne	MTNR1B	17	45
C#C[C@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853714959	CG	On-Demand	Mild	PDE3A	48	44
C#C[C@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853714959	CG	On-Demand	Mild	PDE3B	53	39
C#C[C@H]1CCCN(c2nccc3cc(OC)c(OC)cc23)C1	ZINC000853714959	CG	On-Demand	Mild	PDE10A	18	44
O=C(NC[C@@H]1CCc2ccccc21)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853714961	DG	On-Demand	Anodyne	MTNR1B	17	45
O=C(NC[C@@H]1CCc2ccccc21)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853714964	DG	On-Demand	Anodyne	MTNR1B	17	45
O=C(NC[C@@H]1CCc2ccccc21)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853714967	DG	On-Demand	Anodyne	MTNR1B	17	45
COc1cc(N2CCC(Oc3ncc(C)cn3)CC2)c([N+](=O)[O-])cc1C	ZINC000853714969	FG	On-Demand	Bother	PDE3B	42	38
Cn1ncnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853715030	DD	On-Demand	Anodyne	SIRT3	71	53
Cn1ncnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853715030	DD	On-Demand	Anodyne	SIRT2	66	53
Cn1ncnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853715030	DD	On-Demand	Anodyne	SIRT1	62	53
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC2CC(CO)C2)C1	ZINC000853715034	DD	On-Demand	Anodyne	EPHX2	23	47
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@H]2C[C@H](O)C2)C1	ZINC000853715056	CC	On-Demand	Anodyne	EPHX2	24	49
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@H]2C[C@H](O)C2)C1	ZINC000853715056	CC	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCC(O)(C2CC2)C2CC2)C1	ZINC000853715085	FD	On-Demand	Anodyne	EPHX2	17	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(NC(C)=O)c(F)c2F)CC1	ZINC000853715097	GD	On-Demand	Anodyne	P2RY12	43	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(NC(C)=O)c(F)c2F)CC1	ZINC000853715099	GD	On-Demand	Anodyne	P2RY12	43	37
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715112	FE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715112	FE	On-Demand	Anodyne	CCR3	17	45
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715113	FE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715113	FE	On-Demand	Anodyne	CCR3	17	45
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715115	FE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715115	FE	On-Demand	Anodyne	CCR3	17	45
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715116	FE	On-Demand	Anodyne	BCHE	21	42
O=C(NCCCNC(=O)c1ccc(F)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715116	FE	On-Demand	Anodyne	CCR3	17	45
CC[C@@H](O)CNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853715122	DD	On-Demand	Anodyne	GPR119	26	42
O=C(NCCCNC(=O)N1CC[C@H](N2CCOC2=O)C1)c1cccc(F)c1	ZINC000853715138	GD	On-Demand	Anodyne	PLD2	45	36
O=C(NCCCNC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1cccc(F)c1	ZINC000853715142	GD	On-Demand	Anodyne	PLD2	45	36
CC(C)(C)OC(=O)N1CCC(CCNc2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1	ZINC000853715144	GG	On-Demand	Bother	GPR119	51	53
CC(C)(C)OC(=O)N1CCC(CCNc2cc(C#N)cnn2)CC1	ZINC000853715146	EF	On-Demand	Mild	GPR119	56	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc(Br)nc2C)CC1	ZINC000853715148	FD	On-Demand	Anodyne	P2RY12	44	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc(Br)nc2C)CC1	ZINC000853715151	FD	On-Demand	Anodyne	P2RY12	44	36
COCCN(CCF)C(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000853715152	ED	On-Demand	Anodyne	DRD4	43	33
C#Cc1cccnc1N1C[C@@H](C(=O)OC)[C@H](c2ccc(Cl)cc2)C1	ZINC000853715182	EG	On-Demand	Mild	SLC6A4	20	47
C#Cc1cccnc1N1C[C@@H](C(=O)OC)[C@H](c2ccc(Cl)cc2)C1	ZINC000853715182	EG	On-Demand	Mild	SLC6A3	35	47
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)C1	ZINC000853715195	FD	On-Demand	Anodyne	EPHX2	26	46
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)C1	ZINC000853715196	FD	On-Demand	Anodyne	EPHX2	26	46
COc1ccc(N2CCN(C(=O)COc3ccc4oc(O)nc4c3)CC2)cc1	ZINC000853715197	GE	On-Demand	Clean	HTR1D	19	44
COc1ccc(N2CCN(C(=O)COc3ccc4oc(O)nc4c3)CC2)cc1	ZINC000853715197	GE	On-Demand	Clean	HTR1B	19	44
COc1cccc(SCCOc2ccc([C@@H](C)O)cc2)c1	ZINC000853715244	DH	On-Demand	Anodyne	MTNR1A	17	50
COc1cccc(SCCOc2ccc([C@@H](C)O)cc2)c1	ZINC000853715244	DH	On-Demand	Anodyne	MTNR1B	19	50
COc1cccc(SCCOc2ccc([C@H](C)O)cc2)c1	ZINC000853715246	DH	On-Demand	Anodyne	MTNR1A	17	50
COc1cccc(SCCOc2ccc([C@H](C)O)cc2)c1	ZINC000853715246	DH	On-Demand	Anodyne	MTNR1B	19	50
Cn1ccnc1[C@H](NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C(C)(C)CO	ZINC000853715290	GD	On-Demand	Anodyne	GPR119	31	40
Cn1ccnc1[C@@H](NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C(C)(C)CO	ZINC000853715292	GD	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)NCCC1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1	ZINC000853715295	FF	On-Demand	Bother	SIRT3	53	45
CC(C)(C)OC(=O)NCCC1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1	ZINC000853715295	FF	On-Demand	Bother	SIRT2	56	45
CC(C)(C)OC(=O)NCCC1CCN(c2ccc(N)c([N+](=O)[O-])n2)CC1	ZINC000853715295	FF	On-Demand	Bother	SIRT1	54	45
COC(=O)Cc1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715304	GF	On-Demand	Anodyne	SIRT3	57	48
COC(=O)Cc1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715304	GF	On-Demand	Anodyne	SIRT2	60	48
COC(=O)Cc1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715304	GF	On-Demand	Anodyne	SIRT1	58	48
O=C(COc1ccc2oc(O)nc2c1)NC1CCCCCCC1	ZINC000853715307	DG	On-Demand	Anodyne	FAAH	23	41
O=C(COc1ccc2oc(O)nc2c1)NC1CCCCCCC1	ZINC000853715307	DG	On-Demand	Anodyne	PTGES	15	42
O=C(COc1ccc2oc(O)nc2c1)NC1CCCCCCC1	ZINC000853715307	DG	On-Demand	Anodyne	TNKS	62	32
COC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853715312	FE	On-Demand	Anodyne	ACACB	15	47
COC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853715312	FE	On-Demand	Anodyne	SIRT3	59	49
COC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853715312	FE	On-Demand	Anodyne	SIRT2	63	49
COC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853715312	FE	On-Demand	Anodyne	SIRT1	60	49
COC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853715312	FE	On-Demand	Anodyne	GPR119	20	43
CC(C)(C)OC(=O)NCCC1CCN(c2nc3ccc(N)cc3s2)CC1	ZINC000853715331	GI	On-Demand	Anodyne	ACACB	15	45
CC(C)(C)OC(=O)NCCC1CCN(c2nc3ccc(N)cc3s2)CC1	ZINC000853715331	GI	On-Demand	Anodyne	SIRT3	74	53
CC(C)(C)OC(=O)NCCC1CCN(c2nc3ccc(N)cc3s2)CC1	ZINC000853715331	GI	On-Demand	Anodyne	SIRT2	69	53
CC(C)(C)OC(=O)NCCC1CCN(c2nc3ccc(N)cc3s2)CC1	ZINC000853715331	GI	On-Demand	Anodyne	SIRT1	65	53
CCCCC[C@@H](C)NC(=O)COc1ccc2oc(O)nc2c1	ZINC000853715389	DF	On-Demand	Anodyne	PLA2G4B	44	33
C[C@@H](CCNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853715412	ED	On-Demand	Anodyne	CHRNA3	22	41
C[C@@H](CCNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853715412	ED	On-Demand	Anodyne	CHRNA4	18	41
C[C@@H](CCNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853715412	ED	On-Demand	Anodyne	EPHX2	17	40
C[C@@H](CCNC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853715412	ED	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@]2(C)CC2(C)C)C1	ZINC000853715430	DE	On-Demand	Anodyne	EPHX2	18	50
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@@]2(C)CC2(C)C)C1	ZINC000853715433	DE	On-Demand	Anodyne	EPHX2	18	50
Cc1ccc(NCCC2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000853715434	DG	On-Demand	Anodyne	SIRT3	47	38
Cc1ccc(NCCC2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000853715434	DG	On-Demand	Anodyne	SIRT2	47	38
Cc1ccc(NCCC2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000853715434	DG	On-Demand	Anodyne	SIRT1	47	38
Cc1ccc(NCCC2CCN(C(=O)OC(C)(C)C)CC2)nn1	ZINC000853715434	DG	On-Demand	Anodyne	GPR119	59	48
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([C@H](C)O)cc2)CC1	ZINC000853715435	FD	On-Demand	Anodyne	P2RY12	54	38
C#Cc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853715437	DG	On-Demand	Mild	SIGMAR1	18	48
C#Cc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853715437	DG	On-Demand	Mild	SSTR5	47	36
C#Cc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853715437	DG	On-Demand	Mild	MLNR	15	40
C#Cc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853715437	DG	On-Demand	Mild	MCHR1	17	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc([C@@H](C)O)cc2)CC1	ZINC000853715438	FD	On-Demand	Anodyne	P2RY12	54	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([C@H](C)O)cc2)CC1	ZINC000853715442	FD	On-Demand	Anodyne	P2RY12	54	38
COc1cccc(C2(NC(=O)N[C@@H]3CCN(C(=O)OC(C)(C)C)C3)CCC2)c1	ZINC000853715443	GG	On-Demand	Anodyne	NPBWR1	52	30
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc([C@@H](C)O)cc2)CC1	ZINC000853715445	FD	On-Demand	Anodyne	P2RY12	54	38
CCN1CCCC[C@@H]1CNC(=O)NCCN(C)OC	ZINC000853715497	CC	On-Demand	Anodyne	DRD2	34	44
CCN1CCCC[C@H]1CNC(=O)NCCN(C)OC	ZINC000853715499	CC	On-Demand	Anodyne	DRD2	34	44
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715506	FE	On-Demand	Anodyne	DRD4	16	44
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715506	FE	On-Demand	Anodyne	P2RX7	74	44
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715506	FE	On-Demand	Anodyne	CCR3	64	44
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715506	FE	On-Demand	Anodyne	UTS2R	19	40
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715506	FE	On-Demand	Anodyne	MCHR1	17	42
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715508	FE	On-Demand	Anodyne	DRD4	16	44
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715508	FE	On-Demand	Anodyne	P2RX7	74	44
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715508	FE	On-Demand	Anodyne	CCR3	64	44
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715508	FE	On-Demand	Anodyne	UTS2R	19	40
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000853715508	FE	On-Demand	Anodyne	MCHR1	17	42
CON(C)CCNC(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000853715515	EC	On-Demand	Anodyne	DRD4	43	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)N(C(C)C)S(C)(=O)=O)CC1	ZINC000853715541	EC	On-Demand	Anodyne	CHRNA3	16	40
COC(=O)[C@@H]1CN(c2cc(F)ncn2)C[C@H]1c1ccccc1	ZINC000853715566	DE	On-Demand	Anodyne	SLC6A3	35	41
C#Cc1cccnc1N1C[C@@H](C(=O)OC)[C@H](c2ccccc2)C1	ZINC000853715568	DE	On-Demand	Mild	SLC6A3	17	46
O=C1[C@@H]2CN(Cc3ccccc3)C[C@@H]2C(=O)N1Cc1csc(Cl)n1	ZINC000853715641	FE	On-Demand	Anodyne	DRD4	15	46
C[C@H](O)c1ccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)cc1	ZINC000853715659	GF	On-Demand	Anodyne	C3AR1	37	41
C[C@H](O)c1ccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)cc1	ZINC000853715659	GF	On-Demand	Anodyne	EPHX2	40	41
FC1(F)[C@@H]2CN(c3nc4ccccc4n4cccc34)C[C@H]21	ZINC000853715668	CG	On-Demand	Anodyne	HTR3A	26	44
FC1(F)[C@@H]2CN(c3nc4ccccc4n4cccc34)C[C@@H]21	ZINC000853715673	CG	On-Demand	Anodyne	HTR3A	26	44
FC1(F)[C@H]2CN(c3nc4ccccc4n4cccc34)C[C@@H]21	ZINC000853715674	CG	On-Demand	Anodyne	HTR3A	26	44
CCOC(=O)N1CCN(C(=O)[C@H](C)N(C(C)C)S(C)(=O)=O)CC1	ZINC000853715692	EC	On-Demand	Anodyne	CHRNA3	16	40
CC(=O)c1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715707	EG	On-Demand	Anodyne	ACACB	15	45
CC(=O)c1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715707	EG	On-Demand	Anodyne	CACNA1I	46	35
CC(=O)c1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715707	EG	On-Demand	Anodyne	SIRT3	60	50
CC(=O)c1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715707	EG	On-Demand	Anodyne	SIRT2	63	50
CC(=O)c1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715707	EG	On-Demand	Anodyne	SIRT1	61	50
CC(=O)c1ccnc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)c1	ZINC000853715707	EG	On-Demand	Anodyne	GPR119	27	41
C[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)C(C)(C)C	ZINC000853715719	DG	On-Demand	Anodyne	ABCC8	45	35
CC(C)(C)OC(=O)N1CCC(CCCn2ncc3ncccc32)CC1	ZINC000853715721	EH	On-Demand	Anodyne	GPR119	60	47
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1	ZINC000853715726	GF	On-Demand	Anodyne	DRD2	28	40
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@H](c2nnc(S)n2C2CC2)C1	ZINC000853715728	GF	On-Demand	Anodyne	DRD2	28	40
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@H](c2nnc(S)n2C2CC2)C1	ZINC000853715730	GF	On-Demand	Anodyne	DRD2	28	40
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1	ZINC000853715732	GF	On-Demand	Anodyne	DRD2	28	40
CC(C)(C)OC(=O)N1CC2(CCN(c3cc(F)ncn3)CC2)C1	ZINC000853715738	DE	On-Demand	Anodyne	GPR119	31	48
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C#N)cnn2)CC1	ZINC000853715756	EE	On-Demand	Mild	SIRT3	59	49
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C#N)cnn2)CC1	ZINC000853715756	EE	On-Demand	Mild	SIRT2	59	49
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C#N)cnn2)CC1	ZINC000853715756	EE	On-Demand	Mild	SIRT1	57	49
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C#N)cnn2)CC1	ZINC000853715756	EE	On-Demand	Mild	GPR119	19	41
COC(=O)c1ccc(Br)cc1CN(C(C)C)S(C)(=O)=O	ZINC000853715770	FE	On-Demand	Anodyne	BMP1	17	41
COC(=O)c1ccc(Br)cc1CN(C(C)C)S(C)(=O)=O	ZINC000853715770	FE	On-Demand	Anodyne	COLA	58	39
CCN1CCCC[C@H]1CNC(=O)NNc1cc(F)ccc1C	ZINC000853715772	DF	On-Demand	Reactive	DRD2	39	41
CCN1CCCC[C@@H]1CNC(=O)NNc1cc(F)ccc1C	ZINC000853715774	DF	On-Demand	Reactive	DRD2	39	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000853715777	EF	On-Demand	Mild	MTNR1B	15	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCc2ccccc21	ZINC000853715779	EF	On-Demand	Mild	MTNR1B	15	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@@H]2COc3cc(F)ccc3C2)C1	ZINC000853715782	GE	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@@H]2COc3cc(F)ccc3C2)C1	ZINC000853715782	GE	On-Demand	Anodyne	SFRP1	25	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@H]2COc3cc(F)ccc3C2)C1	ZINC000853715785	GE	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N[C@H]2COc3cc(F)ccc3C2)C1	ZINC000853715785	GE	On-Demand	Anodyne	SFRP1	25	41
CCCCC[C@@H](C)NC(=O)CN(C(C)C)S(C)(=O)=O	ZINC000853715796	CD	On-Demand	Anodyne	NOD1	67	35
CN(CCN1CCCCC1)c1cc(F)ncn1	ZINC000853715834	BD	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	DRD2	19	46
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	KCNH2	27	41
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	LTA4H	23	49
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	CCR3	19	42
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	ARG1	30	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853715843	GH	On-Demand	Anodyne	ARG2	30	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	DRD2	19	46
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	KCNH2	27	41
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	LTA4H	23	49
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	CCR3	19	42
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	ARG1	30	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853715844	GH	On-Demand	Anodyne	ARG2	30	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	DRD2	19	46
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	KCNH2	27	41
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	LTA4H	23	49
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	CCR3	19	42
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	ARG1	30	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853715846	GH	On-Demand	Anodyne	ARG2	30	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	DRD2	19	46
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	KCNH2	27	41
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	LTA4H	23	49
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	SIGMAR1	21	44
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	CCR3	19	42
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	ACHP_LYMST	16	43
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	ARG1	30	40
O=C(NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853715849	GH	On-Demand	Anodyne	ARG2	30	40
COC(=O)[C@@H]1CN(c2cc(F)ncn2)C[C@H]1c1ccc(Cl)cc1	ZINC000853715851	EF	On-Demand	Anodyne	SLC6A4	34	50
COC(=O)[C@@H]1CN(c2cc(F)ncn2)C[C@H]1c1ccc(Cl)cc1	ZINC000853715851	EF	On-Demand	Anodyne	SLC6A3	55	50
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3c(OC)cccc3c2=O)CC1	ZINC000853715866	GD	On-Demand	Anodyne	NR5A1	31	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3c(OC)cccc3c2=O)CC1	ZINC000853715867	GD	On-Demand	Anodyne	NR5A1	31	47
C#Cc1cccnc1N1CCC(Oc2ncc(C)cn2)CC1	ZINC000853715868	CE	On-Demand	Mild	DCK	54	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853715871	FG	On-Demand	Reactive	EPHX2	24	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853715871	FG	On-Demand	Reactive	GPR119	28	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853715871	FG	On-Demand	Reactive	SFRP1	53	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853715871	FG	On-Demand	Reactive	WNT3	42	35
COC[C@@H](NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(OC)c1	ZINC000853715899	GF	On-Demand	Anodyne	MTNR1A	15	43
COC[C@@H](NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(OC)c1	ZINC000853715899	GF	On-Demand	Anodyne	MTNR1B	19	43
COC[C@H](NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(OC)c1	ZINC000853715901	GF	On-Demand	Anodyne	MTNR1A	15	43
COC[C@H](NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc(OC)c1	ZINC000853715901	GF	On-Demand	Anodyne	MTNR1B	19	43
CC(C)(C)OC(=O)N1CCC(Cn2ncc3ncccc32)CC1	ZINC000853715921	DG	On-Demand	Anodyne	GRIN2B	21	40
CC(C)(C)OC(=O)N1CCC(Cn2ncc3ncccc32)CC1	ZINC000853715921	DG	On-Demand	Anodyne	GPR119	62	49
C#Cc1cccnc1N1CCN(CCOCCOC)CC1	ZINC000853715925	CC	On-Demand	Mild	HTR1A	56	39
C#Cc1cccnc1N1CCN(CCOCCOC)CC1	ZINC000853715925	CC	On-Demand	Mild	DRD2	50	42
C#Cc1cccnc1N1CCN(CCOCCOC)CC1	ZINC000853715925	CC	On-Demand	Mild	DRD4	40	46
C#Cc1cccnc1N1CCN(CCOCCOC)CC1	ZINC000853715925	CC	On-Demand	Mild	DRD3	46	38
O=C(NCCS(=O)(=O)CC(F)(F)F)NC[C@H]1CCc2ccccc21	ZINC000853715928	FD	On-Demand	Anodyne	NQO2	16	42
O=C(NCCS(=O)(=O)CC(F)(F)F)NC[C@H]1CCc2ccccc21	ZINC000853715928	FD	On-Demand	Anodyne	MTNR1B	16	41
O=C(NCCS(=O)(=O)CC(F)(F)F)NC[C@@H]1CCc2ccccc21	ZINC000853715929	FD	On-Demand	Anodyne	NQO2	16	42
O=C(NCCS(=O)(=O)CC(F)(F)F)NC[C@@H]1CCc2ccccc21	ZINC000853715929	FD	On-Demand	Anodyne	MTNR1B	16	41
Cc1cc(C(=O)CN(C(C)C)S(C)(=O)=O)c(C)n1Cc1ccccc1	ZINC000853715933	FG	On-Demand	Anodyne	PLA2G10	40	31
CON(C)CCNC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853715935	ED	On-Demand	Anodyne	DRD2	26	52
CON(C)CCNC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853715935	ED	On-Demand	Anodyne	DRD3	17	49
CON(C)CCNC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853715935	ED	On-Demand	Anodyne	SLC6A3	31	45
CON(C)CCNC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853715935	ED	On-Demand	Anodyne	KCNH2	27	40
CON(C)CCNC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853715935	ED	On-Demand	Anodyne	LTA4H	28	48
CON(C)CCNC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853715935	ED	On-Demand	Anodyne	SIGMAR1	20	49
CON(C)CCNC(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853715935	ED	On-Demand	Anodyne	CCR3	25	43
C#CCCN(CCOC)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000853715940	DE	On-Demand	Mild	MTNR1B	21	40
C#CCCN(CCOC)C(=O)NC[C@H]1CCc2ccccc21	ZINC000853715941	DE	On-Demand	Mild	MTNR1B	21	40
C[C@H](O)c1ccc(OCc2cccc(F)c2OC(F)F)cc1	ZINC000853715970	DI	On-Demand	Anodyne	GYS1	49	34
FC1(F)[C@H]2CN(c3nc(NCc4ccccc4)c4ccccc4n3)C[C@@H]21	ZINC000853715982	FH	On-Demand	Anodyne	HRH4	15	47
FC1(F)[C@@H]2CN(c3nc(NCc4ccccc4)c4ccccc4n3)C[C@H]21	ZINC000853715985	FH	On-Demand	Anodyne	HRH4	15	47
FC1(F)[C@@H]2CN(c3nc(NCc4ccccc4)c4ccccc4n3)C[C@@H]21	ZINC000853715986	FH	On-Demand	Anodyne	HRH4	15	47
C=C(Cl)CN1C(=O)[C@@H]2CN(Cc3ccccc3)C[C@@H]2C1=O	ZINC000853716001	DD	On-Demand	Mild	SIGMAR1	43	40
CC(C)(C)OC(=O)NCCC1CCN(c2nc(C#N)c(Cl)s2)CC1	ZINC000853716012	FH	On-Demand	Mild	SIRT3	53	46
CC(C)(C)OC(=O)NCCC1CCN(c2nc(C#N)c(Cl)s2)CC1	ZINC000853716012	FH	On-Demand	Mild	SIRT2	56	46
CC(C)(C)OC(=O)NCCC1CCN(c2nc(C#N)c(Cl)s2)CC1	ZINC000853716012	FH	On-Demand	Mild	SIRT1	54	46
C#C[C@@H]1CCCN(c2cc(CC(=O)OC)ccn2)C1	ZINC000853716025	CD	On-Demand	Mild	GPBAR1	17	42
C#C[C@H]1CCCN(c2cc(CC(=O)OC)ccn2)C1	ZINC000853716028	CD	On-Demand	Mild	GPBAR1	17	42
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853716034	FD	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853716036	FD	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853716037	FD	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853716038	FD	On-Demand	Anodyne	DRD2	31	41
Cn1nnc2c(N3CCC(CCNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853716044	FD	On-Demand	Anodyne	SIRT3	103	62
Cn1nnc2c(N3CCC(CCNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853716044	FD	On-Demand	Anodyne	SIRT2	86	62
Cn1nnc2c(N3CCC(CCNC(=O)OC(C)(C)C)CC3)ncnc21	ZINC000853716044	FD	On-Demand	Anodyne	SIRT1	77	62
CCOc1ccc([C@@H]2CCCN2C(=O)Cn2nc(Br)nc2C)cc1	ZINC000853716045	GG	On-Demand	Anodyne	CPT1A	102	38
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716075	FD	On-Demand	Anodyne	DRD4	15	41
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716075	FD	On-Demand	Anodyne	HRH2	21	41
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716075	FD	On-Demand	Anodyne	SLC6A1	40	33
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716075	FD	On-Demand	Anodyne	CCR3	34	40
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716076	FD	On-Demand	Anodyne	DRD4	15	41
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716076	FD	On-Demand	Anodyne	HRH2	21	41
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716076	FD	On-Demand	Anodyne	SLC6A1	40	33
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716076	FD	On-Demand	Anodyne	CCR3	34	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc3c(cc2=O)Cc2ccccc2-3)CC1	ZINC000853716082	GD	On-Demand	Anodyne	P2RY12	184	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc3c(cc2=O)Cc2ccccc2-3)CC1	ZINC000853716085	GD	On-Demand	Anodyne	P2RY12	184	40
CC(C)(C)OC(=O)NCCC1CCN(c2cnc(F)cn2)CC1	ZINC000853716088	DF	On-Demand	Anodyne	SIRT3	57	50
CC(C)(C)OC(=O)NCCC1CCN(c2cnc(F)cn2)CC1	ZINC000853716088	DF	On-Demand	Anodyne	SIRT2	60	50
CC(C)(C)OC(=O)NCCC1CCN(c2cnc(F)cn2)CC1	ZINC000853716088	DF	On-Demand	Anodyne	SIRT1	58	50
CC(C)(C)OC(=O)NCCC1CCN(c2cnc(F)cn2)CC1	ZINC000853716088	DF	On-Demand	Anodyne	GPR119	31	41
CCN1CCCC[C@H]1CNC(=O)NNc1cccc(C(=O)OC)c1C	ZINC000853716091	EE	On-Demand	Reactive	DRD2	37	42
CC(C)(C)OC(=O)NCCC1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1	ZINC000853716092	FF	On-Demand	Bother	SIRT3	57	48
CC(C)(C)OC(=O)NCCC1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1	ZINC000853716092	FF	On-Demand	Bother	SIRT2	60	48
CC(C)(C)OC(=O)NCCC1CCN(c2ccnc(O)c2[N+](=O)[O-])CC1	ZINC000853716092	FF	On-Demand	Bother	SIRT1	59	48
CCN1CCCC[C@@H]1CNC(=O)NNc1cccc(C(=O)OC)c1C	ZINC000853716093	EE	On-Demand	Reactive	DRD2	37	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853716105	GF	On-Demand	Anodyne	CHRM3	16	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853716105	GF	On-Demand	Anodyne	EPHX2	44	49
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853716105	GF	On-Demand	Anodyne	CCR8	28	43
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853716105	GF	On-Demand	Anodyne	GPR119	43	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853716105	GF	On-Demand	Anodyne	SFRP1	118	44
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853716105	GF	On-Demand	Anodyne	WNT3	81	39
O=C(COc1ccc2oc(O)nc2c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853716113	FE	On-Demand	Anodyne	ACOX1	47	37
O=C(COc1ccc2oc(O)nc2c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853716113	FE	On-Demand	Anodyne	MTOR	50	36
O=C(COc1ccc2oc(O)nc2c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853716113	FE	On-Demand	Anodyne	MCHR1	20	52
O=C(COc1ccc2oc(O)nc2c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853716113	FE	On-Demand	Anodyne	STAT6	57	37
CC(C)(C)OC(=O)N1CCC(CCNc2ccnc(O)c2[N+](=O)[O-])CC1	ZINC000853716129	FG	On-Demand	Bother	GPR119	57	45
CC(C)(C)OC(=O)N1CCC(CCNc2nc3ncccc3cc2C#N)CC1	ZINC000853716183	GH	On-Demand	Mild	GPR119	56	44
COC(=O)[C@@H]1CN(c2cc(Cl)nc3cc(C)nn23)C[C@H]1c1ccccc1	ZINC000853716195	FG	On-Demand	Anodyne	SLC6A3	15	43
Cn1ncc(C#N)c1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853716202	EE	On-Demand	Mild	SIRT3	54	47
Cn1ncc(C#N)c1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853716202	EE	On-Demand	Mild	SIRT2	57	47
Cn1ncc(C#N)c1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853716202	EE	On-Demand	Mild	SIRT1	55	47
C#Cc1cccnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853716215	EG	On-Demand	Mild	SIRT3	68	51
C#Cc1cccnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853716215	EG	On-Demand	Mild	SIRT2	66	51
C#Cc1cccnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853716215	EG	On-Demand	Mild	SIRT1	63	51
CCOC(=O)c1nccc(N2C[C@@H]3[C@@H](C2)C3(F)F)n1	ZINC000853716230	CD	On-Demand	Anodyne	SORD	41	45
CCOC(=O)c1nccc(N2C[C@@H]3[C@H](C2)C3(F)F)n1	ZINC000853716234	CD	On-Demand	Anodyne	SORD	41	45
COC(=O)[C@@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])C[C@H]1c1ccccc1	ZINC000853716272	GH	On-Demand	Bother	SLC6A3	26	43
COc1ccc(N2CCN(C(=O)Cn3ncc4ncccc43)CC2)cc1	ZINC000853716297	FD	On-Demand	Clean	CCKAR	24	45
COc1ccc(N2CCN(C(=O)Cn3ncc4ncccc43)CC2)cc1	ZINC000853716297	FD	On-Demand	Clean	CCR1	23	40
COC(=O)[C@@H]1CN(c2cnc(F)cn2)C[C@H]1c1ccc(Cl)cc1	ZINC000853716309	EF	On-Demand	Anodyne	SLC6A4	31	51
COC(=O)[C@@H]1CN(c2cnc(F)cn2)C[C@H]1c1ccc(Cl)cc1	ZINC000853716309	EF	On-Demand	Anodyne	SLC6A3	52	51
CCOc1cc(N2CCC3(CC2)CN(C(=O)OC(C)(C)C)C3)nc(C)n1	ZINC000853716330	FG	On-Demand	Anodyne	GPR119	23	46
CN(CCN1CCCCC1)c1cnc(F)cn1	ZINC000853716333	BD	On-Demand	Anodyne	HRH3	15	44
CN(CCN1CCCCC1)c1cnc(F)cn1	ZINC000853716333	BD	On-Demand	Anodyne	HNMT	28	44
O=C1CCC2=C(CCN(C(=O)NCCCNC(=O)c3cccc(F)c3)C2)N1	ZINC000853716334	FD	On-Demand	Anodyne	PLD2	57	38
CCOC(=O)c1nccc(N2C[C@H]3[C@H](C2)C3(F)F)n1	ZINC000853716346	CD	On-Demand	Anodyne	SORD	41	45
CC(C)(C)OC(=O)NCCC1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000853716349	GH	On-Demand	Bother	SIRT3	51	45
CC(C)(C)OC(=O)NCCC1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000853716349	GH	On-Demand	Bother	SIRT2	55	45
CC(C)(C)OC(=O)NCCC1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1	ZINC000853716349	GH	On-Demand	Bother	SIRT1	53	45
CC(C)(C)OC(=O)NCCC1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1	ZINC000853716357	GF	On-Demand	Bother	SIRT3	58	49
CC(C)(C)OC(=O)NCCC1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1	ZINC000853716357	GF	On-Demand	Bother	SIRT2	61	49
CC(C)(C)OC(=O)NCCC1CCN(c2ccc([N+](=O)[O-])c(C(N)=O)c2)CC1	ZINC000853716357	GF	On-Demand	Bother	SIRT1	60	49
CC(C)(C)OC(=O)N1CCCCN1c1cnccn1	ZINC000853716359	CE	On-Demand	Anodyne	GPR119	19	55
Cc1cc(CO)cc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716374	EG	On-Demand	Anodyne	ACACB	15	49
Cc1cc(CO)cc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716374	EG	On-Demand	Anodyne	SIRT3	55	48
Cc1cc(CO)cc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716374	EG	On-Demand	Anodyne	SIRT2	58	48
Cc1cc(CO)cc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716374	EG	On-Demand	Anodyne	SIRT1	56	48
CC(C)(C)OC(=O)NCCC1CCN(c2cc(O)nc3cccnc23)CC1	ZINC000853716377	FG	On-Demand	Anodyne	ACACB	16	46
CC(C)(C)OC(=O)NCCC1CCN(c2cc(O)nc3cccnc23)CC1	ZINC000853716377	FG	On-Demand	Anodyne	SIRT3	65	51
CC(C)(C)OC(=O)NCCC1CCN(c2cc(O)nc3cccnc23)CC1	ZINC000853716377	FG	On-Demand	Anodyne	SIRT2	65	51
CC(C)(C)OC(=O)NCCC1CCN(c2cc(O)nc3cccnc23)CC1	ZINC000853716377	FG	On-Demand	Anodyne	SIRT1	63	51
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853716391	ED	On-Demand	Anodyne	EPHX2	18	49
COC(=O)[C@@H]1CN(c2cnc(F)cn2)C[C@H]1c1ccccc1	ZINC000853716410	DE	On-Demand	Anodyne	SLC6A3	33	49
CCN1CCCC[C@H]1CNC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853716418	FD	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@@H]1CNC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853716421	FD	On-Demand	Anodyne	DRD2	31	41
Cc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853716430	DF	On-Demand	Anodyne	ACACB	15	46
Cc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853716430	DF	On-Demand	Anodyne	SIRT3	60	52
Cc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853716430	DF	On-Demand	Anodyne	SIRT2	64	52
Cc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853716430	DF	On-Demand	Anodyne	SIRT1	61	52
Cc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853716430	DF	On-Demand	Anodyne	SCD1	54	48
Cc1ccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)nn1	ZINC000853716430	DF	On-Demand	Anodyne	SCD	29	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)c(Cl)cc3ccccc32)CC1	ZINC000853716489	GF	On-Demand	Anodyne	HTR4	24	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)c(Cl)cc3ccccc32)CC1	ZINC000853716489	GF	On-Demand	Anodyne	P2RY12	141	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)c(Cl)cc3ccccc32)CC1	ZINC000853716493	GF	On-Demand	Anodyne	HTR4	24	45
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)c(Cl)cc3ccccc32)CC1	ZINC000853716493	GF	On-Demand	Anodyne	P2RY12	141	41
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716497	GF	On-Demand	Mild	SLC6A1	75	34
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(Cc2c(F)cccc2F)C1	ZINC000853716499	GF	On-Demand	Mild	SLC6A1	75	34
C[C@H]1CN(c2ccc(NC(=O)COc3ccc4oc(O)nc4c3)cc2)C[C@H](C)O1	ZINC000853716502	GG	On-Demand	Anodyne	MCHR1	18	41
C[C@H]1CN(c2ccc(NC(=O)COc3ccc4oc(O)nc4c3)cc2)C[C@@H](C)O1	ZINC000853716504	GG	On-Demand	Anodyne	MCHR1	18	41
CC(C)(C)OC(=O)NCCC1CCN(c2nc(C3CCOCC3)ns2)CC1	ZINC000853716506	GH	On-Demand	Anodyne	SIRT3	41	44
CC(C)(C)OC(=O)NCCC1CCN(c2nc(C3CCOCC3)ns2)CC1	ZINC000853716506	GH	On-Demand	Anodyne	SIRT2	38	44
CC(C)(C)OC(=O)NCCC1CCN(c2nc(C3CCOCC3)ns2)CC1	ZINC000853716506	GH	On-Demand	Anodyne	SIRT1	39	44
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@@H](c2nnc(S)n2CC)C1	ZINC000853716537	GE	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@H]1CNC(=O)N1CCC[C@H](c2nnc(S)n2CC)C1	ZINC000853716541	GE	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@@H](c2nnc(S)n2CC)C1	ZINC000853716544	GE	On-Demand	Anodyne	DRD2	31	41
CCN1CCCC[C@@H]1CNC(=O)N1CCC[C@H](c2nnc(S)n2CC)C1	ZINC000853716547	GE	On-Demand	Anodyne	DRD2	31	41
COCC1(NC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCCC1	ZINC000853716554	EE	On-Demand	Anodyne	EPHX2	19	51
C[C@@H](CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853716556	EE	On-Demand	Anodyne	EPHX2	27	42
C[C@@H](CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853716556	EE	On-Demand	Anodyne	CCR8	41	39
C[C@@H](CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853716556	EE	On-Demand	Anodyne	GPR119	50	47
C[C@@H](CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853716556	EE	On-Demand	Anodyne	SFRP1	53	39
C[C@@H](CNC(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853716556	EE	On-Demand	Anodyne	WNT3	42	34
CC(C)(C)OC(=O)NCCC1CCN(c2nc3ncccc3cc2C#N)CC1	ZINC000853716585	GH	On-Demand	Mild	SIRT3	62	49
CC(C)(C)OC(=O)NCCC1CCN(c2nc3ncccc3cc2C#N)CC1	ZINC000853716585	GH	On-Demand	Mild	SIRT2	64	49
CC(C)(C)OC(=O)NCCC1CCN(c2nc3ncccc3cc2C#N)CC1	ZINC000853716585	GH	On-Demand	Mild	SIRT1	61	40
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCC2CCC(O)CC2)C1	ZINC000853716586	ED	On-Demand	Anodyne	EPHX2	16	44
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853716591	GD	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853716592	GD	On-Demand	Anodyne	GPR119	32	42
O=C(COc1ccc2oc(O)nc2c1)Nc1ccc(N2CCCCC2)cc1	ZINC000853716604	FH	On-Demand	Anodyne	MCHR1	22	46
CC[C@@](C)(NC(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C1CC1	ZINC000853716614	EF	On-Demand	Anodyne	EPHX2	16	44
C#C[C@H]1CCCN(c2ccnc(C(=O)OC)n2)C1	ZINC000853716638	BD	On-Demand	Mild	SORD	15	40
C#C[C@@H]1CCCN(c2ccnc(C(=O)OC)n2)C1	ZINC000853716640	BD	On-Demand	Mild	SORD	15	40
N#Cc1cccc(CN2CCC(Nc3cc(Br)cnc3C#N)CC2)c1	ZINC000853716641	GH	On-Demand	Mild	SIGMAR1	18	48
N#Cc1cccc(CN2CCC(Nc3cc(Br)cnc3C#N)CC2)c1	ZINC000853716641	GH	On-Demand	Mild	SSTR5	52	36
N#Cc1cccc(CN2CCC(Nc3cc(Br)cnc3C#N)CC2)c1	ZINC000853716641	GH	On-Demand	Mild	CCR3	17	43
N#Cc1cccc(CN2CCC(Nc3cc(Br)cnc3C#N)CC2)c1	ZINC000853716641	GH	On-Demand	Mild	MCHR1	15	41
COCCN(CCF)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000853716653	CE	On-Demand	Anodyne	NQO2	18	41
COCCN(CCF)C(=O)NC[C@@H]1CCc2ccccc21	ZINC000853716653	CE	On-Demand	Anodyne	MTNR1B	23	42
COCCN(CCF)C(=O)NC[C@H]1CCc2ccccc21	ZINC000853716654	CE	On-Demand	Anodyne	NQO2	18	41
COCCN(CCF)C(=O)NC[C@H]1CCc2ccccc21	ZINC000853716654	CE	On-Demand	Anodyne	MTNR1B	23	42
C#CCCN(CCOC)C(=O)NCCCNC(=O)c1cccc(F)c1	ZINC000853716666	ED	On-Demand	Mild	DRD4	42	32
C#CCCN(CCOC)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853716668	FF	On-Demand	Mild	DRD2	23	47
C#CCCN(CCOC)C(=O)NC1C[C@@H]2CC[C@H](C1)N2Cc1ccccc1	ZINC000853716668	FF	On-Demand	Mild	DRD3	16	45
CC(C)(C)OC(=O)N1CCC(CCNc2nc(C3CCOCC3)ns2)CC1	ZINC000853716684	GH	On-Demand	Anodyne	GPR119	32	44
CON(C)CCNC(=O)NC[C@H]1CCc2ccccc21	ZINC000853716723	CD	On-Demand	Anodyne	NQO2	20	42
CON(C)CCNC(=O)NC[C@H]1CCc2ccccc21	ZINC000853716723	CD	On-Demand	Anodyne	MTNR1A	28	45
CON(C)CCNC(=O)NC[C@H]1CCc2ccccc21	ZINC000853716723	CD	On-Demand	Anodyne	MTNR1B	30	45
CON(C)CCNC(=O)NC[C@@H]1CCc2ccccc21	ZINC000853716724	CD	On-Demand	Anodyne	NQO2	20	42
CON(C)CCNC(=O)NC[C@@H]1CCc2ccccc21	ZINC000853716724	CD	On-Demand	Anodyne	MTNR1A	28	45
CON(C)CCNC(=O)NC[C@@H]1CCc2ccccc21	ZINC000853716724	CD	On-Demand	Anodyne	MTNR1B	30	45
CCOC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716737	GF	On-Demand	Anodyne	ACACB	15	46
CCOC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716737	GF	On-Demand	Anodyne	SIRT3	60	43
CCOC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716737	GF	On-Demand	Anodyne	SIRT2	64	49
CCOC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716737	GF	On-Demand	Anodyne	SIRT1	61	49
CCOC(=O)c1nccc(N2CCC(CCNC(=O)OC(C)(C)C)CC2)n1	ZINC000853716737	GF	On-Demand	Anodyne	GPR119	20	41
C=CCOc1ccc(/C=C/C(=O)OCC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1OC	ZINC000853716758	JD	On-Demand	Mild	PDGFRB	62	42
C=CCOc1ccc(/C=C\C(=O)OCC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1OC	ZINC000853716761	JD	On-Demand	Mild	PDGFRB	62	42
CN1C[C@H](CNC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853716764	EC	On-Demand	Anodyne	EPHX2	17	40
CN1C[C@@H](CNC(=O)N[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853716765	EC	On-Demand	Anodyne	EPHX2	17	40
CC(C)(C)OC(=O)NCCC1CCN(c2cc(CO)c(F)cn2)CC1	ZINC000853716784	FF	On-Demand	Anodyne	ACACB	15	47
CC(C)(C)OC(=O)NCCC1CCN(c2cc(CO)c(F)cn2)CC1	ZINC000853716784	FF	On-Demand	Anodyne	SIRT3	60	49
CC(C)(C)OC(=O)NCCC1CCN(c2cc(CO)c(F)cn2)CC1	ZINC000853716784	FF	On-Demand	Anodyne	SIRT2	60	49
CC(C)(C)OC(=O)NCCC1CCN(c2cc(CO)c(F)cn2)CC1	ZINC000853716784	FF	On-Demand	Anodyne	SIRT1	58	49
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NCC2(O)CCC(F)(F)CC2)C1	ZINC000853716791	GE	On-Demand	Anodyne	GPR119	34	40
CCN1CCCC[C@H]1CNC(=O)NNc1ccc(C)c(F)c1	ZINC000853716795	DF	On-Demand	Reactive	DRD2	33	41
CCN1CCCC[C@@H]1CNC(=O)NNc1ccc(C)c(F)c1	ZINC000853716797	DF	On-Demand	Reactive	DRD2	33	41
O=C(COc1ccc2oc(O)nc2c1)Nc1ccc(N2CCCC2)cc1	ZINC000853716801	FG	On-Demand	Anodyne	MCHR1	24	46
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	DRD4	22	54
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	LTA4H	22	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	SIGMAR1	24	49
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	SSTR5	44	36
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	CCR3	19	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	SLC6A5	29	40
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	MCHR1	38	47
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853716811	GG	On-Demand	Anodyne	CCR8	17	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	DRD4	22	54
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	LTA4H	22	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	SIGMAR1	24	49
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	SSTR5	44	36
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	CCR3	19	41
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	SLC6A5	29	40
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	MCHR1	38	47
Cc1ccccc1CN1CCC(NC(=O)COc2ccc([C@H](C)O)cc2)CC1	ZINC000853716813	GG	On-Demand	Anodyne	CCR8	17	41
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853716854	GD	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@H](NC(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853716856	GD	On-Demand	Anodyne	CACNA1I	41	32
CCN1CCCC[C@@H]1CNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853716908	DE	On-Demand	Anodyne	DRD2	34	42
CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853716910	DE	On-Demand	Anodyne	DRD2	34	42
CCN1CCCC[C@@H]1CNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853716911	DE	On-Demand	Anodyne	DRD2	34	42
CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853716912	DE	On-Demand	Anodyne	DRD2	34	42
CC(C)(C)OC(=O)N1CCC(CCn2ncc3ncccc32)CC1	ZINC000853716927	EG	On-Demand	Anodyne	GRIN2B	21	40
CC(C)(C)OC(=O)N1CCC(CCn2ncc3ncccc32)CC1	ZINC000853716927	EG	On-Demand	Anodyne	GPR119	61	51
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCCCC2)cc1	ZINC000853716941	EG	On-Demand	Anodyne	PRNP	42	36
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCCCC2)cc1	ZINC000853716941	EG	On-Demand	Anodyne	IMDH_CRYPV	38	40
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCCC2)cc1	ZINC000853716942	DF	On-Demand	Anodyne	PRNP	42	36
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCCC2)cc1	ZINC000853716942	DF	On-Demand	Anodyne	STAT6	46	31
O=C(Cn1ncc2ncccc21)Nc1ccc(N2CCCC2)cc1	ZINC000853716942	DF	On-Demand	Anodyne	IMDH_CRYPV	38	40
CCOC(=O)c1nccc(N2CCC3(CC2)CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853716967	GE	On-Demand	Anodyne	GPR119	24	44
CCOC(=O)c1nc(=NCCC2CCN(C(=O)OC(C)(C)C)CC2)cc[nH]1	ZINC000853716971	GF	On-Demand	Anodyne	GPR119	41	41
COC(=O)c1nccc(N2CCC3(CC2)CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853716979	FE	On-Demand	Anodyne	GPR119	19	46
CC(C)(C)OC(=O)N1CCC(CCNc2cnc(F)cn2)CC1	ZINC000853716993	DG	On-Demand	Anodyne	GPR119	69	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncc3ncccc32)CC1	ZINC000853717001	ED	On-Demand	Anodyne	P2RY12	68	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncc3ncccc32)CC1	ZINC000853717002	ED	On-Demand	Anodyne	P2RY12	68	37
C#CCCCOc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853717020	FH	On-Demand	Mild	SIGMAR1	15	46
C#CCCCOc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853717020	FH	On-Demand	Mild	SSTR5	65	38
C#CCCCOc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853717020	FH	On-Demand	Mild	CCR3	16	42
C#CCCCOc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853717020	FH	On-Demand	Mild	MCHR1	15	43
C#CCCCOc1cccnc1NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000853717020	FH	On-Demand	Mild	EHMT2	48	35
N#Cc1cccc(CN2CCC(Nc3ncnc(F)c3Br)CC2)c1	ZINC000853717024	GG	On-Demand	Mild	SIGMAR1	23	48
N#Cc1cccc(CN2CCC(Nc3ncnc(F)c3Br)CC2)c1	ZINC000853717024	GG	On-Demand	Mild	SSTR5	61	37
N#Cc1cccc(CN2CCC(Nc3ncnc(F)c3Br)CC2)c1	ZINC000853717024	GG	On-Demand	Mild	CCR3	20	43
N#Cc1cccc(CN2CCC(Nc3ncnc(F)c3Br)CC2)c1	ZINC000853717024	GG	On-Demand	Mild	SCN5A	48	35
N#Cc1cccc(CN2CCC(Nc3ncnc(F)c3Br)CC2)c1	ZINC000853717024	GG	On-Demand	Mild	MCHR1	23	44
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2ncc3ncccc32)CC1	ZINC000853717101	EH	On-Demand	Anodyne	ACACB	16	43
O=C(NCCCNC(=O)N1CCC(N2CCOC2=O)CC1)c1cccc(F)c1	ZINC000853717103	GD	On-Demand	Anodyne	PLD1	41	37
O=C(NCCCNC(=O)N1CCC(N2CCOC2=O)CC1)c1cccc(F)c1	ZINC000853717103	GD	On-Demand	Anodyne	PLD2	48	37
CC(C)(C)OC(=O)NCCC1CCN(c2cnc(N3CCCC3=O)cn2)CC1	ZINC000853717108	GF	On-Demand	Anodyne	SIRT3	54	47
CC(C)(C)OC(=O)NCCC1CCN(c2cnc(N3CCCC3=O)cn2)CC1	ZINC000853717108	GF	On-Demand	Anodyne	SIRT2	57	47
CC(C)(C)OC(=O)NCCC1CCN(c2cnc(N3CCCC3=O)cn2)CC1	ZINC000853717108	GF	On-Demand	Anodyne	SIRT1	55	47
CC(C)(C)OC(=O)N1CCC(CCNc2cnccn2)CC1	ZINC000853717112	DF	On-Demand	Anodyne	GRIN2B	19	54
CC(C)(C)OC(=O)N1CCC(CCNc2cnccn2)CC1	ZINC000853717112	DF	On-Demand	Anodyne	GPR119	63	57
CC(C)(C)OC(=O)NCCC1CCN(c2cc(F)ncn2)CC1	ZINC000853717124	DF	On-Demand	Anodyne	SIRT3	75	56
CC(C)(C)OC(=O)NCCC1CCN(c2cc(F)ncn2)CC1	ZINC000853717124	DF	On-Demand	Anodyne	SIRT2	70	56
CC(C)(C)OC(=O)NCCC1CCN(c2cc(F)ncn2)CC1	ZINC000853717124	DF	On-Demand	Anodyne	SIRT1	66	56
CC(C)(C)OC(=O)NCCC1CCN(c2cc(F)ncn2)CC1	ZINC000853717124	DF	On-Demand	Anodyne	GPR119	28	44
CC(C)(C)OC(=O)N1CC2(CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853717128	EE	On-Demand	Mild	GPR119	19	44
CC(C)(C)OC(=O)N1CCC(CCNc2cc(F)ncn2)CC1	ZINC000853717138	DG	On-Demand	Anodyne	SIRT3	56	41
CC(C)(C)OC(=O)N1CCC(CCNc2cc(F)ncn2)CC1	ZINC000853717138	DG	On-Demand	Anodyne	SIRT2	56	41
CC(C)(C)OC(=O)N1CCC(CCNc2cc(F)ncn2)CC1	ZINC000853717138	DG	On-Demand	Anodyne	SIRT1	53	41
CC(C)(C)OC(=O)N1CCC(CCNc2cc(F)ncn2)CC1	ZINC000853717138	DG	On-Demand	Anodyne	GPR119	75	52
C#Cc1cccnc1N(C)CCN1CCCCC1	ZINC000853717145	BD	On-Demand	Mild	HRH3	21	52
C#Cc1cccnc1N(C)CCN1CCCCC1	ZINC000853717145	BD	On-Demand	Mild	HNMT	37	52
CCNc1nccnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853717195	EG	On-Demand	Anodyne	SIRT3	70	54
CCNc1nccnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853717195	EG	On-Demand	Anodyne	SIRT2	67	54
CCNc1nccnc1N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853717195	EG	On-Demand	Anodyne	SIRT1	64	54
COc1cccc(Nc2nc(N3C[C@H]4[C@H](C3)C4(F)F)nc3[nH]cnc23)c1	ZINC000853717199	FF	On-Demand	Anodyne	GALR2	30	42
COc1cccc(Nc2nc(N3C[C@@H]4[C@H](C3)C4(F)F)nc3[nH]cnc23)c1	ZINC000853717200	FF	On-Demand	Anodyne	GALR2	30	42
COc1cccc(Nc2nc(N3C[C@@H]4[C@@H](C3)C4(F)F)nc3[nH]cnc23)c1	ZINC000853717201	FF	On-Demand	Anodyne	GALR2	30	42
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853717202	FH	On-Demand	Anodyne	ACACB	15	44
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853717202	FH	On-Demand	Anodyne	CACNA1I	41	31
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853717202	FH	On-Demand	Anodyne	SIRT3	75	56
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853717202	FH	On-Demand	Anodyne	SIRT2	70	56
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853717202	FH	On-Demand	Anodyne	SIRT1	66	56
CC(C)(C)OC(=O)NCCC1CCN(c2cc(C(C)(C)C)ncn2)CC1	ZINC000853717202	FH	On-Demand	Anodyne	GPR119	25	44
C[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717248	EG	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717248	EG	On-Demand	Anodyne	GRIN2B	42	41
C[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717248	EG	On-Demand	Anodyne	SIGMAR1	15	42
C[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717248	EG	On-Demand	Anodyne	CHEK2	19	45
C[C@H](O)c1ccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717248	EG	On-Demand	Anodyne	SLC18A3	15	44
C[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717250	EG	On-Demand	Anodyne	SLC6A3	17	40
C[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717250	EG	On-Demand	Anodyne	GRIN2B	42	41
C[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717250	EG	On-Demand	Anodyne	SIGMAR1	15	42
C[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717250	EG	On-Demand	Anodyne	CHEK2	19	45
C[C@H](O)c1ccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)cc1	ZINC000853717250	EG	On-Demand	Anodyne	SLC18A3	15	44
COC(=O)C1(COc2ccc([C@H](C)O)cc2)CC1	ZINC000853717306	CE	On-Demand	Anodyne	CYP26A1	16	40
COC(=O)C1(COc2ccc([C@@H](C)O)cc2)CC1	ZINC000853717307	CE	On-Demand	Anodyne	CYP26A1	16	40
CC(C)c1ccc2ncnc(N3C[C@@H]4[C@H](C3)C4(F)F)c2c1	ZINC000853717325	CG	On-Demand	Anodyne	PDE3A	42	42
CC(C)c1ccc2ncnc(N3C[C@@H]4[C@H](C3)C4(F)F)c2c1	ZINC000853717325	CG	On-Demand	Anodyne	PDE3B	45	42
CC(C)c1ccc2ncnc(N3C[C@@H]4[C@@H](C3)C4(F)F)c2c1	ZINC000853717326	CG	On-Demand	Anodyne	PDE3A	42	42
CC(C)c1ccc2ncnc(N3C[C@@H]4[C@@H](C3)C4(F)F)c2c1	ZINC000853717326	CG	On-Demand	Anodyne	PDE3B	45	42
CC(C)c1ccc2ncnc(N3C[C@H]4[C@H](C3)C4(F)F)c2c1	ZINC000853717327	CG	On-Demand	Anodyne	PDE3A	42	42
CC(C)c1ccc2ncnc(N3C[C@H]4[C@H](C3)C4(F)F)c2c1	ZINC000853717327	CG	On-Demand	Anodyne	PDE3B	45	42
COc1cccc(Nc2nc(N3CCC[C@]4(C3)CC4(F)F)nc3[nH]cnc23)c1	ZINC000853717328	GH	On-Demand	Anodyne	GALR2	47	44
COc1cccc(Nc2nc(N3CCC[C@@]4(C3)CC4(F)F)nc3[nH]cnc23)c1	ZINC000853717329	GH	On-Demand	Anodyne	GALR2	47	44
COc1ccc(N2CCN(C(=O)Cn3cc(CCO)cnc3=O)CC2)cc1	ZINC000853717361	FC	On-Demand	Clean	PLA2G7	26	45
CC(C)c1ccc2ncnc(NC[C@H]3CCCN(C(=O)C(F)(F)F)C3)c2c1	ZINC000853717377	GH	On-Demand	Anodyne	CLK4	19	40
CC(C)c1ccc2ncnc(NC[C@@H]3CCCN(C(=O)C(F)(F)F)C3)c2c1	ZINC000853717378	GH	On-Demand	Anodyne	CLK4	19	40
CC(C)c1cccc(C(C)C)c1NC(=O)Cn1ccc(=O)c2cnc(Cl)cc21	ZINC000853717384	GJ	On-Demand	Anodyne	SOAT1	58	40
CC(C)(C)OC(=O)N1CCC(CCn2cc(CCO)cnc2=O)CC1	ZINC000853717428	FD	On-Demand	Anodyne	GPR119	53	43
Fc1ncnc(N[C@@H](C[C@@H]2CCCO2)C(F)(F)F)c1Br	ZINC000853717438	FG	On-Demand	Anodyne	TNK2	40	34
Fc1ncnc(N[C@H](C[C@@H]2CCCO2)C(F)(F)F)c1Br	ZINC000853717439	FG	On-Demand	Anodyne	TNK2	40	34
Fc1ncnc(N[C@H](C[C@H]2CCCO2)C(F)(F)F)c1Br	ZINC000853717440	FG	On-Demand	Anodyne	TNK2	40	34
Fc1ncnc(N[C@@H](C[C@H]2CCCO2)C(F)(F)F)c1Br	ZINC000853717441	FG	On-Demand	Anodyne	TNK2	40	34
CC(C)(C)OC(=O)N1CCC(COc2ccc3oc(O)nc3c2)CC1	ZINC000853717452	EH	On-Demand	Anodyne	GPR119	60	45
COc1ccc(Cn2cc(CCO)cnc2=O)cc1	ZINC000853717457	CC	On-Demand	Anodyne	PROKR1	67	38
COc1ccc(Cn2cc(CCO)cnc2=O)cc1	ZINC000853717457	CC	On-Demand	Anodyne	NPBWR1	42	38
O=S(=O)(c1ccccc1)N1CCC(Nc2cc(F)ncn2)CC1	ZINC000853717482	ED	On-Demand	Anodyne	EPHX2	16	45
O=S(=O)(c1ccccc1)N1CCC(Nc2cc(F)ncn2)CC1	ZINC000853717482	ED	On-Demand	Anodyne	TGM2	60	37
O=S(=O)(c1ccccc1)N1CCC(Nc2cc(F)ncn2)CC1	ZINC000853717482	ED	On-Demand	Anodyne	F13A1	46	36
O=S(=O)(c1ccccc1)N1CCC(Nc2cc(F)ncn2)CC1	ZINC000853717482	ED	On-Demand	Anodyne	SFRP1	42	44
CC(C)(C)OC(=O)N1CCC(CCCn2cc(CCO)cnc2=O)CC1	ZINC000853717510	FE	On-Demand	Anodyne	GPR119	50	42
CC(C)(C)OC(=O)N1CCC(Cn2cc(CCO)cnc2=O)CC1	ZINC000853717517	ED	On-Demand	Anodyne	GPR119	49	43
COc1cc(NC[C@H]2CCCN(C(=O)C(F)(F)F)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000853717544	GG	On-Demand	Bother	HTR4	22	40
COc1cc(NC[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c(Cl)cc1[N+](=O)[O-]	ZINC000853717545	GG	On-Demand	Bother	HTR4	22	40
CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(CCO)cnc3=O)c2C)cc1	ZINC000853717552	GE	On-Demand	Clean	CACNA2D1	51	36
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)N1CCC(Cc2ccccc2)CC1	ZINC000853717574	GH	On-Demand	Anodyne	GRIN2B	81	42
C#CCNC(=O)[C@H](C)OC(=O)/C=C\c1ccc(OCC=C)c(OC)c1	ZINC000853717583	ED	On-Demand	Mild	APP	18	40
C#CCNC(=O)[C@@H](C)OC(=O)/C=C\c1ccc(OCC=C)c(OC)c1	ZINC000853717584	ED	On-Demand	Mild	APP	18	40
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)N[C@H]1CCCc2ccccc21	ZINC000853717605	FG	On-Demand	Anodyne	BDKRB1	49	38
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)N[C@@H]1CCCc2ccccc21	ZINC000853717606	FG	On-Demand	Anodyne	BDKRB1	49	38
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC1CCCCCCC1	ZINC000853717619	EG	On-Demand	Anodyne	CNR1	20	45
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC1CCCCCCC1	ZINC000853717619	EG	On-Demand	Anodyne	EPHX2	16	43
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC1CCCCCC1	ZINC000853717629	EF	On-Demand	Anodyne	CNR1	20	45
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC1CCCCCC1	ZINC000853717629	EF	On-Demand	Anodyne	EPHX2	16	43
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853717635	GF	On-Demand	Anodyne	MAPKAPK5	41	35
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853717635	GF	On-Demand	Anodyne	MTOR	43	37
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853717635	GF	On-Demand	Anodyne	PIK3CB	19	43
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853717635	GF	On-Demand	Anodyne	STAT6	66	35
CC(C)(C)OC(=O)N1CCC(CCOc2ccc3oc(O)nc3c2)CC1	ZINC000853717754	FH	On-Demand	Anodyne	GPR119	55	51
O=c1ncc(CCO)cn1Cc1ccc(Cl)nc1	ZINC000853717759	CC	On-Demand	Anodyne	Q8WSF8_APLCA	42	38
O=c1ncc(CCO)cn1Cc1ccc(Cl)nc1	ZINC000853717759	CC	On-Demand	Anodyne	NACHRBETA2	55	44
CC(C)(C)OC(=O)N1CC[C@H](CCOc2ccc3oc(O)nc3c2)C1	ZINC000853717765	EH	On-Demand	Anodyne	GPR119	47	47
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2ccc3oc(O)nc3c2)C1	ZINC000853717766	EH	On-Demand	Anodyne	GPR119	47	47
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC12CC3CC(CC(C3)C1)C2	ZINC000853717790	FG	On-Demand	Anodyne	CNR2	32	42
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC12CC3CC(CC(C3)C1)C2	ZINC000853717790	FG	On-Demand	Anodyne	EPHX2	53	38
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC1CCCCC1	ZINC000853717806	DE	On-Demand	Anodyne	CNR1	20	45
O=C(Cn1ccc(=O)c2cnc(Cl)cc21)NC1CCCCC1	ZINC000853717806	DE	On-Demand	Anodyne	EPHX2	16	43
C=CCOc1ccc(/C=C\C(=O)O[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1OC	ZINC000853717832	JI	On-Demand	Mild	VIPR1	27	42
C=CCOc1ccc(/C=C\C(=O)O[C@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1OC	ZINC000853717833	JI	On-Demand	Mild	VIPR1	27	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3oc(O)nc3c2)CC1	ZINC000853717883	FD	On-Demand	Anodyne	P2RY12	83	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3oc(O)nc3c2)CC1	ZINC000853717884	FD	On-Demand	Anodyne	P2RY12	83	38
C[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)C1CCC(F)(F)CC1	ZINC000853717907	FI	On-Demand	Anodyne	ABCC8	44	33
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc(CCO)cnc2=O)C1	ZINC000853717912	ED	On-Demand	Anodyne	GPR119	42	39
CC(C)(C)OC(=O)N1CC[C@H](CCn2cc(CCO)cnc2=O)C1	ZINC000853717913	ED	On-Demand	Anodyne	GPR119	42	39
O=c1ncc(CCO)cn1CCOc1cccc(F)c1	ZINC000853717925	CC	On-Demand	Anodyne	UPP1	50	34
O=S(=O)(c1ccccc1)N1CCC(Nc2cnc(F)cn2)CC1	ZINC000853717993	ED	On-Demand	Anodyne	TGM2	44	36
O=S(=O)(c1ccccc1)N1CCC(Nc2cnc(F)cn2)CC1	ZINC000853717993	ED	On-Demand	Anodyne	SFRP1	30	42
C[C@@H]1CCCCN1C(=O)Cn1ccc(=O)c2cnc(Cl)cc21	ZINC000853718007	DE	On-Demand	Anodyne	CPT1A	42	35
C[C@H]1CCCCN1C(=O)Cn1ccc(=O)c2cnc(Cl)cc21	ZINC000853718008	DE	On-Demand	Anodyne	CPT1A	42	35
Nc1ncn(CC(=O)NC2CCCCCCC2)c(=O)c1Cl	ZINC000853718070	DD	On-Demand	Anodyne	CNR1	18	46
Cc1ncn(CCC2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853718072	CF	On-Demand	Anodyne	GPR119	59	50
COC(=O)c1ccc(Br)cc1Cn1cnc(C)n1	ZINC000853718073	DE	On-Demand	Anodyne	MT-CYB	48	32
COc1ccc(N2CCN(C(=O)Cn3cnc(C)n3)CC2)cc1	ZINC000853718084	DC	On-Demand	Clean	CCR1	28	45
Cc1ncn(CCCC2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853718097	DG	On-Demand	Anodyne	GPR119	58	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C)nn2)CC1	ZINC000853718101	CC	On-Demand	Anodyne	P2RY12	45	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C)nn2)CC1	ZINC000853718102	CC	On-Demand	Anodyne	P2RY12	45	37
Cc1ncn(CC(=O)NC2CCCCCCC2)n1	ZINC000853718116	CD	On-Demand	Anodyne	CNR1	18	45
Cc1ncn(CC(=O)NC2CCCCCCC2)n1	ZINC000853718116	CD	On-Demand	Anodyne	EPHX2	24	40
O=C(NCc1ccc(Br)cc1F)N[C@H]1C[C@H](O)C1	ZINC000853718163	DD	On-Demand	Anodyne	AKR1B1	20	41
CCCCCNC(=O)Cn1ccc(=O)c2cnc(Cl)cc21	ZINC000853718170	DE	On-Demand	Anodyne	ASAH1	74	37
COC(=O)Cc1ccccc1CNc1nc(C(F)(F)F)ccc1C(=O)OC	ZINC000853718174	GG	On-Demand	Anodyne	TRPV1	51	33
O=c1ccn(CCN2CCCCC2)c2cc(Cl)ncc12	ZINC000853718177	CF	On-Demand	Anodyne	HNMT	68	35
O=C(NCc1ccc(Br)cc1F)N1CC[C@@H](O)C(F)(F)C1	ZINC000853718198	FE	On-Demand	Anodyne	EPHX2	15	42
O=C(NCc1ccc(Br)cc1F)N1CC[C@H](O)C(F)(F)C1	ZINC000853718199	FE	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)OC(=O)NC[C@H](NC(=O)NCc1ncccn1)C1CCCCC1	ZINC000853718231	GF	On-Demand	Anodyne	REN	54	40
CC(C)(C)OC(=O)NC[C@H](NC(=O)NCc1ncccn1)C1CCCCC1	ZINC000853718231	GF	On-Demand	Anodyne	CTSE	15	41
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NCc1ncccn1)C1CCCCC1	ZINC000853718232	GF	On-Demand	Anodyne	REN	54	40
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NCc1ncccn1)C1CCCCC1	ZINC000853718232	GF	On-Demand	Anodyne	CTSE	15	41
CC(C)(C)OC(=O)N1CCC(Cn2ccc(=O)c3cnc(Cl)cc32)CC1	ZINC000853718233	GH	On-Demand	Anodyne	GPR119	53	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(OCc3ccccc3)n2)CC1	ZINC000853718236	GE	On-Demand	Anodyne	P2RY12	133	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(OCc3ccccc3)n2)CC1	ZINC000853718237	GE	On-Demand	Anodyne	P2RY12	133	45
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718239	FE	On-Demand	Anodyne	AKR1B1	19	41
O=C(NCc1ccc(Br)cc1F)NC1CC(CO)C1	ZINC000853718269	EE	On-Demand	Anodyne	AKR1B1	19	42
O=C(c1cccc(Cn2ccc(=O)c3cnc(Cl)cc32)c1)N1CCCCC1	ZINC000853718270	GH	On-Demand	Anodyne	PARP1	15	42
O=C(c1cccc(Cn2ccc(=O)c3cnc(Cl)cc32)c1)N1CCCCC1	ZINC000853718270	GH	On-Demand	Anodyne	HPGD	35	40
COCC1(NC(=O)NCc2ccc(Br)cc2F)CCCC1	ZINC000853718278	FG	On-Demand	Anodyne	AKR1B1	20	41
COCC1(NC(=O)NCc2ccc(Br)cc2F)CCCC1	ZINC000853718278	FG	On-Demand	Anodyne	P2RX7	19	48
C[C@H]1CCc2ccccc2N1C(=O)Cn1ccc(=O)c2cnc(Cl)cc21	ZINC000853718281	FG	On-Demand	Anodyne	DRD4	25	42
C[C@@H]1CN(CCNC(=O)NCc2ccc(Br)cc2F)[C@H](C)CO1	ZINC000853718285	GE	On-Demand	Anodyne	P2RX7	26	43
CN1C[C@@H](CNC(=O)NCc2ccc(Br)cc2F)CC1=O	ZINC000853718288	FD	On-Demand	Anodyne	P2RX7	52	50
CN1C[C@H](CNC(=O)NCc2ccc(Br)cc2F)CC1=O	ZINC000853718289	FD	On-Demand	Anodyne	P2RX7	52	50
CN(Cc1cn(C)nn1)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCCC1	ZINC000853718291	GE	On-Demand	Anodyne	REN	40	34
CN(Cc1cn(C)nn1)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCCC1	ZINC000853718293	GE	On-Demand	Anodyne	REN	40	34
O=c1ccn(Cc2ccc(CN3CCCCC3)cc2)c2cc(Cl)ncc12	ZINC000853718298	FI	On-Demand	Anodyne	HRH3	20	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(I)cc1	ZINC000853718305	JG	On-Demand	Mild	STAT6	46	32
C#CCCCn1cnc(N)c(Cl)c1=O	ZINC000853718307	BC	On-Demand	Mild	HSP90B1	46	36
CCCCCCCCn1cc(C)nn1	ZINC000853718347	AF	On-Demand	Mild	GBA	15	49
CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc(C)n3)c2C)cc1	ZINC000853718352	EG	On-Demand	Clean	CACNA2D1	84	42
CCOc1ccc(-n2c(C)cc(C(=O)Cn3cnc(C)n3)c2C)cc1	ZINC000853718352	EG	On-Demand	Clean	CACNA2D2	50	33
C[C@@H](ON=Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853718391	HH	On-Demand	Mild	ITGAL	41	32
C[C@@H](ON=Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853718391	HH	On-Demand	Mild	EPHX2	16	43
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(Oc2ccccc2)cc1	ZINC000853718401	II	On-Demand	Mild	LTA4H	43	40
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(Oc2ccccc2)cc1	ZINC000853718401	II	On-Demand	Mild	STAT6	54	37
CCCOc1cccc(CNC(=O)Cn2ccc(=O)c3cnc(Cl)cc32)c1	ZINC000853718419	GG	On-Demand	Anodyne	UPP1	42	37
CCCOc1cccc(CNC(=O)Cn2ccc(=O)c3cnc(Cl)cc32)c1	ZINC000853718419	GG	On-Demand	Anodyne	PDS	61	37
CCCCCCCCCn1cnc(C)n1	ZINC000853718449	BG	On-Demand	Mild	ADA	29	45
Cc1ncn(CC2CCN(C(=O)OC(C)(C)C)CC2)n1	ZINC000853718460	CE	On-Demand	Anodyne	GPR119	59	48
CC(C)(C)OC(=O)N1CCC(CCn2cnc(N)c(Cl)c2=O)CC1	ZINC000853718465	FF	On-Demand	Anodyne	GPR119	48	44
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(N2CCCCC2)cc1	ZINC000853718467	HH	On-Demand	Mild	STAT6	46	32
Cc1nn(C)c2c(=O)n(Cc3cnc(Cl)s3)ncc12	ZINC000853718481	CD	On-Demand	Anodyne	PKM	48	39
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	ESR1	86	39
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	ACHE	16	43
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	HRH2	32	47
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	KCNH2	17	41
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	ESR2	61	38
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	LTA4H	75	52
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	HRH3	72	52
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	PSMB2	47	50
CON(C)CCNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000853718483	FD	On-Demand	Anodyne	PSMB1	50	50
O=C(CON=Cc1ccc(N2CCOCC2)cc1)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1	ZINC000853718489	JI	On-Demand	Mild	GRIN2D	55	31
O=C(CON=Cc1ccc(N2CCOCC2)cc1)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1	ZINC000853718493	JI	On-Demand	Mild	GRIN2D	55	31
O=C(CON=Cc1ccc(N2CCOCC2)cc1)N[C@@H]1CCCc2ccccc21	ZINC000853718495	GG	On-Demand	Mild	PLM1_PLAFA	40	35
O=C(CON=Cc1ccc(N2CCOCC2)cc1)N[C@H]1CCCc2ccccc21	ZINC000853718497	GG	On-Demand	Mild	PLM1_PLAFA	40	35
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718498	FG	On-Demand	Anodyne	P2RX7	24	51
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718498	FG	On-Demand	Anodyne	CCR5	18	45
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718500	FG	On-Demand	Anodyne	P2RX7	24	51
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718500	FG	On-Demand	Anodyne	CCR5	18	45
O=C(NCc1ccc(Br)cc1F)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853718507	GG	On-Demand	Anodyne	AKR1B1	19	40
O=C(NCc1ccc(Br)cc1F)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853718507	GG	On-Demand	Anodyne	CPT1A	66	36
O=C(NCc1ccc(Br)cc1F)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853718508	GG	On-Demand	Anodyne	AKR1B1	19	40
O=C(NCc1ccc(Br)cc1F)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853718508	GG	On-Demand	Anodyne	CPT1A	66	36
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CON=Cc2ccc(N3CCOCC3)cc2)cc1	ZINC000853718510	JI	On-Demand	Mild	GRIN2D	68	31
CN1CCN(C)[C@H](CNC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853718521	FD	On-Demand	Reactive	LCK	28	42
CN1CCN(C)[C@H](CNC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853718521	FD	On-Demand	Reactive	CSNK1D	39	43
CN1CCN(C)[C@@H](CNC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853718524	FD	On-Demand	Reactive	LCK	28	42
CN1CCN(C)[C@@H](CNC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853718524	FD	On-Demand	Reactive	CSNK1D	39	43
Cc1ccc(OCCn2cnc(C)n2)cc1	ZINC000853718539	BD	On-Demand	Anodyne	HRH3	15	46
Cc1nn(C)c2c(=O)n(Cc3cc(Cl)ccc3OCC#N)ncc12	ZINC000853718542	EE	On-Demand	Mild	PTGER1	37	41
Cc1nn(C)c2c(=O)n(Cc3cc(Cl)ccc3OCC#N)ncc12	ZINC000853718542	EE	On-Demand	Mild	PKM	44	40
Cc1nn(C)c2c(=O)n(Cc3cc(Cl)ccc3OCC#N)ncc12	ZINC000853718542	EE	On-Demand	Mild	Q9M629_MAIZE	17	40
C=Cc1ccccc1O[C@@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853718547	EE	On-Demand	Anodyne	P2RY12	82	41
C=Cc1ccccc1O[C@H](C)C(=O)N1CCN(C(=O)OCC)CC1	ZINC000853718550	EE	On-Demand	Anodyne	P2RY12	82	41
O=c1ccn(CCCCOc2cccc(C(F)(F)F)c2)c2cc(Cl)ncc12	ZINC000853718574	GJ	On-Demand	Anodyne	GALR3	62	35
O=c1ccn(CCCCOc2cccc(C(F)(F)F)c2)c2cc(Cl)ncc12	ZINC000853718574	GJ	On-Demand	Anodyne	PDS	45	39
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	ESR1	107	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	HRH2	33	43
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	KCNH2	16	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	ESR2	70	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	LTA4H	74	51
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	HRH3	69	46
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	PSMB2	45	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853718576	GG	On-Demand	Anodyne	PSMB1	49	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	ESR1	107	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	HRH2	33	43
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	KCNH2	16	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	ESR2	70	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	LTA4H	74	51
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	HRH3	69	46
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	PSMB2	45	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853718580	GG	On-Demand	Anodyne	PSMB1	49	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	ESR1	107	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	HRH2	33	43
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	KCNH2	16	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	ESR2	70	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	LTA4H	74	51
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	HRH3	69	46
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	PSMB2	45	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853718584	GG	On-Demand	Anodyne	PSMB1	49	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	ESR1	107	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	HRH2	33	43
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	KCNH2	16	40
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	ESR2	70	41
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	LTA4H	74	51
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	HRH3	69	46
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	PSMB2	45	44
O=C(NCc1ccc(OCCN2CCCC2)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853718588	GG	On-Demand	Anodyne	PSMB1	49	44
CCOc1ccc(-n2c(C)cc(C(=O)Cn3cc(CO)nn3)c2C)cc1	ZINC000853718599	FE	On-Demand	Clean	CACNA2D1	75	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2-n2cncn2)CC1	ZINC000853718602	FD	On-Demand	Anodyne	P2RY12	109	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2-n2cncn2)CC1	ZINC000853718603	FD	On-Demand	Anodyne	P2RY12	109	39
CO[C@]1(CO)CCCN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718626	GE	On-Demand	Anodyne	EPHX2	16	46
CON(C)CCNC(=O)NCC1CCN(Cc2nc(C)c(C)o2)CC1	ZINC000853718628	FD	On-Demand	Anodyne	CACNA1I	59	37
CCCCCCCCCn1cc(C)nn1	ZINC000853718641	BG	On-Demand	Mild	GBA	15	49
Cc1nn(C)c2c(=O)n(CC(=O)NC3CCCCCCC3)ncc12	ZINC000853718691	ED	On-Demand	Anodyne	CNR2	17	41
O=c1ccn(CCCN2CCCCC2)c2cc(Cl)ncc12	ZINC000853718695	DF	On-Demand	Anodyne	SIGMAR1	20	41
O=c1ccn(CCCN2CCCCC2)c2cc(Cl)ncc12	ZINC000853718695	DF	On-Demand	Anodyne	HNMT	76	36
Cc1nn(C)c2c(=O)n(CCOc3cccc(F)c3)ncc12	ZINC000853718708	DD	On-Demand	Anodyne	PKM	46	36
COC(=O)Cc1ccccc1CNc1cc(OC)c(C)cc1[N+](=O)[O-]	ZINC000853718718	EG	On-Demand	Bother	COLA	64	35
CS(=O)(=O)C1CN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718744	FD	On-Demand	Anodyne	AKR1B1	19	41
CS(=O)(=O)C1CN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718744	FD	On-Demand	Anodyne	TRPV1	54	33
CS(=O)(=O)C1CN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853718744	FD	On-Demand	Anodyne	P2RX7	23	48
Cc1nn(C)c2c(=O)n(CCCC3CCN(C(=O)OC(C)(C)C)CC3)ncc12	ZINC000853718786	GF	On-Demand	Anodyne	GPR119	42	42
Cc1nn(C)c2c(=O)n(Cc3ccc(CC(C)C)cc3)ncc12	ZINC000853718801	DF	On-Demand	Anodyne	PKM	47	44
CC(C)(C)OC(=O)N1CCC(Cn2cnc(N)c(Cl)c2=O)CC1	ZINC000853718824	EE	On-Demand	Anodyne	GPR119	47	43
COc1ccc(N2CCN(C(=O)Cn3ncc4c(C)nn(C)c4c3=O)CC2)cc1	ZINC000853718855	GC	On-Demand	Clean	CCR1	26	44
COc1ccc(N2CCN(C(=O)Cn3ncc4c(C)nn(C)c4c3=O)CC2)cc1	ZINC000853718855	GC	On-Demand	Clean	NPBWR1	54	38
Cc1ncn(CC(=O)c2cc(C)n(Cc3ccccc3)c2C)n1	ZINC000853718876	DF	On-Demand	Anodyne	PLA2G2A	45	35
C#C[C@@H](NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1	ZINC000853718882	GD	On-Demand	Mild	TACR2	40	37
C#C[C@@H](NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1	ZINC000853718884	GD	On-Demand	Mild	TACR2	40	37
C#C[C@H](NC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1	ZINC000853718887	GD	On-Demand	Mild	TACR2	40	37
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853718888	HG	On-Demand	Mild	CTSS	18	45
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853718888	HG	On-Demand	Mild	EPHX2	58	47
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853718888	HG	On-Demand	Mild	MCHR1	18	48
O=C(COC(=O)CSCc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853718889	HH	On-Demand	Anodyne	KCNQ2	19	40
O=C(COC(=O)CSCc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853718889	HH	On-Demand	Anodyne	DGAT1	35	41
O=C(COC(=O)CSCc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853718889	HH	On-Demand	Anodyne	SLC27A1	48	42
C#C[C@H](NC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1)C1CCOCC1	ZINC000853718890	GD	On-Demand	Mild	TACR2	40	37
O=C(NCCCc1nc[nH]n1)NCc1ccc(Br)cc1F	ZINC000853718896	FE	On-Demand	Anodyne	AKR1B1	19	45
COCCN(CCF)C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000853718911	FD	On-Demand	Anodyne	CASR	53	43
COCCN(CCF)C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000853718911	FD	On-Demand	Anodyne	PSMB8	50	37
Cc1nn(C)c2c(=O)n(Cc3ccc(OC(C)C)cc3)ncc12	ZINC000853718919	DE	On-Demand	Anodyne	PKM	43	46
Cc1nn(C)c2c(=O)n(Cc3ccc(OC(C)C)cc3)ncc12	ZINC000853718919	DE	On-Demand	Anodyne	NPBWR1	58	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(-c3ccc(C)o3)ncc2=O)CC1	ZINC000853718920	GD	On-Demand	Anodyne	P2RY12	66	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(-c3ccc(C)o3)ncc2=O)CC1	ZINC000853718922	GD	On-Demand	Anodyne	P2RY12	66	36
Cc1nn(C)c2c(=O)n(Cc3cccc(C(=O)C(F)(F)F)c3)ncc12	ZINC000853718938	FE	On-Demand	Anodyne	PKM	50	46
C#CCCN(CCOC)C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000853718970	FD	On-Demand	Mild	CASR	49	42
C#CCCN(CCOC)C(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000853718970	FD	On-Demand	Mild	PSMB8	43	36
C#CCCN(CCOC)C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000853718972	FD	On-Demand	Mild	CASR	49	42
C#CCCN(CCOC)C(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000853718972	FD	On-Demand	Mild	PSMB8	43	36
CC(C)(C)OC(=O)NC[C@H](NC(=O)NCCCc1nc[nH]n1)C1CCCCC1	ZINC000853718977	GF	On-Demand	Anodyne	REN	52	39
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NCCCc1nc[nH]n1)C1CCCCC1	ZINC000853718980	GF	On-Demand	Anodyne	REN	52	39
CON(C)CCNC(=O)NCc1ccc(Br)cc1F	ZINC000853718989	ED	On-Demand	Anodyne	AKR1B1	20	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)N1CCC(Cc2ccccc2)CC1	ZINC000853718997	HG	On-Demand	Mild	GRIN2B	60	47
Cc1nn(C)c2c(=O)n(Cc3ccnn3C)ncc12	ZINC000853719017	CC	On-Demand	Anodyne	PKM	46	37
Cc1nn(C)c2c(=O)n(Cc3cccc(SC(F)(F)F)c3)ncc12	ZINC000853719068	FG	On-Demand	Anodyne	PKM	50	48
CC(C)(C)OC(=O)N1CCC(CCCn2cc(CO)nn2)CC1	ZINC000853719085	DE	On-Demand	Anodyne	GPR119	47	47
CC(C)(C)OC(=O)N1CCC(CCCn2cc(CO)nn2)CC1	ZINC000853719085	DE	On-Demand	Anodyne	KDM1A	19	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cccc(F)c2=O)CC1	ZINC000853719089	EC	On-Demand	Anodyne	P2RY12	51	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cccc(F)c2=O)CC1	ZINC000853719092	EC	On-Demand	Anodyne	P2RY12	51	38
Cc1nc(CN2CCC(CNC(=O)N[C@H]3C[C@H](O)c4ccccc43)CC2)oc1C	ZINC000853719110	GF	On-Demand	Anodyne	HTR4	63	41
Cc1nc(CN2CCC(CNC(=O)N[C@H]3C[C@H](O)c4ccccc43)CC2)oc1C	ZINC000853719110	GF	On-Demand	Anodyne	CACNA1I	60	39
Cc1ncn(CC(=O)Nc2cccc(S(C)(=O)=O)c2)n1	ZINC000853719113	CC	On-Demand	Anodyne	CA4	15	46
Cc1nc(CN2CCC(CNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)CC2)oc1C	ZINC000853719116	GF	On-Demand	Anodyne	HTR4	63	41
Cc1nc(CN2CCC(CNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)CC2)oc1C	ZINC000853719116	GF	On-Demand	Anodyne	CACNA1I	60	39
Cc1nc(CN2CCC(CNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)CC2)oc1C	ZINC000853719119	GF	On-Demand	Anodyne	HTR4	63	41
Cc1nc(CN2CCC(CNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)CC2)oc1C	ZINC000853719119	GF	On-Demand	Anodyne	CACNA1I	60	39
Cc1nc(CN2CCC(CNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)CC2)oc1C	ZINC000853719123	GF	On-Demand	Anodyne	HTR4	63	41
Cc1nc(CN2CCC(CNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)CC2)oc1C	ZINC000853719123	GF	On-Demand	Anodyne	CACNA1I	60	39
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1c(F)cccc1F	ZINC000853719124	GF	On-Demand	Mild	STAT6	45	36
Cc1nn(C)c2c(=O)n(Cc3ccc(S(=O)(=O)C(F)F)cc3)ncc12	ZINC000853719127	FD	On-Demand	Anodyne	PKM	46	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2SC)CC1	ZINC000853719142	FE	On-Demand	Anodyne	P2RY12	106	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2SC)CC1	ZINC000853719146	FE	On-Demand	Anodyne	P2RY12	106	41
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1cccc(Oc2ccccc2)c1	ZINC000853719147	II	On-Demand	Mild	CASR	36	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1cccc(Oc2ccccc2)c1	ZINC000853719147	II	On-Demand	Mild	ACOX1	17	40
O=C(NCc1ccc(Br)cc1F)N1C[C@@H]2CCCC[C@@H]21	ZINC000853719150	EH	On-Demand	Anodyne	AKR1B1	20	40
O=C(NCc1ccc(Br)cc1F)N1C[C@@H]2CCCC[C@@H]21	ZINC000853719150	EH	On-Demand	Anodyne	P2RX7	32	51
Cc1nn(C)c2c(=O)n(Cc3ccc(CO[Si](C)(C)C(C)(C)C)cc3)ncc12	ZINC000853719185	GI	On-Demand	Reactive	PKM	37	41
O=C(CON=Cc1ccc(N2CCOCC2)cc1)NC12CC3CC(CC(C3)C1)C2	ZINC000853719187	GF	On-Demand	Mild	EPHX2	62	54
CN1CCN(C(=O)NCc2ccc(Br)cc2F)CCC1=O	ZINC000853719195	FD	On-Demand	Anodyne	P2RX7	40	52
Cc1nn(C)c2c(=O)n(CC(=O)c3cc(C)n(Cc4ccccc4)c3C)ncc12	ZINC000853719210	GF	On-Demand	Anodyne	PKM	39	41
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCC[C@H](CC#N)C1)C1CCCCC1	ZINC000853719212	GH	On-Demand	Mild	REN	43	44
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCC[C@H](CC#N)C1)C1CCCCC1	ZINC000853719212	GH	On-Demand	Mild	CTSS	17	47
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCC[C@@H](CC#N)C1)C1CCCCC1	ZINC000853719213	GH	On-Demand	Mild	REN	43	44
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCC[C@@H](CC#N)C1)C1CCCCC1	ZINC000853719213	GH	On-Demand	Mild	CTSS	17	47
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCC[C@H](CC#N)C1)C1CCCCC1	ZINC000853719215	GH	On-Demand	Mild	REN	43	44
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCC[C@H](CC#N)C1)C1CCCCC1	ZINC000853719215	GH	On-Demand	Mild	CTSS	17	47
CC(C)(C)OC(=O)N1CCC(CCn2cc(CO)nn2)CC1	ZINC000853719234	DD	On-Demand	Anodyne	GPR119	48	45
CC(C)(C)OC(=O)N1CCC(CCn2cc(CO)nn2)CC1	ZINC000853719234	DD	On-Demand	Anodyne	KDM1A	19	45
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ccc(=O)c3cnc(Cl)cc32)C1	ZINC000853719247	GH	On-Demand	Anodyne	GPR119	48	40
CC(C)(C)OC(=O)N1CC[C@H](CCn2ccc(=O)c3cnc(Cl)cc32)C1	ZINC000853719248	GH	On-Demand	Anodyne	GPR119	48	40
COC(=O)Cc1ccccc1CNc1cc(OC)ncc1Br	ZINC000853719252	FG	On-Demand	Anodyne	MT-CYB	43	32
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc2ccccc2c1	ZINC000853719263	GH	On-Demand	Mild	STAT6	57	35
CN1C(=O)N(CCCNC(=O)C2CCCC2)S(=O)(=O)c2ccccc21	ZINC000853719276	FD	On-Demand	Anodyne	TBK1	61	34
CN1C(=O)N(CCN2CCCCC2)S(=O)(=O)c2ccccc21	ZINC000853719281	DD	On-Demand	Anodyne	HNMT	42	31
COC(=O)c1ccc(Br)cc1Cn1ncc2c(C)nn(C)c2c1=O	ZINC000853719284	GE	On-Demand	Anodyne	PKM	45	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(CO)nn2)CC1	ZINC000853719285	DB	On-Demand	Anodyne	P2RY12	40	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(CO)nn2)CC1	ZINC000853719286	DB	On-Demand	Anodyne	P2RY12	40	35
Cc1nn(C)c2c(=O)n(Cc3csc(Cl)n3)ncc12	ZINC000853719292	CD	On-Demand	Anodyne	PKM	40	38
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)C1CCCCC1	ZINC000853719295	GH	On-Demand	Mild	REN	43	44
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)C1CCCCC1	ZINC000853719295	GH	On-Demand	Mild	CTSS	17	47
CCCCCCCCn1cnc(N)c(Cl)c1=O	ZINC000853719303	CF	On-Demand	Mild	ADA	41	40
CCCCCCn1cnc(N)c(Cl)c1=O	ZINC000853719335	BE	On-Demand	Anodyne	ADA	41	40
O=C(COC(=O)CSCc1ccc(F)cc1)NCC1(c2ccccc2)CC1	ZINC000853719338	GG	On-Demand	Anodyne	KCNA3	47	38
O=C(COC(=O)CSCc1ccc(F)cc1)NCC1(c2ccccc2)CC1	ZINC000853719338	GG	On-Demand	Anodyne	NPFFR1	37	44
COC(=O)N(C)CCNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000853719342	GC	On-Demand	Anodyne	TACR2	26	42
COC(=O)N(C)CCNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000853719344	GC	On-Demand	Anodyne	TACR2	26	42
Cc1nn(C)c2c(=O)n(Cc3ccc(SC(=O)N(C)C)cc3)ncc12	ZINC000853719357	FE	On-Demand	Anodyne	PKM	37	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2cnc(N)c(Cl)c2=O)CC1	ZINC000853719377	FF	On-Demand	Anodyne	CACNA1I	44	34
C=Cc1ccccc1OCC(=O)NCc1ccc(N2CCOCC2)c(F)c1	ZINC000853719379	FG	On-Demand	Clean	STAT6	43	33
CC(C)(C)OC(=O)N1CCc2c(cccc2Cn2cc(CO)nn2)C1	ZINC000853719380	EE	On-Demand	Anodyne	KDM1A	20	43
O=C(NCc1ccc(Br)cc1F)N1CCC(O)(CO)CC1	ZINC000853719381	FD	On-Demand	Anodyne	AKR1B1	20	41
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CC[C@@]2(O)C[C@H]2C1)C1CCCCC1	ZINC000853719401	GF	On-Demand	Anodyne	REN	25	40
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CC[C@@]2(O)C[C@H]2C1)C1CCCCC1	ZINC000853719404	GF	On-Demand	Anodyne	REN	25	40
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2cc(CO)nn2)C1	ZINC000853719407	CC	On-Demand	Anodyne	KDM1A	18	40
CC(C)(C)OC(=O)N1CCO[C@H](Cn2cc(CO)nn2)C1	ZINC000853719409	CC	On-Demand	Anodyne	KDM1A	18	40
CN1C(=O)N(CCCN2CCCCC2)S(=O)(=O)c2ccccc21	ZINC000853719414	EE	On-Demand	Anodyne	HTR1A	25	47
CN1C(=O)N(CCCN2CCCCC2)S(=O)(=O)c2ccccc21	ZINC000853719414	EE	On-Demand	Anodyne	ADRA1A	15	47
CN1C(=O)N(CCCN2CCCCC2)S(=O)(=O)c2ccccc21	ZINC000853719414	EE	On-Demand	Anodyne	ADRA1B	18	41
CN1C(=O)N(CCCN2CCCCC2)S(=O)(=O)c2ccccc21	ZINC000853719414	EE	On-Demand	Anodyne	HTR7	18	43
CN1C(=O)N(CCCN2CCCCC2)S(=O)(=O)c2ccccc21	ZINC000853719414	EE	On-Demand	Anodyne	SIGMAR1	19	44
CN1C(=O)N(CCCN2CCCCC2)S(=O)(=O)c2ccccc21	ZINC000853719414	EE	On-Demand	Anodyne	HNMT	51	34
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719419	HE	On-Demand	Mild	MTOR	45	36
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719419	HE	On-Demand	Mild	EPHX2	15	43
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719419	HE	On-Demand	Mild	STAT6	53	34
COc1ccc(N2CCN(C(=O)Cn3cnc(N)c(Cl)c3=O)CC2)cc1	ZINC000853719422	GC	On-Demand	Clean	PLA2G7	22	40
COc1ccc(N2CCN(C(=O)Cn3cnc(N)c(Cl)c3=O)CC2)cc1	ZINC000853719422	GC	On-Demand	Clean	CCR1	28	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C)n2)CC1	ZINC000853719440	CC	On-Demand	Anodyne	P2RY12	72	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C)n2)CC1	ZINC000853719443	CC	On-Demand	Anodyne	P2RY12	72	38
CCCCCCn1cc(C)nn1	ZINC000853719453	AE	On-Demand	Anodyne	GBA	15	49
CC[C@H](C)N(CC)C(=O)NCc1ccc(Br)cc1F	ZINC000853719462	EH	On-Demand	Anodyne	AKR1B1	19	40
CC[C@H](C)N(CC)C(=O)NCc1ccc(Br)cc1F	ZINC000853719462	EH	On-Demand	Anodyne	P2RX7	15	48
Cc1nn(C)c2c(=O)n(Cc3ccc(Cl)s3)ncc12	ZINC000853719473	CE	On-Demand	Anodyne	PKM	51	42
CCCCC[C@@H](C)NC(=O)Cn1cnc(C)n1	ZINC000853719478	BD	On-Demand	Anodyne	NOD1	51	34
O=C(Cn1ccc(OCc2ccccc2)n1)N1CCC2(CC1)OCCO2	ZINC000853719481	FD	On-Demand	Anodyne	SLC12A5	51	33
CCCCCCCCn1cnc(C)n1	ZINC000853719486	AF	On-Demand	Mild	ADA	29	45
O=C1CCCN1C[C@H]1CCN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853719488	GF	On-Demand	Anodyne	P2RX7	25	48
O=C1CCCN1C[C@@H]1CCN(C(=O)NCc2ccc(Br)cc2F)C1	ZINC000853719490	GF	On-Demand	Anodyne	P2RX7	25	48
CN1CCN(C)[C@H](CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853719497	EC	On-Demand	Reactive	WDR5	38	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853719516	ED	On-Demand	Anodyne	PLM2_PLAFA	43	31
C[C@@H]1Cc2ccccc2[C@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853719519	ED	On-Demand	Anodyne	PLM2_PLAFA	43	31
CN1CCN(C)[C@@H](CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853719524	EC	On-Demand	Reactive	WDR5	38	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853719527	II	On-Demand	Mild	LTA4H	31	47
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853719527	II	On-Demand	Mild	STAT6	51	38
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(Br)cc1F	ZINC000853719533	FF	On-Demand	Anodyne	AKR1B1	20	41
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(Br)cc1F	ZINC000853719533	FF	On-Demand	Anodyne	P2RX7	39	54
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853719537	JE	On-Demand	Mild	F13A1	41	40
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)CN1CCOCC1	ZINC000853719547	FC	On-Demand	Anodyne	PSMB8	41	38
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)CN1CCOCC1	ZINC000853719550	FC	On-Demand	Anodyne	PSMB8	41	38
O=c1ccn(C[C@@H]2CN(Cc3ccccc3)CCCO2)c2cc(Cl)ncc12	ZINC000853719559	GG	On-Demand	Anodyne	DRD4	15	41
O=c1ccn(C[C@H]2CN(Cc3ccccc3)CCCO2)c2cc(Cl)ncc12	ZINC000853719560	GG	On-Demand	Anodyne	DRD4	15	41
O=C(NCCCn1ccc(=O)c2cnc(Cl)cc21)C1CCCC1	ZINC000853719562	EF	On-Demand	Anodyne	TBK1	79	36
O=C(NCc1ccc(Br)cc1F)NCC1(O)CCC(F)(F)CC1	ZINC000853719582	GG	On-Demand	Anodyne	AKR1B1	19	40
O=S1(=O)N=C(Cl)c2ccc(N3CCC[C@@H](N4CCOCC4)CC3)cc21	ZINC000853719605	GE	On-Demand	Anodyne	L3MBTL3	43	42
O=S1(=O)N=C(Cl)c2ccc(N3CCC[C@H](N4CCOCC4)CC3)cc21	ZINC000853719606	GE	On-Demand	Anodyne	L3MBTL3	43	42
O=c1ccn(CC2CCOCC2)c2cc(Cl)ncc12	ZINC000853719615	CE	On-Demand	Anodyne	CNR2	17	42
CCOc1cc(NCc2ccccc2CC(=O)OC)nc(C)n1	ZINC000853719641	DF	On-Demand	Anodyne	METG	49	33
CCOc1cc(NCc2ccccc2CC(=O)OC)nc(C)n1	ZINC000853719641	DF	On-Demand	Anodyne	MT-CYB	43	32
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	PIK3CA	42	41
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	JAK2	15	45
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	MAPKAPK5	40	34
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	MTOR	85	41
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	EPHX2	17	43
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	EPHB4	49	32
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	STAT6	62	36
Cc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853719649	DD	On-Demand	Anodyne	DGAT1	18	43
CCCCCCn1cnc(C)n1	ZINC000853719666	AE	On-Demand	Anodyne	ADA	29	45
Cc1nn(C)c2c(=O)n(Cc3ccc([Si](C)(C)C)cc3)ncc12	ZINC000853719695	EE	On-Demand	Anodyne	PKM	50	47
CN1C(=O)N(CCCOc2ccc3c(c2)OCO3)S(=O)(=O)c2ccccc21	ZINC000853719725	GE	On-Demand	Anodyne	ELANE	45	37
CN1C(=O)N(CCCOc2ccc3c(c2)OCO3)S(=O)(=O)c2ccccc21	ZINC000853719725	GE	On-Demand	Anodyne	DYRK2	48	35
Cc1nn(C)c2c(=O)n(Cc3ccc4c(c3)COC4)ncc12	ZINC000853719735	CD	On-Demand	Anodyne	PKM	46	41
CN(Cc1cnc[nH]1)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCCC1	ZINC000853719741	GG	On-Demand	Anodyne	REN	37	45
CN(Cc1cnc[nH]1)C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCCC1	ZINC000853719743	GG	On-Demand	Anodyne	REN	37	45
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853719744	DG	On-Demand	Anodyne	PLM1_PLAFA	43	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853719744	DG	On-Demand	Anodyne	PLM2_PLAFA	36	42
O=C(Cn1ccc(OCc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719745	GF	On-Demand	Anodyne	LTA4H	15	41
O=C(Cn1ccc(OCc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719745	GF	On-Demand	Anodyne	PTGER1	15	40
O=C(Cn1ccc(OCc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719745	GF	On-Demand	Anodyne	MTOR	50	38
O=C(Cn1ccc(OCc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719745	GF	On-Demand	Anodyne	STAT6	72	41
O=C(Cn1ccc(OCc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853719745	GF	On-Demand	Anodyne	DGAT1	17	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853719746	DG	On-Demand	Anodyne	PLM1_PLAFA	43	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853719746	DG	On-Demand	Anodyne	PLM2_PLAFA	36	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853719748	DG	On-Demand	Anodyne	PLM1_PLAFA	43	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853719748	DG	On-Demand	Anodyne	PLM2_PLAFA	36	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853719750	DG	On-Demand	Anodyne	PLM1_PLAFA	43	42
C[C@@H]1Cc2ccccc2[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853719750	DG	On-Demand	Anodyne	PLM2_PLAFA	36	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853719755	JD	On-Demand	Mild	TGM2	62	40
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853719755	JD	On-Demand	Mild	F13A1	87	45
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853719755	JD	On-Demand	Mild	NAMPT	23	42
CN1CCN(C)[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853719763	ED	On-Demand	Reactive	CACNA1I	71	37
CN1CCN(C)[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853719765	ED	On-Demand	Reactive	CACNA1I	71	37
CN(C)S(=O)(=O)c1cccc(NC(=O)CON=Cc2ccc(N3CCOCC3)cc2)c1	ZINC000853719776	ID	On-Demand	Mild	CASR	21	40
Nc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)c(=O)c1Cl	ZINC000853719781	FC	On-Demand	Anodyne	MTOR	42	38
Nc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)c(=O)c1Cl	ZINC000853719781	FC	On-Demand	Anodyne	PIK3CB	16	42
Nc1ncn(CC(=O)Nc2ccc(N3CCOCC3)cc2)c(=O)c1Cl	ZINC000853719781	FC	On-Demand	Anodyne	STAT6	59	36
CCCCC[C@@H](C)NC(=O)Cn1cc(C)nn1	ZINC000853719790	BD	On-Demand	Anodyne	NOD1	50	33
COc1cc(C)nc(CN2C(=O)N(C)c3ccccc3S2(=O)=O)c1	ZINC000853719791	EE	On-Demand	Anodyne	ELANE	62	38
CCCCCCCCCn1cnc(N)c(Cl)c1=O	ZINC000853719804	CG	On-Demand	Mild	ADA	41	40
COc1ccc(N2CCN(C(=O)Cn3ncc(N(C)C)cc3=O)CC2)cc1	ZINC000853719806	FC	On-Demand	Clean	CCR1	26	43
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(-c2ccccc2)cc1	ZINC000853719807	HI	On-Demand	Mild	PIK3CA	39	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(-c2ccccc2)cc1	ZINC000853719807	HI	On-Demand	Mild	PRNP	48	43
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(-c2ccccc2)cc1	ZINC000853719807	HI	On-Demand	Mild	MTOR	73	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(-c2ccccc2)cc1	ZINC000853719807	HI	On-Demand	Mild	PIK3CG	32	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(-c2ccccc2)cc1	ZINC000853719807	HI	On-Demand	Mild	STAT6	41	36
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc(-c2ccccc2)cc1	ZINC000853719807	HI	On-Demand	Mild	DGAT1	19	42
Cc1nn(C)c2c(=O)n(Cc3cncc(C(F)(F)F)c3)ncc12	ZINC000853719810	DD	On-Demand	Anodyne	PKM	47	48
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853719832	JD	On-Demand	Mild	F13A1	48	41
COCc1n[nH]c(CNC(=O)NCc2ccc(Br)cc2F)n1	ZINC000853719842	FD	On-Demand	Anodyne	AKR1B1	19	40
O=C(NC/C=C/CO)NCc1ccc(Br)cc1F	ZINC000853719849	DD	On-Demand	Anodyne	AKR1B1	19	42
O=C(NC/C=C\CO)NCc1ccc(Br)cc1F	ZINC000853719850	DD	On-Demand	Anodyne	AKR1B1	19	42
CC(C)(C)OC(=O)NCCCCCCCn1cnc(N)c(Cl)c1=O	ZINC000853719882	FF	On-Demand	Anodyne	DNAE	53	32
O=C(NCc1ccc(Br)cc1F)N1CCC(CO)(CO)C1	ZINC000853719888	FD	On-Demand	Anodyne	AKR1B1	20	40
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CC[C@H]2COC[C@@H]2C1)C1CCCCC1	ZINC000853719889	GG	On-Demand	Anodyne	REN	30	40
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CC[C@H]2COC[C@H]2C1)C1CCCCC1	ZINC000853719890	GG	On-Demand	Anodyne	REN	30	40
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CC[C@@H]2COC[C@H]2C1)C1CCCCC1	ZINC000853719891	GG	On-Demand	Anodyne	REN	30	40
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CC[C@@H]2COC[C@@H]2C1)C1CCCCC1	ZINC000853719892	GG	On-Demand	Anodyne	REN	30	40
C#Cc1cccnc1N1CCC[C@H](N2CCOCC2)CC1	ZINC000853719894	CD	On-Demand	Mild	L3MBTL3	46	41
C#Cc1cccnc1N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853719895	CD	On-Demand	Mild	L3MBTL3	46	41
CC(C)(C)OC(=O)N1CCC(CCn2ccc(=O)c3cnc(Cl)cc32)CC1	ZINC000853719904	GI	On-Demand	Anodyne	GPR119	57	44
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)CON=Cc1ccc(N2CCOCC2)cc1	ZINC000853719908	JI	On-Demand	Mild	DGAT1	23	42
CCCN(Cc1ccc(C)cc1)C(=O)Cn1ccc(=O)c2cnc(Cl)cc21	ZINC000853719911	GH	On-Demand	Anodyne	PLA2G7	70	35
COC(=O)Cc1ccccc1CNc1nc(C(F)(F)F)ccc1C(C)=O	ZINC000853719921	FH	On-Demand	Anodyne	TRPV1	51	33
Cc1nn(C)c2c(=O)n(CC3CCN(C(=O)OC(C)(C)C)CC3)ncc12	ZINC000853719929	FE	On-Demand	Anodyne	GPR119	46	43
CC(C)(C)OC(=O)N1CCc2ccc(Cn3cc(CO)nn3)cc2C1	ZINC000853719975	EE	On-Demand	Anodyne	KDM1A	20	50
CON(C)CCNC(=O)N[C@H]1c2ccccc2C[C@H]1C	ZINC000853719980	CD	On-Demand	Anodyne	PLM1_PLAFA	41	37
CON(C)CCNC(=O)N[C@@H]1c2ccccc2C[C@@H]1C	ZINC000853719981	CD	On-Demand	Anodyne	PLM1_PLAFA	41	37
CON(C)CCNC(=O)N[C@@H]1c2ccccc2C[C@H]1C	ZINC000853719982	CD	On-Demand	Anodyne	PLM1_PLAFA	41	37
CON(C)CCNC(=O)N[C@H]1c2ccccc2C[C@@H]1C	ZINC000853719983	CD	On-Demand	Anodyne	PLM1_PLAFA	41	37
COC(=O)Cc1ccccc1CNc1cc(C(F)(F)F)cc(C)n1	ZINC000853720000	EH	On-Demand	Anodyne	TACR1	18	40
Cc1nn(C)c2c(=O)n(Cc3ccc(CF)cc3)ncc12	ZINC000853720021	CD	On-Demand	Anodyne	PKM	54	49
CCOc1ccc(-n2c(C)cc(C(=O)Cn3ncc(N(C)C)cc3=O)c2C)cc1	ZINC000853720027	GF	On-Demand	Clean	CACNA2D1	53	38
COc1cccc(Nc2nc(NC[C@H]3CN(C4CC4)C(=O)O3)nc3[nH]cnc23)c1	ZINC000853720031	GF	On-Demand	Anodyne	PDPK1	15	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccn3c(=O)cc(C)nc23)CC1	ZINC000853720033	FC	On-Demand	Anodyne	P2RY12	107	39
COc1cccc(Nc2nc(NC[C@@H]3CN(C4CC4)C(=O)O3)nc3[nH]cnc23)c1	ZINC000853720034	GF	On-Demand	Anodyne	PDPK1	15	45
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccn3c(=O)cc(C)nc23)CC1	ZINC000853720036	FC	On-Demand	Anodyne	P2RY12	107	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccccc2COC)CC1	ZINC000853720042	FD	On-Demand	Anodyne	P2RY12	88	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccccc2COC)CC1	ZINC000853720044	FD	On-Demand	Anodyne	P2RY12	88	40
O=[N+]([O-])c1ccc(N2C[C@@H]3CCCC[C@@H]32)c2nonc12	ZINC000853720054	CF	On-Demand	Bother	GSTM2	110	48
O=[N+]([O-])c1ccc(N2C[C@@H]3CCCC[C@@H]32)c2nonc12	ZINC000853720054	CF	On-Demand	Bother	GSTP1	67	48
Cc1nn(C)c2c(=O)n(Cc3cccc(NC(=O)OC(C)(C)C)c3)ncc12	ZINC000853720076	FF	On-Demand	Anodyne	PKM	42	39
Cc1nn(C)c2c(=O)n(Cc3cccc4c3OCCO4)ncc12	ZINC000853720089	DD	On-Demand	Anodyne	PKM	48	39
COc1ccc(N2CCN(C(=O)Cn3cc(C)nn3)CC2)cc1	ZINC000853720091	DC	On-Demand	Clean	CCKAR	28	41
COc1ccc(N2CCN(C(=O)Cn3cc(C)nn3)CC2)cc1	ZINC000853720091	DC	On-Demand	Clean	CCR1	24	45
CC[C@@H](O)CNC(=O)NCc1ccc(Br)cc1F	ZINC000853720095	DE	On-Demand	Anodyne	AKR1B1	19	42
C=Cc1ccccc1OCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853720106	EG	On-Demand	Anodyne	MTOR	43	37
C=Cc1ccccc1OCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853720106	EG	On-Demand	Anodyne	EPHX2	20	41
C=Cc1ccccc1OCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853720106	EG	On-Demand	Anodyne	STAT6	68	39
C=Cc1ccccc1OCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853720106	EG	On-Demand	Anodyne	DGAT1	15	41
C[C@@H]1CN(C(=O)NCc2ccc(Br)cc2F)C[C@@H](C)C1O	ZINC000853720108	FF	On-Demand	Anodyne	AKR1B1	20	41
C[C@@H]1CN(C(=O)NCc2ccc(Br)cc2F)C[C@@H](C)C1O	ZINC000853720108	FF	On-Demand	Anodyne	P2RX7	36	49
Cn1c(S)nnc1CCNC(=O)NCc1ccc(Br)cc1F	ZINC000853720110	GE	On-Demand	Anodyne	AKR1B1	18	40
O=C(NCc1ccc(Br)cc1F)NCC(O)(C1CC1)C1CC1	ZINC000853720115	FF	On-Demand	Anodyne	AKR1B1	19	40
O=C(NCc1ccc(Br)cc1F)NCC(O)(C1CC1)C1CC1	ZINC000853720115	FF	On-Demand	Anodyne	P2RX7	22	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(=O)c3cnc(Cl)cc32)CC1	ZINC000853720122	GD	On-Demand	Anodyne	P2RY12	48	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(=O)c3cnc(Cl)cc32)CC1	ZINC000853720123	GD	On-Demand	Anodyne	P2RY12	48	35
CC(C)(CO)[C@H](NC(=O)NCc1ccc(Br)cc1F)C1CC1	ZINC000853720145	FG	On-Demand	Anodyne	P2RX7	16	45
CCCCC[C@@H](C)NC(=O)Cn1cnc(N)c(Cl)c1=O	ZINC000853720164	DD	On-Demand	Anodyne	ADA	41	33
C[C@H]1CN(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CCCCC2)C[C@@H](C)[C@@H]1O	ZINC000853720178	GG	On-Demand	Anodyne	REN	24	40
C[C@@H]1CN(C(=O)N[C@H](CNC(=O)OC(C)(C)C)C2CCCCC2)C[C@@H](C)C1O	ZINC000853720179	GG	On-Demand	Anodyne	REN	24	40
C[C@H]1CN(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CCCCC2)C[C@@H](C)[C@@H]1O	ZINC000853720180	GG	On-Demand	Anodyne	REN	24	40
C[C@@H]1CN(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C2CCCCC2)C[C@@H](C)C1O	ZINC000853720181	GG	On-Demand	Anodyne	REN	24	40
O=C(NCc1ccc(Br)cc1F)NCC1CCC(O)CC1	ZINC000853720187	FF	On-Demand	Anodyne	AKR1B1	19	42
O=C(NCc1ccc(Br)cc1F)NCC1CCC(O)CC1	ZINC000853720187	FF	On-Demand	Anodyne	P2RX7	16	47
CC(C)(C)OC(=O)N1CC[C@H](CCn2cc(CO)nn2)C1	ZINC000853720198	CD	On-Demand	Anodyne	GPR119	39	41
CC(C)(C)OC(=O)N1CC[C@H](CCn2cc(CO)nn2)C1	ZINC000853720198	CD	On-Demand	Anodyne	KDM1A	18	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc(CO)nn2)C1	ZINC000853720199	CD	On-Demand	Anodyne	GPR119	39	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc(CO)nn2)C1	ZINC000853720199	CD	On-Demand	Anodyne	KDM1A	18	41
O=C(CON=Cc1ccc(N2CCOCC2)cc1)NCCC(c1ccccc1)c1ccccc1	ZINC000853720219	JI	On-Demand	Mild	CASR	52	38
Cc1nn(C)c2c(=O)n(CCC3CCN(C(=O)OC(C)(C)C)CC3)ncc12	ZINC000853720222	GE	On-Demand	Anodyne	GPR119	45	42
Cc1nonc1Cn1ncc2c(C)nn(C)c2c1=O	ZINC000853720228	CC	On-Demand	Anodyne	PKM	46	36
Cc1nn(C)c2c(=O)n(Cc3ccc(Cl)nc3C(F)(F)F)ncc12	ZINC000853720229	FF	On-Demand	Anodyne	PKM	44	39
Cc1nn(C)c2c(=O)n(Cc3ccc(Cl)nc3C(F)(F)F)ncc12	ZINC000853720229	FF	On-Demand	Anodyne	NPBWR1	46	38
O=C1O[C@H](CNc2ccnc3c(F)cc(Cl)cc23)CN1C1CC1	ZINC000853720311	EG	On-Demand	Anodyne	HRP1_PLAFA	52	31
O=C1O[C@@H](CNc2ccnc3c(F)cc(Cl)cc23)CN1C1CC1	ZINC000853720312	EG	On-Demand	Anodyne	HRP1_PLAFA	52	31
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(N)c(Cl)c2=O)C1	ZINC000853720338	EE	On-Demand	Anodyne	GPR119	42	41
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(N)c(Cl)c2=O)C1	ZINC000853720340	EE	On-Demand	Anodyne	GPR119	42	41
c1cc(N2CCCC2)nc(N2C[C@@H]3CCCC[C@@H]32)n1	ZINC000853720344	CE	On-Demand	Anodyne	SORD	67	36
CC(C)(C)OC(=O)N1CCC(CCCn2cnc(N)c(Cl)c2=O)CC1	ZINC000853720361	FF	On-Demand	Anodyne	GPR119	46	44
O=C(NCc1ccc(Br)cc1F)N1CCn2c(O)nnc2C1	ZINC000853720367	FD	On-Demand	Anodyne	P2RX7	15	42
C[C@@H]1CCCN(C(=O)NCc2ccc(Br)cc2F)[C@H]1CCO	ZINC000853720382	FG	On-Demand	Anodyne	P2RX7	22	48
C[C@@H]1CCCN(C(=O)NCc2ccc(Br)cc2F)[C@@H]1CCO	ZINC000853720383	FG	On-Demand	Anodyne	P2RX7	22	48
O=C(NCc1ccc(Br)cc1F)N1CCC2(COC2)C1	ZINC000853720390	EF	On-Demand	Anodyne	AKR1B1	20	40
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccccc1Cl	ZINC000853720392	FG	On-Demand	Mild	EPHB3	28	43
C=Cc1ccccc1OCC(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853720418	DH	On-Demand	Anodyne	KCNQ2	20	43
C=Cc1ccccc1OCC(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853720418	DH	On-Demand	Anodyne	F13A1	40	37
O=C(CON=Cc1ccc(N2CCOCC2)cc1)Nc1ccc2c(c1)OCO2	ZINC000853720423	GE	On-Demand	Mild	DYRK2	42	33
CC(C)c1ccc2ncnc(NC[C@H]3CN(C4CC4)C(=O)O3)c2c1	ZINC000853720480	EG	On-Demand	Anodyne	CLK4	49	38
CC(C)c1ccc2ncnc(NC[C@@H]3CN(C4CC4)C(=O)O3)c2c1	ZINC000853720481	EG	On-Demand	Anodyne	CLK4	49	38
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	CHRM2	19	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	CHRM1	18	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	ACE	25	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	DRD2	27	56
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	DRD4	50	56
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	ACHE	26	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	SLC6A3	28	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	KCNH2	20	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	CHRM3	25	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	LTA4H	30	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	SIGMAR1	52	54
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	SSTR5	40	38
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	CCR3	86	53
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	TIMP3	40	35
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	UTS2R	23	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	SLC18A3	18	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	MLNR	77	39
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	CCR2	20	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	BACE1	22	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	MCHR1	45	48
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	CACNA1G	48	49
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	LEF	15	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853720521	IG	On-Demand	Anodyne	BIRC2	46	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	CHRM2	19	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	CHRM1	18	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	ACE	25	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	DRD2	27	56
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	DRD4	50	56
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	ACHE	26	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	SLC6A3	28	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	KCNH2	20	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	CHRM3	25	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	LTA4H	30	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	SIGMAR1	52	54
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	SSTR5	40	38
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	CCR3	86	53
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	TIMP3	40	35
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	UTS2R	23	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	SLC18A3	18	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	MLNR	77	39
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	CCR2	20	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	BACE1	22	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	MCHR1	45	48
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	CACNA1G	48	49
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	LEF	15	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853720523	IG	On-Demand	Anodyne	BIRC2	46	44
Cn1cncc1CCONC(=N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853720525	FE	On-Demand	Anodyne	GPR119	41	40
N#CCOc1cccc(OCCC2CCC2)c1	ZINC000853720540	BG	On-Demand	Mild	CHRNA10	41	38
O=C(NOCc1cncs1)C1CC1	ZINC000853720559	AD	On-Demand	Anodyne	CYP3A4	35	41
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CHRM2	24	47
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CHRM1	24	47
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	DRD2	34	53
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	DRD4	64	53
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	ACHE	50	48
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	SSTR2	17	41
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	DRD3	23	53
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	OPRK1	19	40
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	SLC6A3	19	42
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	KCNH2	18	46
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	HTR4	37	48
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CHRM3	38	47
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	LTA4H	29	45
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	HRH3	17	41
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	SIGMAR1	67	58
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	SSTR5	71	41
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CACNA1B	17	42
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CCR3	39	44
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CCR5	25	40
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CCR2	15	40
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	SLC6A5	23	43
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	EPHX2	26	47
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	MCHR1	59	52
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CACNA1G	47	45
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	CCR8	25	45
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	BIRC2	38	43
C[C@@H](ONC(=O)C1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720562	ED	On-Demand	Anodyne	NPFFR1	40	35
O=C(CONC(=O)C1CC1)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853720570	FD	On-Demand	Anodyne	EPHX2	20	41
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccc(OCC#N)c2)C1	ZINC000853720600	EF	On-Demand	Mild	GPR119	34	45
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccc(OCC#N)c2)C1	ZINC000853720601	EF	On-Demand	Mild	GPR119	34	45
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853720608	HI	On-Demand	Anodyne	KCNQ2	50	45
CC(C)(C)OC(=O)N1CCC(C(=N)NOCCC2CCC2)CC1	ZINC000853720612	EG	On-Demand	Anodyne	GPR119	38	42
N#CCOc1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853720633	EG	On-Demand	Mild	GRIN2B	36	44
N#CCOc1cccc(OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853720633	EG	On-Demand	Mild	CHRNA10	44	37
N#CCOc1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853720634	EG	On-Demand	Mild	GRIN2B	36	44
N#CCOc1cccc(OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853720634	EG	On-Demand	Mild	CHRNA10	44	37
N#Cc1cccc(S(=O)(=O)NCC(=O)OCC(=O)N[C@@H](c2ccccc2)C2CC2)c1	ZINC000853720636	ID	On-Demand	Mild	ITGA4	43	30
N#Cc1cccc(S(=O)(=O)NCC(=O)OCC(=O)N[C@H](c2ccccc2)C2CC2)c1	ZINC000853720637	ID	On-Demand	Mild	ITGA4	43	30
N#CCOc1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853720642	GF	On-Demand	Mild	CPT1A	49	39
N#CCOc1cccc(OCC(=O)NC2CCN(C(=O)C3CCCCC3)CC2)c1	ZINC000853720642	GF	On-Demand	Mild	CPT2	41	36
C#CCNC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1	ZINC000853720662	DD	On-Demand	Mild	PAPA1_CARPA	33	45
C#CCNC(=O)[C@H](C)OC(=O)CSCc1ccc(F)cc1	ZINC000853720663	DD	On-Demand	Mild	PAPA1_CARPA	33	45
CC(C)c1cccc(CONC(=O)C2CC2)c1	ZINC000853720669	BF	On-Demand	Anodyne	F11	25	40
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1	ZINC000853720672	EF	On-Demand	Anodyne	ACE	16	51
CC[C@H](C)NC(=O)[C@H](C)OC(=O)CSCc1ccc(F)cc1	ZINC000853720673	EF	On-Demand	Anodyne	ACE	16	51
Cc1c(NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c2cccc(C#N)c2)cccc1[N+](=O)[O-]	ZINC000853720675	ID	On-Demand	Mild	COLA	91	35
Cc1c(NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2cccc(C#N)c2)cccc1[N+](=O)[O-]	ZINC000853720676	ID	On-Demand	Mild	COLA	91	35
O=c1c2cc([N+](=O)[O-])ccc2ccn1CCOC(F)F	ZINC000853720679	CE	On-Demand	Bother	F2RL3	48	34
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000853720694	GG	On-Demand	Bother	GPR119	48	47
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	CHRM2	24	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	CHRM1	22	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	ACE	24	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	DRD2	36	50
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	DRD4	60	48
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	ACHE	40	45
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	HTR2A	15	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	DRD3	19	50
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	SLC6A3	33	47
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	KCNH2	23	49
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	HTR4	15	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	CHRM3	30	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	LTA4H	35	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	SIGMAR1	63	62
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	SSTR5	59	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	CCR3	86	52
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	CCR5	19	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	TIMP3	42	35
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	MLNR	61	39
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	SLC6A5	24	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	BACE1	25	46
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	MCHR1	61	49
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853720704	IH	On-Demand	Anodyne	CACNA1G	56	52
N#CCOc1cccc(OC[C@@H]2CC[C@H]3C[C@H]3C2)c1	ZINC000853720716	CG	On-Demand	Mild	CHRNA10	48	38
N#CCOc1cccc(OC[C@@H]2CC[C@@H]3C[C@@H]3C2)c1	ZINC000853720717	CG	On-Demand	Mild	CHRNA10	48	38
N#CCOc1cccc(OC[C@@H]2CC[C@@H]3C[C@H]3C2)c1	ZINC000853720718	CG	On-Demand	Mild	CHRNA10	48	38
N#CCOc1cccc(OC[C@@H]2CC[C@H]3C[C@@H]3C2)c1	ZINC000853720719	CG	On-Demand	Mild	CHRNA10	48	38
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000853720725	FD	On-Demand	Anodyne	CALCRL	15	42
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(CC(F)(F)F)C1=O	ZINC000853720726	FD	On-Demand	Anodyne	CALCRL	15	42
O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853720727	FD	On-Demand	Anodyne	CALCRL	15	42
O=C(N[C@@H]1CCN(CC(F)(F)F)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853720728	FD	On-Demand	Anodyne	CALCRL	15	42
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)C2CC2)CC1	ZINC000853720729	DC	On-Demand	Anodyne	P2RY12	43	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)C2CC2)CC1	ZINC000853720730	DC	On-Demand	Anodyne	P2RY12	43	36
Cc1nocc1CONC(=N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853720744	EF	On-Demand	Anodyne	GPR119	44	39
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CC1	ZINC000853720749	CD	On-Demand	Anodyne	GRIN2B	42	37
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CC1	ZINC000853720749	CD	On-Demand	Anodyne	SLC18A3	15	42
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CC1	ZINC000853720749	CD	On-Demand	Anodyne	L3MBTL3	71	38
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CC1	ZINC000853720750	CD	On-Demand	Anodyne	GRIN2B	42	37
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CC1	ZINC000853720750	CD	On-Demand	Anodyne	SLC18A3	15	42
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CC1	ZINC000853720750	CD	On-Demand	Anodyne	L3MBTL3	71	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncc(N(C)C)cc2=O)CC1	ZINC000853720754	FC	On-Demand	Anodyne	P2RY12	66	43
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncc(N(C)C)cc2=O)CC1	ZINC000853720755	FC	On-Demand	Anodyne	P2RY12	66	43
CCCn1ncnc1CONC(=N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853720769	FE	On-Demand	Anodyne	GPR119	44	41
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000853720773	HJ	On-Demand	Anodyne	LTA4H	15	47
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000853720773	HJ	On-Demand	Anodyne	PTGER4	18	41
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(Cl)cc1	ZINC000853720773	HJ	On-Demand	Anodyne	LEF	42	39
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000853720774	HJ	On-Demand	Anodyne	LTA4H	15	47
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000853720774	HJ	On-Demand	Anodyne	PTGER4	18	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000853720774	HJ	On-Demand	Anodyne	LEF	42	39
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	DRD4	24	55
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	HTR4	17	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	SIGMAR1	23	49
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	SSTR5	41	38
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	CCR3	18	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	CCR2	20	51
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	EPHX2	21	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CC2)CC1	ZINC000853720801	ED	On-Demand	Anodyne	MCHR1	28	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853720808	HI	On-Demand	Mild	VIPR1	31	49
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OCC#N)c2)CC1	ZINC000853720816	FD	On-Demand	Mild	P2RY12	69	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OCC#N)c2)CC1	ZINC000853720817	FD	On-Demand	Mild	P2RY12	69	38
CC(C)(C)OC(=O)N1CCC(C(=N)NOCCOCc2ccccc2)CC1	ZINC000853720820	GG	On-Demand	Anodyne	FKBP1A	30	41
CC(C)(C)OC(=O)N1CCC(C(=N)NOCCOCc2ccccc2)CC1	ZINC000853720820	GG	On-Demand	Anodyne	GRIN2B	32	43
CC(C)(C)OC(=O)N1CCC(C(=N)NOCCOCc2ccccc2)CC1	ZINC000853720820	GG	On-Demand	Anodyne	GPR119	45	41
CC(C)(C)OC(=O)N1CCC(C(=N)NOCCOCc2ccccc2)CC1	ZINC000853720820	GG	On-Demand	Anodyne	SFRP1	54	42
CC(C)(C)OC(=O)N1CCC(C(=N)NOCCOCc2ccccc2)CC1	ZINC000853720820	GG	On-Demand	Anodyne	WNT3	42	35
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)CSCc3ccc(F)cc3)CC2)cc1	ZINC000853720834	JF	On-Demand	Anodyne	TRY2_BOVIN	15	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)CSCc3ccc(F)cc3)CC2)cc1	ZINC000853720834	JF	On-Demand	Anodyne	TGM2	40	42
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)CSCc3ccc(F)cc3)CC2)cc1	ZINC000853720834	JF	On-Demand	Anodyne	F13A1	45	42
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)CSCc3ccc(F)cc3)CC2)cc1	ZINC000853720835	JF	On-Demand	Anodyne	TRY2_BOVIN	15	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)CSCc3ccc(F)cc3)CC2)cc1	ZINC000853720835	JF	On-Demand	Anodyne	TGM2	40	42
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)CSCc3ccc(F)cc3)CC2)cc1	ZINC000853720835	JF	On-Demand	Anodyne	F13A1	45	42
CC(C)(C)OC(=O)N1CCC(C(=N)NOCC2CC=CC2)CC1	ZINC000853720855	DG	On-Demand	Anodyne	GPR119	38	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCc1ccccc1F	ZINC000853720861	GG	On-Demand	Anodyne	AMP1_PLAFQ	29	40
O=C(NOCCOCc1ccccc1)C1CC1	ZINC000853720865	BD	On-Demand	Anodyne	LTA4H	25	40
O=C(NOCCOCc1ccccc1)C1CC1	ZINC000853720865	BD	On-Demand	Anodyne	UGCG	20	40
O=C(NOCCOCc1ccccc1)C1CC1	ZINC000853720865	BD	On-Demand	Anodyne	F11	40	36
O=C(NOCCOCc1ccccc1)C1CC1	ZINC000853720865	BD	On-Demand	Anodyne	GBA2	28	40
O=C(NOCCOCc1ccccc1)C1CC1	ZINC000853720865	BD	On-Demand	Anodyne	NAAA	33	43
CS(=O)(=O)N1CC[C@@H](COc2cccc(OCC#N)c2)C1	ZINC000853720875	DD	On-Demand	Mild	CHRNA10	55	40
CS(=O)(=O)N1CC[C@H](COc2cccc(OCC#N)c2)C1	ZINC000853720876	DD	On-Demand	Mild	CHRNA10	55	40
CC(C)(C)OC(=O)N1CCC(C(=N)NOCC2C[C@H]3C[C@@H]3C2)CC1	ZINC000853720878	EG	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC(C(=N)NOCC2C[C@@H]3C[C@H]3C2)CC1	ZINC000853720879	EG	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1CCC(C(=N)NOC[C@H]2C[C@@H]3C[C@@H]3C2)CC1	ZINC000853720880	EG	On-Demand	Anodyne	GPR119	31	40
Cc1ccccc1CN1CCC(NC(=O)COc2cccc(OCC#N)c2)CC1	ZINC000853720890	GG	On-Demand	Mild	DRD4	23	53
Cc1ccccc1CN1CCC(NC(=O)COc2cccc(OCC#N)c2)CC1	ZINC000853720890	GG	On-Demand	Mild	SIGMAR1	19	49
Cc1ccccc1CN1CCC(NC(=O)COc2cccc(OCC#N)c2)CC1	ZINC000853720890	GG	On-Demand	Mild	SSTR5	44	36
Cc1ccccc1CN1CCC(NC(=O)COc2cccc(OCC#N)c2)CC1	ZINC000853720890	GG	On-Demand	Mild	CCR3	34	43
Cc1ccccc1CN1CCC(NC(=O)COc2cccc(OCC#N)c2)CC1	ZINC000853720890	GG	On-Demand	Mild	MCHR1	30	55
Cc1ccccc1CN1CCC(NC(=O)COc2cccc(OCC#N)c2)CC1	ZINC000853720890	GG	On-Demand	Mild	CCR8	17	45
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2cccnc2N)CC1	ZINC000853720891	EE	On-Demand	Anodyne	GRIN2B	22	43
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2cccnc2N)CC1	ZINC000853720891	EE	On-Demand	Anodyne	GPR119	55	47
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N(C)Cc1nc2ccccc2s1	ZINC000853720894	II	On-Demand	Anodyne	TMPRSS6	43	32
COC[C@@H](COc1cccc(OCC#N)c1)OC	ZINC000853720902	CD	On-Demand	Mild	PDS	45	35
N#Cc1cccc(S(=O)(=O)NCC(=O)OCC(=O)NCc2ccccc2Cn2cccn2)c1	ZINC000853720905	JC	On-Demand	Mild	PTGER3	21	48
CCn1ncnc1CONC(=N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853720906	FD	On-Demand	Anodyne	GPR119	47	43
CCCOc1cccc(COc2cccc(OCC#N)c2)c1	ZINC000853720908	CH	On-Demand	Mild	MAOB	42	46
CCCOc1cccc(COc2cccc(OCC#N)c2)c1	ZINC000853720908	CH	On-Demand	Mild	FFAR1	15	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	SSTR2	55	36
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	EDNRA	29	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	TACR1	31	53
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MC4R	36	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	NQO2	16	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	CCKAR	100	52
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MPO	85	38
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	BRS3	31	47
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	NMBR	31	52
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MC3R	58	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MC5R	52	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MTNR1A	17	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MMP2	24	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MMP8	34	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MMP14	20	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	GRPR	60	33
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	ECE1	48	37
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MMP11	75	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	CCKBR	65	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	GHSR	61	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MMP9	22	42
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	MC1R	75	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853720913	HH	On-Demand	Anodyne	KISS1R	75	38
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)Nc1cc(Cl)ccc1F	ZINC000853720915	GI	On-Demand	Anodyne	LEF	53	35
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2cncs2)CC1	ZINC000853720923	EF	On-Demand	Anodyne	GPR119	45	41
N#CCOc1cccc(OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853720927	BG	On-Demand	Mild	CHRNA10	45	39
N#CCOc1cccc(OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853720928	BG	On-Demand	Mild	CHRNA10	45	39
N#CCOc1cccc(OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853720929	BG	On-Demand	Mild	CHRNA10	45	39
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2ncnn2CCF)CC1	ZINC000853720954	FD	On-Demand	Anodyne	GPR119	46	41
CCCOc1cccc(CONC(=O)C2CC2)c1	ZINC000853720957	BE	On-Demand	Anodyne	HRH2	29	43
CCCOc1cccc(CONC(=O)C2CC2)c1	ZINC000853720957	BE	On-Demand	Anodyne	MTNR1A	30	40
CCCOc1cccc(CONC(=O)C2CC2)c1	ZINC000853720957	BE	On-Demand	Anodyne	MTNR1B	23	40
CCCOc1cccc(CONC(=O)C2CC2)c1	ZINC000853720957	BE	On-Demand	Anodyne	FAAH	15	41
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853720966	JF	On-Demand	Anodyne	CA2	69	43
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853720966	JF	On-Demand	Anodyne	CA1	51	41
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853720966	JF	On-Demand	Anodyne	CA4	46	37
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853720966	JF	On-Demand	Anodyne	CA12	35	41
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1ccc(F)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853720966	JF	On-Demand	Anodyne	CA9	34	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853720967	JF	On-Demand	Anodyne	CA2	69	43
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853720967	JF	On-Demand	Anodyne	CA1	51	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853720967	JF	On-Demand	Anodyne	CA4	46	37
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853720967	JF	On-Demand	Anodyne	CA12	35	41
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853720967	JF	On-Demand	Anodyne	CA9	34	41
COc1cccc(SCCONC(=O)C2CC2)c1	ZINC000853720983	CE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(SCCONC(=O)C2CC2)c1	ZINC000853720983	CE	On-Demand	Anodyne	NQO2	17	41
COc1cccc(SCCONC(=O)C2CC2)c1	ZINC000853720983	CE	On-Demand	Anodyne	MTNR1A	57	60
COc1cccc(SCCONC(=O)C2CC2)c1	ZINC000853720983	CE	On-Demand	Anodyne	MTNR1B	55	60
O=C(NOC[C@@H]1CC[C@@H](c2ccccc2)C1)C1CC1	ZINC000853721012	CG	On-Demand	Anodyne	VCP	54	36
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000853721030	HE	On-Demand	Anodyne	P2RX3	25	44
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000853721030	HE	On-Demand	Anodyne	AKT1	28	44
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2cn(C(C)(C)C)nn2)CC1	ZINC000853721035	GF	On-Demand	Anodyne	GPR119	44	41
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2csc(Cl)n2)CC1	ZINC000853721043	FG	On-Demand	Anodyne	GPR119	43	39
CCC(CC)COc1cccc(OCC#N)c1	ZINC000853721044	BG	On-Demand	Mild	PDS	71	39
CCCCC[C@@H](C)NC(=O)Cn1ccc(=O)c(OCc2ccccc2)c1C	ZINC000853721070	FH	On-Demand	Anodyne	CAPN2	45	37
N#CCOc1cccc(OCCOCCO)c1	ZINC000853721071	BC	On-Demand	Mild	UPP1	43	33
N#CCOc1cccc(OCC2CC=CC2)c1	ZINC000853721075	BF	On-Demand	Mild	CHRNA10	46	40
C[C@@H](OC(=O)CSCc1ccc(F)cc1)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853721086	IG	On-Demand	Anodyne	MC4R	60	42
CC(C)n1ncnc1CONC(=N)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853721096	FF	On-Demand	Anodyne	GPR119	50	42
CC(C)(C)OC(=O)N1CCC(C(=N)NOCc2cc(C3CC3)no2)CC1	ZINC000853721113	FG	On-Demand	Anodyne	GPR119	45	40
N#Cc1cccc(S(=O)(=O)NCC(=O)OCC(=O)NC(C2CC2)C2CC2)c1	ZINC000853721127	GC	On-Demand	Mild	ITGA4	49	30
O=C(NOCC[C@H]1CCc2ccccc21)C1CC1	ZINC000853721138	BF	On-Demand	Anodyne	MTNR1A	20	41
O=C(NOCC[C@@H]1CCc2ccccc21)C1CC1	ZINC000853721139	BF	On-Demand	Anodyne	MTNR1A	20	41
C[C@@H](NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721256	GH	On-Demand	Anodyne	PRCP	20	43
C[C@@H](NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721256	GH	On-Demand	Anodyne	UTS2	45	37
C[C@H](NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721257	GH	On-Demand	Anodyne	PRCP	20	43
C[C@H](NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721257	GH	On-Demand	Anodyne	UTS2	45	37
C[C@@H](NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721258	GH	On-Demand	Anodyne	PRCP	20	43
C[C@@H](NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721258	GH	On-Demand	Anodyne	UTS2	45	37
C[C@H](NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721259	GH	On-Demand	Anodyne	PRCP	20	43
C[C@H](NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C)c1ccc(Cl)cc1	ZINC000853721259	GH	On-Demand	Anodyne	UTS2	45	37
COC(=O)C1CCN(C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853721260	FD	On-Demand	Anodyne	SFRP1	75	39
COC(=O)C1CCN(C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853721260	FD	On-Demand	Anodyne	WNT3	55	39
COC(=O)C1CCN(C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853721260	FD	On-Demand	Anodyne	PTR1	45	33
COC(=O)C1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853721261	FD	On-Demand	Anodyne	SFRP1	75	39
COC(=O)C1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853721261	FD	On-Demand	Anodyne	WNT3	55	39
COC(=O)C1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853721261	FD	On-Demand	Anodyne	PTR1	45	33
COCCN(CCF)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853721270	FE	On-Demand	Anodyne	HCN1	58	38
COCCN(CCF)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853721270	FE	On-Demand	Anodyne	HCN4	54	36
CCCCC[C@@H](C)NC(=O)Cn1c(=O)c(=O)n(CC)c2ccccc21	ZINC000853721298	EE	On-Demand	Anodyne	CNR2	21	40
CCCCC[C@@H](C)NC(=O)Cn1c(=O)c(=O)n(CC)c2ccccc21	ZINC000853721298	EE	On-Demand	Anodyne	NOD1	51	35
CC(C)(C)OC(=O)N1CC[C@@H](CCn2c(=O)ccn2-c2ccccn2)C1	ZINC000853721313	FF	On-Demand	Anodyne	GPR119	48	56
CC(C)(C)OC(=O)N1CC[C@H](CCn2c(=O)ccn2-c2ccccn2)C1	ZINC000853721314	FF	On-Demand	Anodyne	GPR119	48	56
CCn1c(=O)c(=O)n(CCCCCCO)c2ccccc21	ZINC000853721322	CD	On-Demand	Anodyne	CNR2	20	41
Cc1cccc(CNC(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)c1	ZINC000853721328	EF	On-Demand	Anodyne	FBP1	23	51
Cc1cccc(CNC(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)c1	ZINC000853721328	EF	On-Demand	Anodyne	LIMK2	20	42
Cc1cccc(CNC(=O)CN=[S@](=O)(c2ccccc2)N(C)C)c1	ZINC000853721329	EF	On-Demand	Anodyne	FBP1	23	51
Cc1cccc(CNC(=O)CN=[S@](=O)(c2ccccc2)N(C)C)c1	ZINC000853721329	EF	On-Demand	Anodyne	LIMK2	20	42
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c2cccc(C#N)c2)CC1	ZINC000853721341	HB	On-Demand	Mild	TRY2_BOVIN	59	35
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2cccc(C#N)c2)CC1	ZINC000853721342	HB	On-Demand	Mild	TRY2_BOVIN	59	35
C[C@@H]1CCCCN1C(=O)COc1nnc2c(N)c(Cl)ncn12	ZINC000853721358	DD	On-Demand	Anodyne	CPT1A	97	37
C[C@H]1CCCCN1C(=O)COc1nnc2c(N)c(Cl)ncn12	ZINC000853721359	DD	On-Demand	Anodyne	CPT1A	97	37
COC(=O)C1CCN(C(=O)COc2nnc3c(N)c(Cl)ncn23)CC1	ZINC000853721369	FC	On-Demand	Anodyne	PTR1	46	33
CCn1c(=O)c(=O)n(CCOc2ccc(C)cc2)c2ccccc21	ZINC000853721411	DF	On-Demand	Anodyne	LTA4H	43	39
CCn1c(=O)c(=O)n(CCOc2ccc(C)cc2)c2ccccc21	ZINC000853721411	DF	On-Demand	Anodyne	HRH3	15	44
Cc1ccc(CNC(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721453	EF	On-Demand	Anodyne	CA5B	17	44
Cc1ccc(CNC(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721453	EF	On-Demand	Anodyne	CA5A	20	44
Cc1ccc(CNC(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721453	EF	On-Demand	Anodyne	FBP1	19	43
Cc1ccc(CNC(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721453	EF	On-Demand	Anodyne	CACNA1G	18	40
Cc1ccc(CNC(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721457	EF	On-Demand	Anodyne	CA5B	17	44
Cc1ccc(CNC(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721457	EF	On-Demand	Anodyne	CA5A	20	44
Cc1ccc(CNC(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721457	EF	On-Demand	Anodyne	FBP1	19	43
Cc1ccc(CNC(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721457	EF	On-Demand	Anodyne	CACNA1G	18	40
C[C@@H](ON=Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853721458	JI	On-Demand	Mild	LTA4H	15	49
C[C@@H](ON=Cc1ccc(N2CCOCC2)cc1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853721458	JI	On-Demand	Mild	STAT6	44	35
CCCCCCn1c(=O)c(=O)n(CC)c2ccccc21	ZINC000853721488	CF	On-Demand	Anodyne	CNR1	22	47
CCCCCCn1c(=O)c(=O)n(CC)c2ccccc21	ZINC000853721488	CF	On-Demand	Anodyne	CNR2	36	47
CCCCCCn1c(=O)c(=O)n(CC)c2ccccc21	ZINC000853721488	CF	On-Demand	Anodyne	FAAH	15	41
CCCCCCn1c(=O)c(=O)n(CC)c2ccccc21	ZINC000853721488	CF	On-Demand	Anodyne	OXER1	67	40
CCn1c(=O)c(=O)n(Cc2cccc(NC(=O)OC(C)(C)C)c2)c2ccccc21	ZINC000853721527	GH	On-Demand	Anodyne	PLA2G2A	41	34
CCn1c(=O)c(=O)n(CC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000853721560	GF	On-Demand	Anodyne	CCR8	21	41
CCn1c(=O)c(=O)n(CC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000853721560	GF	On-Demand	Anodyne	GPR119	51	44
CCn1c(=O)c(=O)n(CC2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc21	ZINC000853721560	GF	On-Demand	Anodyne	SFRP1	23	42
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853721575	JD	On-Demand	Mild	DRD4	27	46
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853721575	JD	On-Demand	Mild	SIGMAR1	22	42
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853721575	JD	On-Demand	Mild	CCR3	37	43
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853721575	JD	On-Demand	Mild	ITGA4	50	32
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853721575	JD	On-Demand	Mild	MLNR	23	40
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853721575	JD	On-Demand	Mild	MCHR1	25	42
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853721577	JD	On-Demand	Mild	DRD4	27	46
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853721577	JD	On-Demand	Mild	SIGMAR1	22	42
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853721577	JD	On-Demand	Mild	CCR3	37	43
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853721577	JD	On-Demand	Mild	ITGA4	50	32
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853721577	JD	On-Demand	Mild	MLNR	23	40
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853721577	JD	On-Demand	Mild	MCHR1	25	42
O=C(Cn1c(=O)ccn1-c1ccccn1)NC1CCCCCCC1	ZINC000853721593	EE	On-Demand	Anodyne	EPHX2	24	41
CN(CCNC(=O)NNc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000853721599	DD	On-Demand	Reactive	SLC27A4	42	30
CCn1c(=O)c(=O)n(CCCOc2ccc(C#N)cc2)c2ccccc21	ZINC000853721603	EF	On-Demand	Mild	ADORA2B	19	40
CCn1c(=O)c(=O)n(CCCOc2ccc(C#N)cc2)c2ccccc21	ZINC000853721603	EF	On-Demand	Mild	HRH3	25	47
CCn1c(=O)c(=O)n(CCCOc2ccc(C#N)cc2)c2ccccc21	ZINC000853721603	EF	On-Demand	Mild	MEN1	43	42
CN(CCNC(=O)NNc1nc2ccc(Cl)cc2s1)CC(F)(F)F	ZINC000853721630	GG	On-Demand	Reactive	LCK	18	43
CN(CCNC(=O)NNc1nc2ccc(Cl)cc2s1)CC(F)(F)F	ZINC000853721630	GG	On-Demand	Reactive	CSNK1D	43	43
Nc1c(Cl)ncn2c(OCCCNC(=O)C3CCCC3)nnc12	ZINC000853721667	ED	On-Demand	Anodyne	SCNN1A	41	33
Nc1c(Cl)ncn2c(OCCCNC(=O)C3CCCC3)nnc12	ZINC000853721667	ED	On-Demand	Anodyne	TBK1	70	35
CCn1c(=O)c(=O)n(CC(=O)NC2CCCCCCC2)c2ccccc21	ZINC000853721682	FE	On-Demand	Anodyne	CNR1	27	47
CCn1c(=O)c(=O)n(CC(=O)NC2CCCCCCC2)c2ccccc21	ZINC000853721682	FE	On-Demand	Anodyne	OPRL1	16	45
CCn1c(=O)c(=O)n(CC(=O)NC2CCCCCCC2)c2ccccc21	ZINC000853721682	FE	On-Demand	Anodyne	AVPR1B	27	42
CCn1c(=O)c(=O)n(CC(=O)NC2CCCCCCC2)c2ccccc21	ZINC000853721682	FE	On-Demand	Anodyne	CNR2	39	47
CCn1c(=O)c(=O)n(CC(=O)NC2CCCCCCC2)c2ccccc21	ZINC000853721682	FE	On-Demand	Anodyne	SIGMAR1	15	41
CCn1c(=O)c(=O)n(CC(=O)NC2CCCCCCC2)c2ccccc21	ZINC000853721682	FE	On-Demand	Anodyne	EPHX2	29	47
C[C@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853721696	DE	On-Demand	Anodyne	WNT3	41	35
C[C@@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853721697	DE	On-Demand	Anodyne	WNT3	41	35
C[C@@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853721703	DE	On-Demand	Anodyne	WNT3	41	35
C[C@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853721704	DE	On-Demand	Anodyne	WNT3	41	35
COC(=O)c1cccc(NNC(=O)NCCN2CCSCC2)c1C	ZINC000853721732	FD	On-Demand	Reactive	DRD4	43	34
Nc1c(Cl)ncn2c(OCC(=O)NCCCc3ccccc3)nnc12	ZINC000853721735	FD	On-Demand	Anodyne	SCNN1A	83	42
COc1ccc(OCCCN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721745	EG	On-Demand	Anodyne	FDPS	21	41
COc1ccc(OCCCN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721745	EG	On-Demand	Anodyne	LTA4H	21	43
COc1ccc(OCCCN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721745	EG	On-Demand	Anodyne	ESRRG	42	31
COc1ccc(OCCCN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721748	EG	On-Demand	Anodyne	FDPS	21	41
COc1ccc(OCCCN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721748	EG	On-Demand	Anodyne	LTA4H	21	43
COc1ccc(OCCCN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853721748	EG	On-Demand	Anodyne	ESRRG	42	31
Nc1c(Cl)ncn2c(OCC[C@H]3CCCCO3)nnc12	ZINC000853721772	CD	On-Demand	Anodyne	PDE8B	41	33
Nc1c(Cl)ncn2c(OCC[C@@H]3CCCCO3)nnc12	ZINC000853721774	CD	On-Demand	Anodyne	PDE8B	41	33
C[C@H](NC(=O)c1ccccc1NC(=O)CON=Cc1ccc(N2CCOCC2)cc1)c1ccccc1	ZINC000853721780	JI	On-Demand	Mild	KCNQ2	17	47
C[C@@H](NC(=O)c1ccccc1NC(=O)CON=Cc1ccc(N2CCOCC2)cc1)c1ccccc1	ZINC000853721781	JI	On-Demand	Mild	KCNQ2	17	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCC2)CC1	ZINC000853721813	FD	On-Demand	Anodyne	DRD4	22	53
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCC2)CC1	ZINC000853721813	FD	On-Demand	Anodyne	SLC6A1	48	34
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCC2)CC1	ZINC000853721813	FD	On-Demand	Anodyne	SIGMAR1	22	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCC2)CC1	ZINC000853721813	FD	On-Demand	Anodyne	CCR2	16	47
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCC2)CC1	ZINC000853721813	FD	On-Demand	Anodyne	EPHX2	18	41
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCC2)CC1	ZINC000853721813	FD	On-Demand	Anodyne	MCHR1	24	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=O)C2CCC2)CC1	ZINC000853721813	FD	On-Demand	Anodyne	CCR8	33	40
CCCCCNC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853721857	DE	On-Demand	Anodyne	ASAH1	65	35
CCCCCNC(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853721859	DE	On-Demand	Anodyne	ASAH1	65	35
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721905	FD	On-Demand	Anodyne	BIRC2	20	43
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721905	FD	On-Demand	Anodyne	SFRP1	58	36
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721908	FD	On-Demand	Anodyne	BIRC2	20	43
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721908	FD	On-Demand	Anodyne	SFRP1	58	36
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721909	FD	On-Demand	Anodyne	BIRC2	20	43
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721909	FD	On-Demand	Anodyne	SFRP1	58	36
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721910	FD	On-Demand	Anodyne	BIRC2	20	43
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)C1	ZINC000853721910	FD	On-Demand	Anodyne	SFRP1	58	36
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853721912	JD	On-Demand	Mild	SLC6A9	19	40
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853721939	FF	On-Demand	Anodyne	ACE	15	42
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853721939	FF	On-Demand	Anodyne	DRD4	27	47
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853721939	FF	On-Demand	Anodyne	TPP2	44	34
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853721945	FF	On-Demand	Anodyne	ACE	15	42
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853721945	FF	On-Demand	Anodyne	DRD4	27	47
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853721945	FF	On-Demand	Anodyne	TPP2	44	34
COc1cccc(OCCN=[S@](=O)(c2ccccc2)N(C)C)c1	ZINC000853721954	EG	On-Demand	Anodyne	MTNR1B	17	42
COc1cccc(OCCN=[S@@](=O)(c2ccccc2)N(C)C)c1	ZINC000853721959	EG	On-Demand	Anodyne	MTNR1B	17	42
Cn1c(S)nnc1CCNC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853722056	GD	On-Demand	Anodyne	HCN1	57	35
Cn1c(S)nnc1CCNC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853722056	GD	On-Demand	Anodyne	HCN4	54	35
CCCOc1cccc(CONC(=O)C2CCC2)c1	ZINC000853722153	CF	On-Demand	Anodyne	HRH2	33	44
CCCOc1cccc(CONC(=O)C2CCC2)c1	ZINC000853722153	CF	On-Demand	Anodyne	MTNR1A	24	46
CCCOc1cccc(CONC(=O)C2CCC2)c1	ZINC000853722153	CF	On-Demand	Anodyne	FAAH	18	42
CC(C)(C)OC(=O)N1CCC(COc2nnc3c(N)c(Cl)ncn23)CC1	ZINC000853722167	GE	On-Demand	Anodyne	GPR119	47	41
CCCOc1cccc(COc2nnc3c(N)c(Cl)ncn23)c1	ZINC000853722187	EF	On-Demand	Anodyne	DRTS_LEIMA	43	35
C=C(Cl)Cn1c2c(c(=O)c3cc(OC)ccc31)CCCC2	ZINC000853722191	DH	On-Demand	Mild	SCARB1	63	37
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCC1	ZINC000853722197	DD	On-Demand	Anodyne	SLC6A1	68	36
O=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)C1CCC1	ZINC000853722197	DD	On-Demand	Anodyne	L3MBTL3	81	40
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCC1	ZINC000853722198	DD	On-Demand	Anodyne	SLC6A1	68	36
O=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)C1CCC1	ZINC000853722198	DD	On-Demand	Anodyne	L3MBTL3	81	40
CCOC(=O)N1CCN(C(=O)[C@H](C)N=[S@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853722261	GD	On-Demand	Anodyne	P2RY12	165	39
CCOC(=O)N1CCN(C(=O)[C@H](C)N=[S@@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853722262	GD	On-Demand	Anodyne	P2RY12	165	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)N=[S@@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853722263	GD	On-Demand	Anodyne	P2RY12	165	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)N=[S@](=O)(c2ccccc2)N(C)C)CC1	ZINC000853722264	GD	On-Demand	Anodyne	P2RY12	165	39
CN(CC1CCCCC1)C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853722311	FG	On-Demand	Anodyne	AMY2	44	31
CN(CC1CCCCC1)C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853722312	FG	On-Demand	Anodyne	AMY2	44	31
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853722319	GH	On-Demand	Anodyne	UTS2	45	35
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853722320	GH	On-Demand	Anodyne	UTS2	45	35
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853722321	GH	On-Demand	Anodyne	UTS2	45	35
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853722322	GH	On-Demand	Anodyne	UTS2	45	35
Nc1c(Cl)ncn2c(OCC(=O)N3CCC[C@H]4CCCC[C@H]43)nnc12	ZINC000853722358	FD	On-Demand	Anodyne	CPT1A	65	35
Nc1c(Cl)ncn2c(OCC(=O)N3CCC[C@H]4CCCC[C@@H]43)nnc12	ZINC000853722362	FD	On-Demand	Anodyne	CPT1A	65	35
Nc1c(Cl)ncn2c(OCC(=O)N3CCC[C@@H]4CCCC[C@@H]43)nnc12	ZINC000853722365	FD	On-Demand	Anodyne	CPT1A	65	35
Nc1c(Cl)ncn2c(OCC(=O)N3CCC[C@@H]4CCCC[C@H]43)nnc12	ZINC000853722367	FD	On-Demand	Anodyne	CPT1A	65	35
O=C(NCC1(N2CCSCC2)CCCCC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853722385	GD	On-Demand	Anodyne	SMO	16	40
O=C(NCC1(N2CCSCC2)CCCCC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853722385	GD	On-Demand	Anodyne	HCN1	53	36
O=C(NCC1(N2CCSCC2)CCCCC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853722385	GD	On-Demand	Anodyne	HCN4	51	36
O=C(NCC1(N2CCSCC2)CCCCC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853722387	GD	On-Demand	Anodyne	SMO	16	40
O=C(NCC1(N2CCSCC2)CCCCC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853722387	GD	On-Demand	Anodyne	HCN1	53	36
O=C(NCC1(N2CCSCC2)CCCCC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853722387	GD	On-Demand	Anodyne	HCN4	51	36
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	BMP1	70	40
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	MMP13	42	43
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	ADAM17	15	41
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	MMP2	23	43
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	MMP3	32	43
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	MMP8	24	43
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	MMP9	45	43
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	MMP12	29	42
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	MMP1	40	43
COc1ccc(CN(C)C(=O)CN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722393	GF	On-Demand	Anodyne	LIMK2	23	41
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	BMP1	70	40
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	MMP13	42	43
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	ADAM17	15	41
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	MMP2	23	43
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	MMP3	32	43
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	MMP8	24	43
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	MMP9	45	43
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	MMP12	29	42
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	MMP1	40	43
COc1ccc(CN(C)C(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853722395	GF	On-Demand	Anodyne	LIMK2	23	41
CCn1c(=O)c(=O)n(CCC2CCOCC2)c2ccccc21	ZINC000853722422	DD	On-Demand	Anodyne	CNR2	15	49
Nc1c(Cl)ncn2c(OC[C@@H]3CN(Cc4ccccc4)CCCO3)nnc12	ZINC000853722460	GE	On-Demand	Anodyne	DRD4	15	49
CC(C)(C)OC(=O)N1CCC(C(=N)NOCCc2ccc(C#N)cc2)CC1	ZINC000853722461	FG	On-Demand	Mild	GPR119	45	44
Nc1c(Cl)ncn2c(OC[C@H]3CN(Cc4ccccc4)CCCO3)nnc12	ZINC000853722463	GE	On-Demand	Anodyne	DRD4	15	49
CON(C)CCNC(=O)NCCc1ccc(F)cc1F	ZINC000853722470	CD	On-Demand	Anodyne	MTNR1A	54	42
N#Cc1cn(CCCNC(=O)C2CCCC2)nc1I	ZINC000853722487	FE	On-Demand	Mild	TBK1	61	34
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NCCc2ccc(F)cc2F)C3)cn1	ZINC000853722575	GE	On-Demand	Anodyne	HTR2A	15	40
CON(C)CCNC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853722583	ED	On-Demand	Anodyne	HCN1	75	42
CON(C)CCNC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853722583	ED	On-Demand	Anodyne	HCN4	62	40
C[C@H](NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C)C(=O)N1CCCCC1	ZINC000853722725	GD	On-Demand	Anodyne	DPP7	47	37
C[C@@H](NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C)C(=O)N1CCCCC1	ZINC000853722727	GD	On-Demand	Anodyne	DPP7	47	37
C[C@H](NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C)C(=O)N1CCCCC1	ZINC000853722728	GD	On-Demand	Anodyne	DPP7	47	37
C[C@@H](NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C)C(=O)N1CCCCC1	ZINC000853722729	GD	On-Demand	Anodyne	DPP7	47	37
CN(Cc1ccc(F)cc1)C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853722749	FF	On-Demand	Anodyne	LIMK2	23	45
CN(Cc1ccc(F)cc1)C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853722750	FF	On-Demand	Anodyne	LIMK2	23	45
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC000853722766	JD	On-Demand	Mild	ITGA4	43	31
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853722787	JF	On-Demand	Mild	ITGA4	51	34
CCn1c(=O)c(=O)n(CCOc2ccccc2C)c2ccccc21	ZINC000853722825	DF	On-Demand	Anodyne	PLA2G2A	22	40
COc1ccc(N2CCN(C(=O)Cn3c(=O)ccn3-c3ccccn3)CC2)cc1	ZINC000853722829	GD	On-Demand	Clean	HTR1A	19	42
COc1ccc(N2CCN(C(=O)Cn3c(=O)ccn3-c3ccccn3)CC2)cc1	ZINC000853722829	GD	On-Demand	Clean	EBP	19	42
O=C(CON=Cc1ccc(N2CCOCC2)cc1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853722867	JD	On-Demand	Mild	TGM2	47	34
O=C(CON=Cc1ccc(N2CCOCC2)cc1)N1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853722867	JD	On-Demand	Mild	F13A1	62	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=O)C2CCC2)CC1	ZINC000853722962	EC	On-Demand	Anodyne	P2RY12	44	39
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=O)C2CCC2)CC1	ZINC000853722964	EC	On-Demand	Anodyne	P2RY12	44	39
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3cccc(O)c3)C2)cc1	ZINC000853723063	FG	On-Demand	Clean	MTNR1A	17	48
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)c3cccc(O)c3)C2)cc1	ZINC000853723063	FG	On-Demand	Clean	MTNR1B	19	48
COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3cccc(O)c3)C2)cc1	ZINC000853723066	FG	On-Demand	Clean	MTNR1A	17	48
COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)c3cccc(O)c3)C2)cc1	ZINC000853723066	FG	On-Demand	Clean	MTNR1B	19	48
CCCOc1cccc(CNC(=O)COc2nnc3c(N)c(Cl)ncn23)c1	ZINC000853723069	GD	On-Demand	Anodyne	PDS	51	35
O=C(NOCc1cncs1)C1CCC1	ZINC000853723099	BD	On-Demand	Anodyne	CYP3A4	30	42
CN(CCNC(=O)NNc1nc2ccc(Cl)cc2s1)C1CC1	ZINC000853723113	EF	On-Demand	Reactive	LCK	23	44
CN(CCNC(=O)NNc1nc2ccc(Cl)cc2s1)C1CC1	ZINC000853723113	EF	On-Demand	Reactive	CSNK1D	42	44
CC[C@@](C)(NC(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1)C1CC1	ZINC000853723151	GE	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CCC(CCn2c(=O)ccn2-c2ccccn2)CC1	ZINC000853723174	FG	On-Demand	Anodyne	GRIN2B	22	42
CC(C)(C)OC(=O)N1CCC(CCn2c(=O)ccn2-c2ccccn2)CC1	ZINC000853723174	FG	On-Demand	Anodyne	GPR119	56	61
CC(C)c1ccccc1NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853723190	FH	On-Demand	Anodyne	SOAT1	41	39
CC(C)c1ccccc1NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853723192	FH	On-Demand	Anodyne	SOAT1	41	39
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853723199	GG	On-Demand	Anodyne	HCN1	69	40
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853723199	GG	On-Demand	Anodyne	HCN4	61	39
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853723201	GG	On-Demand	Anodyne	HCN1	69	40
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853723201	GG	On-Demand	Anodyne	HCN4	61	39
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853723204	GG	On-Demand	Anodyne	HCN1	69	40
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853723204	GG	On-Demand	Anodyne	HCN4	61	39
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853723207	GG	On-Demand	Anodyne	HCN1	69	40
O=C(NCC1(N2CCSCC2)CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853723207	GG	On-Demand	Anodyne	HCN4	61	39
CCn1c(=O)c(=O)n(CC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)c2ccccc21	ZINC000853723240	GF	On-Demand	Anodyne	GPR119	37	41
CCn1c(=O)c(=O)n(CC[C@H]2CCN(C(=O)OC(C)(C)C)C2)c2ccccc21	ZINC000853723242	GF	On-Demand	Anodyne	GPR119	37	41
Cc1ccncc1CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853723252	CF	On-Demand	Anodyne	NAMPT	15	46
Cc1ccncc1CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853723254	CF	On-Demand	Anodyne	NAMPT	15	46
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853723293	JD	On-Demand	Mild	CCKAR	16	42
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853723293	JD	On-Demand	Mild	NMBR	20	43
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853723293	JD	On-Demand	Mild	GRPR	56	32
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853723293	JD	On-Demand	Mild	ALOX15	19	45
COc1ccc(OCCN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853723314	EG	On-Demand	Anodyne	FDPS	18	40
COc1ccc(OCCN=[S@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853723314	EG	On-Demand	Anodyne	LTA4H	20	42
COc1ccc(OCCN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853723317	EG	On-Demand	Anodyne	FDPS	18	40
COc1ccc(OCCN=[S@@](=O)(c2ccccc2)N(C)C)cc1	ZINC000853723317	EG	On-Demand	Anodyne	LTA4H	20	42
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2nnc3c(N)c(Cl)ncn23)C1	ZINC000853723396	GE	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1CC[C@H](CCOc2nnc3c(N)c(Cl)ncn23)C1	ZINC000853723397	GE	On-Demand	Anodyne	GPR119	34	40
C#CCOCCn1c2c(c(=O)c3cc(OC)ccc31)CCCC2	ZINC000853723495	DF	On-Demand	Mild	SCARB1	80	38
Nc1c(Cl)ncn2c(OCCCN3CCCCC3)nnc12	ZINC000853723507	DD	On-Demand	Anodyne	HRH3	44	39
Nc1c(Cl)ncn2c(OCCCN3CCCCC3)nnc12	ZINC000853723507	DD	On-Demand	Anodyne	HNMT	40	34
O=C(NCCN1CCSCC1)NNc1cc(F)cc(Cl)c1	ZINC000853723521	EE	On-Demand	Reactive	CACNA1H	25	43
C[C@@H]1Cc2ccccc2N1C(=O)COc1nnc2c(N)c(Cl)ncn12	ZINC000853723543	FD	On-Demand	Anodyne	DRD4	24	44
C[C@@H]1Cc2ccccc2N1C(=O)COc1nnc2c(N)c(Cl)ncn12	ZINC000853723543	FD	On-Demand	Anodyne	TPP2	62	36
CCCOc1cccc(CNC(=O)CN=[S@](=O)(c2ccccc2)N(C)C)c1	ZINC000853723579	GG	On-Demand	Anodyne	PDS	76	39
CCCOc1cccc(CNC(=O)CN=[S@@](=O)(c2ccccc2)N(C)C)c1	ZINC000853723582	GG	On-Demand	Anodyne	PDS	76	39
CCn1c(=O)c(=O)n(CC(=O)Nc2ccc(N3CCCC3)cc2)c2ccccc21	ZINC000853723585	GE	On-Demand	Anodyne	KCNQ2	63	52
CCn1c(=O)c(=O)n(CC(=O)Nc2ccc(N3CCCC3)cc2)c2ccccc21	ZINC000853723585	GE	On-Demand	Anodyne	PRNP	43	45
CCn1c(=O)c(=O)n(CC(=O)Nc2ccc(N3CCCC3)cc2)c2ccccc21	ZINC000853723585	GE	On-Demand	Anodyne	CALCRL	28	40
Cc1cccc(C(C)C)c1NC(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853723608	FI	On-Demand	Anodyne	SOAT1	51	41
Cc1cccc(C(C)C)c1NC(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853723610	FI	On-Demand	Anodyne	SOAT1	51	41
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853723657	JE	On-Demand	Mild	ITGA4	51	33
CCOC(=O)N1CCN(C(=O)[C@H](C)n2c(=O)ccn2-c2ccccn2)CC1	ZINC000853723663	FC	On-Demand	Anodyne	P2RY12	176	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2c(=O)ccn2-c2ccccn2)CC1	ZINC000853723666	FC	On-Demand	Anodyne	P2RY12	176	39
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@H]1CCOc2ccccc21	ZINC000853723682	ID	On-Demand	Mild	BDKRB1	31	42
C[C@@H](OC(=O)CNS(=O)(=O)c1cccc(C#N)c1)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000853723686	ID	On-Demand	Mild	BDKRB1	31	42
C#CCCN(CCOC)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853723725	FE	On-Demand	Mild	HCN1	57	35
C#CCCN(CCOC)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000853723725	FE	On-Demand	Mild	HCN4	54	35
CCn1c(=O)c(=O)n(Cc2ccc3c(c2)COC3)c2ccccc21	ZINC000853723726	DE	On-Demand	Anodyne	MCHR2	42	38
CSc1ccc(NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c2cccc(C#N)c2)cc1	ZINC000853723733	IE	On-Demand	Mild	ITGA4	40	31
CSc1ccc(NC(=O)[C@H](C)OC(=O)CNS(=O)(=O)c2cccc(C#N)c2)cc1	ZINC000853723734	IE	On-Demand	Mild	ITGA4	40	31
O=C(NOCCOCc1ccccc1)C1CCC1	ZINC000853723757	BE	On-Demand	Anodyne	SLC6A1	20	41
O=C(NOCCOCc1ccccc1)C1CCC1	ZINC000853723757	BE	On-Demand	Anodyne	LTA4H	34	41
O=C(NOCCOCc1ccccc1)C1CCC1	ZINC000853723757	BE	On-Demand	Anodyne	NAAA	22	41
Nc1c(Cl)ncn2c(OCC(=O)N[C@H]3CCOc4ccccc43)nnc12	ZINC000853723805	FD	On-Demand	Anodyne	TRAR	45	40
Nc1c(Cl)ncn2c(OCC(=O)N[C@@H]3CCOc4ccccc43)nnc12	ZINC000853723806	FD	On-Demand	Anodyne	TRAR	45	40
CC(C)(C)OC(=O)N1CCC(CCOc2nnc3c(N)c(Cl)ncn23)CC1	ZINC000853723809	GF	On-Demand	Anodyne	GPR119	44	43
Nc1c(Cl)ncn2c(OCc3ccc(CN4CCCCC4)cc3)nnc12	ZINC000853723850	FF	On-Demand	Anodyne	HRH3	17	49
O=C(NCCc1nnc(S)n1C1CC1)NCCN1CCSCC1	ZINC000853723879	FC	On-Demand	Anodyne	PLD1	46	31
O=C(NCCc1nnc(S)n1C1CC1)NCCN1CCSCC1	ZINC000853723879	FC	On-Demand	Anodyne	PLD2	43	32
O=C(NCCN1CCSCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853723888	FF	On-Demand	Reactive	CSNK1D	37	42
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CHRM2	23	48
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CHRM1	23	48
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	ACE	47	38
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	DRD2	32	51
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	DRD4	56	51
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	ACHE	48	47
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	SLC6A1	52	39
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	SSTR2	31	40
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	DRD3	21	51
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	SLC6A3	17	42
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	KCNH2	18	45
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	HTR4	33	41
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CHRM3	34	48
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	LTA4H	29	44
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	TACR1	15	40
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	HRH3	19	40
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	SIGMAR1	63	58
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	SSTR5	63	40
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CACNA1B	19	43
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CCR3	39	43
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CCR5	33	45
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	EPHX2	24	46
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	MCHR1	54	50
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	XIAP	44	36
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CACNA1G	42	44
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	CCR8	23	43
C[C@@H](ONC(=O)C1CCC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853723909	FE	On-Demand	Anodyne	BIRC2	59	46
CCN(Cc1cccc(F)c1)C(=O)CN=[S@](=O)(c1ccccc1)N(C)C	ZINC000853723984	GG	On-Demand	Anodyne	LIMK2	19	42
CCN(Cc1cccc(F)c1)C(=O)CN=[S@@](=O)(c1ccccc1)N(C)C	ZINC000853723987	GG	On-Demand	Anodyne	LIMK2	19	42
CO[C@@H](COc1ccc(Cl)cc1C(=O)c1ccccc1)[C@@H]1CCOC1	ZINC000853724094	FI	On-Demand	Anodyne	PTGER1	45	36
CO[C@@H](COc1ccc(Cl)cc1C(=O)c1ccccc1)[C@H]1CCOC1	ZINC000853724105	FI	On-Demand	Anodyne	PTGER1	45	36
C#CCN1CCN(C(=O)COc2cc(-c3ccccc3)nc3ccnn23)CC1	ZINC000853724116	GD	On-Demand	Mild	CPT1A	41	33
O=C(Cn1c(=O)ccn1-c1ccccn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853724174	GD	On-Demand	Anodyne	PRNP	41	38
O=C(Cn1c(=O)ccn1-c1ccccn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853724174	GD	On-Demand	Anodyne	JAK2	15	43
O=C(Cn1c(=O)ccn1-c1ccccn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853724174	GD	On-Demand	Anodyne	PIK3CD	19	45
O=C(Cn1c(=O)ccn1-c1ccccn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853724174	GD	On-Demand	Anodyne	MTOR	54	39
O=C(Cn1c(=O)ccn1-c1ccccn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853724174	GD	On-Demand	Anodyne	PIK3CB	26	45
O=C(Cn1c(=O)ccn1-c1ccccn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853724174	GD	On-Demand	Anodyne	STAT6	75	37
O=C(Cn1c(=O)ccn1-c1ccccn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853724174	GD	On-Demand	Anodyne	DGAT1	15	40
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2c(=O)ccn2-c2ccccn2)CC1	ZINC000853724208	GG	On-Demand	Anodyne	ACACB	16	43
C=C(Cl)COc1ccc([C@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853724677	CG	On-Demand	Mild	CHRNA10	55	40
C=C(Cl)COc1ccc([C@@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853724678	CG	On-Demand	Mild	CHRNA10	55	40
COCCN(CCF)C(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000853724940	DH	On-Demand	Anodyne	CTSA	54	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724947	FE	On-Demand	Anodyne	P2RY12	45	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724947	FE	On-Demand	Anodyne	MC4R	45	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724947	FE	On-Demand	Anodyne	CCR1	42	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724947	FE	On-Demand	Anodyne	MC5R	15	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724948	FE	On-Demand	Anodyne	P2RY12	45	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724948	FE	On-Demand	Anodyne	MC4R	45	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724948	FE	On-Demand	Anodyne	CCR1	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(Cl)cc2OC)CC1	ZINC000853724948	FE	On-Demand	Anodyne	MC5R	15	42
COC[C@@H](COc1ccc([C@](C)(O)[C@H]2CCCN2C)cc1)OC	ZINC000853724949	DE	On-Demand	Anodyne	CHRNA10	47	38
COC[C@@H](COc1ccc([C@@](C)(O)[C@H]2CCCN2C)cc1)OC	ZINC000853724952	DE	On-Demand	Anodyne	CHRNA10	47	38
CO[C@@H](COc1ccc([C@@](C)(O)[C@H]2CCCN2C)cc1)C1CCC1	ZINC000853724995	EG	On-Demand	Anodyne	CHRNA10	43	34
CO[C@@H](COc1ccc([C@](C)(O)[C@H]2CCCN2C)cc1)C1CCC1	ZINC000853724996	EG	On-Demand	Anodyne	CHRNA10	43	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc3c(C)cccc3c2)CC1	ZINC000853725003	FF	On-Demand	Anodyne	P2RY12	132	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc3c(C)cccc3c2)CC1	ZINC000853725004	FF	On-Demand	Anodyne	P2RY12	132	39
CCOC(=O)c1c(CON=Cc2ccc(N3CCOCC3)cc2)nc2ccccc2c1C	ZINC000853725075	II	On-Demand	Mild	METAP1	27	41
CCOC(=O)c1c(CON=Cc2ccc(N3CCOCC3)cc2)nc2ccccc2c1C	ZINC000853725075	II	On-Demand	Mild	DGAT1	21	42
COC(=O)C1(COc2ccc([C@](C)(O)[C@H]3CCCN3C)cc2)CC1	ZINC000853725106	EE	On-Demand	Anodyne	CHRNA10	42	34
COC(=O)C1(COc2ccc([C@@](C)(O)[C@H]3CCCN3C)cc2)CC1	ZINC000853725107	EE	On-Demand	Anodyne	CHRNA10	42	34
C#CCOCCOc1ccc([C@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853725129	DE	On-Demand	Mild	HRH3	19	43
C#CCOCCOc1ccc([C@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853725129	DE	On-Demand	Mild	CHRNA10	40	34
C#CCOCCOc1ccc([C@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853725129	DE	On-Demand	Mild	PSMB1	34	40
C#CCOCCOc1ccc([C@@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853725130	DE	On-Demand	Mild	HRH3	19	43
C#CCOCCOc1ccc([C@@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853725130	DE	On-Demand	Mild	CHRNA10	40	34
C#CCOCCOc1ccc([C@@](C)(O)[C@H]2CCCN2C)cc1	ZINC000853725130	DE	On-Demand	Mild	PSMB1	34	40
CO[C@@H](COc1ccc([C@](C)(O)[C@H]2CCCN2C)cc1)C1CCCC1	ZINC000853725169	EH	On-Demand	Anodyne	CHRNA10	43	34
CO[C@@H](COc1ccc([C@@](C)(O)[C@H]2CCCN2C)cc1)C1CCCC1	ZINC000853725172	EH	On-Demand	Anodyne	CHRNA10	43	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(C)cc(Cl)cc2C#N)CC1	ZINC000853725245	GF	On-Demand	Mild	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(C)cc(Cl)cc2C#N)CC1	ZINC000853725246	GF	On-Demand	Mild	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nc3c(OC)cccn3c2=O)CC1	ZINC000853725299	GC	On-Demand	Anodyne	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nc3c(OC)cccn3c2=O)CC1	ZINC000853725301	GC	On-Demand	Anodyne	P2RY12	42	36
O=C(NC/C=C\c1ccccc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853725389	ED	On-Demand	Anodyne	L3MBTL3	49	35
O=C(NC/C=C\c1ccccc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853725391	ED	On-Demand	Anodyne	L3MBTL3	49	35
O=C(NC/C=C/c1ccccc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853725393	ED	On-Demand	Anodyne	L3MBTL3	49	35
O=C(NC/C=C/c1ccccc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853725394	ED	On-Demand	Anodyne	L3MBTL3	49	35
CCOC(=O)NOCc1cncs1	ZINC000853725417	BD	On-Demand	Anodyne	CYP3A4	41	45
C#CCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853725462	CG	On-Demand	Mild	LTA4H	30	40
C#CCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853725462	CG	On-Demand	Mild	HRH3	42	48
COC(=O)c1ccc(CN2[C@@H](C(=O)OC)CCS2(=O)=O)c(F)c1	ZINC000853725464	EC	On-Demand	Anodyne	GYS1	24	40
COC(=O)c1ccc(CN2[C@H](C(=O)OC)CCS2(=O)=O)c(F)c1	ZINC000853725465	EC	On-Demand	Anodyne	GYS1	24	40
COC(=O)[C@H]1CCS(=O)(=O)N1CCOc1cccc(F)c1	ZINC000853725466	DC	On-Demand	Anodyne	GYS1	28	41
COC(=O)[C@H]1CCS(=O)(=O)N1CCOc1cccc(F)c1	ZINC000853725466	DC	On-Demand	Anodyne	CHRNA10	54	45
COC(=O)[C@H]1CCS(=O)(=O)N1CC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853725494	GD	On-Demand	Anodyne	GPR119	25	44
COC(=O)[C@H]1CCS(=O)(=O)N1CC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853725496	GD	On-Demand	Anodyne	GPR119	25	44
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc2c(c1)COC2	ZINC000853725509	DC	On-Demand	Anodyne	GYS1	24	40
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(C(=O)C(F)(F)F)c1	ZINC000853725511	FD	On-Demand	Anodyne	GYS1	33	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccn3ccnc23)CC1	ZINC000853725522	ED	On-Demand	Anodyne	P2RY12	60	36
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccn3ccnc23)CC1	ZINC000853725523	ED	On-Demand	Anodyne	P2RY12	60	36
COCCS(=O)(=O)CCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853725525	GF	On-Demand	Anodyne	HRH2	30	41
COCCS(=O)(=O)CCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853725525	GF	On-Demand	Anodyne	HRH3	47	44
OC1(CCOc2ccc(CN3CCCC3)c(Cl)c2)CC1	ZINC000853725552	CG	On-Demand	Anodyne	HRH3	39	46
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853725558	GE	On-Demand	Anodyne	GYS1	25	41
CON(C)CCNC(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000853725613	DF	On-Demand	Anodyne	ANPEP	26	41
CON(C)CCNC(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000853725613	DF	On-Demand	Anodyne	PTGER3	15	40
CON(C)CCNC(=O)N[C@@H](CC(C)C)c1ccccc1C	ZINC000853725613	DF	On-Demand	Anodyne	CTSA	53	34
CON(C)CCNC(=O)N[C@H](CC(C)C)c1ccccc1C	ZINC000853725615	DF	On-Demand	Anodyne	ANPEP	26	41
CON(C)CCNC(=O)N[C@H](CC(C)C)c1ccccc1C	ZINC000853725615	DF	On-Demand	Anodyne	PTGER3	15	40
CON(C)CCNC(=O)N[C@H](CC(C)C)c1ccccc1C	ZINC000853725615	DF	On-Demand	Anodyne	CTSA	53	34
C=CCC1(NC(=O)NC2CCN(C(=O)OC(C)C)CC2)CCCC1	ZINC000853725734	EG	On-Demand	Mild	EPHX2	23	40
CCOC(=O)NOCc1c(F)cc([N+](=O)[O-])cc1F	ZINC000853725743	CE	On-Demand	Bother	CACNA1D	57	34
O=C(NC/C=C/c1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853725795	EF	On-Demand	Anodyne	L3MBTL3	78	40
O=C(NC/C=C\c1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853725796	EF	On-Demand	Anodyne	L3MBTL3	78	40
O=C(NC/C=C\c1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853725797	EF	On-Demand	Anodyne	L3MBTL3	78	40
O=C(NC/C=C/c1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853725798	EF	On-Demand	Anodyne	L3MBTL3	78	40
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(OC)c1	ZINC000853725819	CC	On-Demand	Anodyne	DRD4	42	33
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(OC)c1	ZINC000853725819	CC	On-Demand	Anodyne	MMP13	22	57
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(OC)c1	ZINC000853725819	CC	On-Demand	Anodyne	MTNR1A	45	41
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(OC)c1	ZINC000853725819	CC	On-Demand	Anodyne	MTNR1B	48	41
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(OC)c1	ZINC000853725819	CC	On-Demand	Anodyne	ROCK2	41	40
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(OC)c1	ZINC000853725819	CC	On-Demand	Anodyne	GYS1	37	52
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(OC)c1	ZINC000853725819	CC	On-Demand	Anodyne	CCR8	19	40
CCCCCNC(=O)CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853725827	FG	On-Demand	Anodyne	ASAH1	91	35
CCCCCNC(=O)CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853725828	FG	On-Demand	Anodyne	ASAH1	91	35
O=S1(=O)CCC(COc2ccc(CN3CCCC3)c(Cl)c2)CC1	ZINC000853725833	FG	On-Demand	Anodyne	SIGMAR1	15	47
O=S1(=O)CCC(COc2ccc(CN3CCCC3)c(Cl)c2)CC1	ZINC000853725833	FG	On-Demand	Anodyne	CHRNA10	47	42
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc([N+](=O)[O-])c1Br	ZINC000853725836	GD	On-Demand	Bother	COLA	51	32
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccnc1Cl	ZINC000853725849	DC	On-Demand	Anodyne	P2RX7	17	44
COC(=O)[C@H]1CCS(=O)(=O)N1CCOc1ccc(C)cc1	ZINC000853725886	DC	On-Demand	Anodyne	LTA4H	19	46
COC(=O)[C@H]1CCS(=O)(=O)N1CCOc1ccc(C)cc1	ZINC000853725886	DC	On-Demand	Anodyne	GYS1	28	43
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCC1	ZINC000853725927	EG	On-Demand	Anodyne	EPHX2	21	44
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCC1	ZINC000853725927	EG	On-Demand	Anodyne	SFRP1	100	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCC1	ZINC000853725927	EG	On-Demand	Anodyne	WNT3	69	33
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCC1	ZINC000853725928	EG	On-Demand	Anodyne	EPHX2	21	44
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCC1	ZINC000853725928	EG	On-Demand	Anodyne	SFRP1	100	33
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCC1	ZINC000853725928	EG	On-Demand	Anodyne	WNT3	69	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N(Cc1ccccc1)C1CC1	ZINC000853725960	GI	On-Demand	Anodyne	SFRP1	59	32
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N(Cc1ccccc1)C1CC1	ZINC000853725962	GI	On-Demand	Anodyne	SFRP1	59	32
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	HTR1A	21	60
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	HTR1D	66	60
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	HTR1B	42	60
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	NQO2	52	70
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	MPO	73	44
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	HTR1E	25	51
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	HTR5A	19	40
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	MTNR1A	135	83
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	MTNR1B	101	70
COc1ccc2[nH]cc(CCNC(=O)NCCN(C)OC)c2c1	ZINC000853725964	DD	On-Demand	Anodyne	ABCG2	29	49
CCCOc1cccc(CONC(=O)OCC)c1	ZINC000853725966	CF	On-Demand	Anodyne	HRH2	25	40
CCCOc1cccc(CONC(=O)OCC)c1	ZINC000853725966	CF	On-Demand	Anodyne	MAOB	30	40
CCCOc1cccc(CONC(=O)OCC)c1	ZINC000853725966	CF	On-Demand	Anodyne	PLA2G4B	36	41
CCCOc1cccc(CONC(=O)OCC)c1	ZINC000853725966	CF	On-Demand	Anodyne	FAAH	28	40
CCCOc1cccc(CONC(=O)OCC)c1	ZINC000853725966	CF	On-Demand	Anodyne	FFAR1	42	36
CCCOc1cccc(CONC(=O)OCC)c1	ZINC000853725966	CF	On-Demand	Anodyne	PDS	77	39
COc1cccc(C[C@@H](C)NC(=O)NCCc2nnc(S)n2C)c1	ZINC000853725968	ED	On-Demand	Anodyne	MTNR1A	44	41
COc1cccc(C[C@@H](C)NC(=O)NCCc2nnc(S)n2C)c1	ZINC000853725968	ED	On-Demand	Anodyne	MTNR1B	42	41
COc1cccc(C[C@H](C)NC(=O)NCCc2nnc(S)n2C)c1	ZINC000853725970	ED	On-Demand	Anodyne	MTNR1A	44	41
COc1cccc(C[C@H](C)NC(=O)NCCc2nnc(S)n2C)c1	ZINC000853725970	ED	On-Demand	Anodyne	MTNR1B	42	41
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3c(N)ncnc32)CC1	ZINC000853725985	EC	On-Demand	Anodyne	ADA	45	46
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3c(N)ncnc32)CC1	ZINC000853725985	EC	On-Demand	Anodyne	AHCY	81	44
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3c(N)ncnc32)CC1	ZINC000853725985	EC	On-Demand	Anodyne	OXGR1	105	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3c(N)ncnc32)CC1	ZINC000853725987	EC	On-Demand	Anodyne	ADA	45	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3c(N)ncnc32)CC1	ZINC000853725987	EC	On-Demand	Anodyne	AHCY	81	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3c(N)ncnc32)CC1	ZINC000853725987	EC	On-Demand	Anodyne	OXGR1	105	40
C#CCOCCn1cnc2c(N)ncnc21	ZINC000853725989	BC	On-Demand	Mild	AHCY	86	52
C#CCOCCn1cnc2c(N)ncnc21	ZINC000853725989	BC	On-Demand	Mild	HSP90B1	50	35
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCCCCC1	ZINC000853726061	EG	On-Demand	Anodyne	SFRP1	107	38
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCCCCC1	ZINC000853726061	EG	On-Demand	Anodyne	WNT3	75	38
CON(C)CCNC(=O)NCCc1cccc(F)c1F	ZINC000853726077	CD	On-Demand	Anodyne	MTNR1A	47	46
Cc1ccccc1[C@H](CC(C)C)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853726078	GI	On-Demand	Anodyne	CTSA	47	32
Cc1ccccc1[C@@H](CC(C)C)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853726079	GI	On-Demand	Anodyne	CTSA	47	32
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cc2cc(Cl)ccc2nc1Cl	ZINC000853726177	GF	On-Demand	Anodyne	GRM1	15	46
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1nc(C)c2ccccc2n1	ZINC000853726201	ED	On-Demand	Anodyne	ADAM17	21	44
O=[S@](=NCc1ccc2c(c1)OCCO2)(c1ccc(F)cc1)C(F)(F)F	ZINC000853726224	GI	On-Demand	Anodyne	PKM	36	47
O=[S@@](=NCc1ccc2c(c1)OCCO2)(c1ccc(F)cc1)C(F)(F)F	ZINC000853726225	GI	On-Demand	Anodyne	PKM	36	47
C#CCNC(=O)COc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853726242	DE	On-Demand	Mild	HRH2	31	40
C#CCNC(=O)COc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853726242	DE	On-Demand	Mild	HRH3	15	45
C#CCNC(=O)COc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853726242	DE	On-Demand	Mild	MCHR1	17	42
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853726244	GC	On-Demand	Anodyne	PIK3CA	43	39
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853726244	GC	On-Demand	Anodyne	MTOR	88	39
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853726244	GC	On-Demand	Anodyne	STAT6	42	32
COC(=O)[C@H]1CCS(=O)(=O)N1CC[C@@H](O)c1ccccc1	ZINC000853726248	DC	On-Demand	Anodyne	SLC6A3	58	39
COC(=O)[C@H]1CCS(=O)(=O)N1CC[C@H](O)c1ccccc1	ZINC000853726249	DC	On-Demand	Anodyne	SLC6A3	58	39
C#CCOCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853726255	CF	On-Demand	Mild	HRH3	32	45
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1c(C)nn(-c2ccccc2)c1Cl	ZINC000853726257	GD	On-Demand	Anodyne	P2RX7	15	42
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCCCCC1	ZINC000853726286	EG	On-Demand	Anodyne	SFRP1	107	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCCCCC1	ZINC000853726286	EG	On-Demand	Anodyne	WNT3	75	38
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	ACHE	21	42
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	HTR1D	64	46
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	HTR1B	52	46
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	NQO2	40	60
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	HTR1E	16	45
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	MTNR1A	119	67
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	MTNR1B	91	60
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726311	FG	On-Demand	Anodyne	ABCG2	27	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(C(=O)OC(C)C)CC2)C1	ZINC000853726312	ED	On-Demand	Anodyne	EPHX2	33	48
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	ACHE	21	42
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	HTR1D	64	46
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	HTR1B	52	46
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	NQO2	40	60
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	HTR1E	16	45
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	MTNR1A	119	67
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	MTNR1B	91	60
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@H](O)c4ccccc43)c2c1	ZINC000853726314	FG	On-Demand	Anodyne	ABCG2	27	43
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	ACHE	21	42
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	HTR1D	64	46
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	HTR1B	52	46
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	NQO2	40	60
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	HTR1E	16	45
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	MTNR1A	119	67
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	MTNR1B	91	60
COc1ccc2[nH]cc(CCNC(=O)N[C@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726316	FG	On-Demand	Anodyne	ABCG2	27	43
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	HTR1A	21	49
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	ACHE	21	42
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	HTR1D	64	46
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	HTR1B	52	46
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	NQO2	40	60
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	HTR1E	16	45
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	MTNR1A	119	67
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	MTNR1B	91	60
COc1ccc2[nH]cc(CCNC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)c2c1	ZINC000853726317	FG	On-Demand	Anodyne	ABCG2	27	43
COc1cccc(C[C@@H](C)NC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853726337	GE	On-Demand	Anodyne	MTNR1A	42	38
COc1cccc(C[C@H](C)NC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853726339	GE	On-Demand	Anodyne	MTNR1A	42	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(C3CC3)c2)CC1	ZINC000853726341	EF	On-Demand	Anodyne	P2RY12	135	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(C3CC3)c2)CC1	ZINC000853726343	EF	On-Demand	Anodyne	P2RY12	135	42
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCCc2ccccc21	ZINC000853726356	GI	On-Demand	Anodyne	BDKRB1	57	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCCc2ccccc21	ZINC000853726358	GI	On-Demand	Anodyne	BDKRB1	57	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCCc2ccccc21	ZINC000853726360	GI	On-Demand	Anodyne	BDKRB1	57	43
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCCc2ccccc21	ZINC000853726362	GI	On-Demand	Anodyne	BDKRB1	57	43
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCc2sccc2C1	ZINC000853726364	GH	On-Demand	Anodyne	AKR1C3	41	47
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCc2sccc2C1	ZINC000853726365	GH	On-Demand	Anodyne	AKR1C3	41	47
COc1cccc(C2(NC(=O)NC3CCN(C(=O)OC(C)C)CC3)CCC2)c1	ZINC000853726372	GG	On-Demand	Anodyne	MTNR1A	17	40
COc1cccc(C2(NC(=O)NC3CCN(C(=O)OC(C)C)CC3)CCC2)c1	ZINC000853726372	GG	On-Demand	Anodyne	MTNR1B	22	40
COc1cccc(C2(NC(=O)NC3CCN(C(=O)OC(C)C)CC3)CCC2)c1	ZINC000853726372	GG	On-Demand	Anodyne	EPHX2	33	40
CCOC(=O)NOCC[C@H]1CCc2ccccc21	ZINC000853726383	BF	On-Demand	Anodyne	NQO2	20	41
CCOC(=O)NOCC[C@@H]1CCc2ccccc21	ZINC000853726385	BF	On-Demand	Anodyne	NQO2	20	41
O=C(NC/C=C\c1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853726390	DH	On-Demand	Anodyne	EPHX2	26	48
O=C(NC/C=C/c1ccccc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853726392	DH	On-Demand	Anodyne	EPHX2	26	48
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3c(C)cccc3c2=O)CC1	ZINC000853726404	FE	On-Demand	Anodyne	NR5A1	29	42
COC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)C)CC1)c1cccc(OC)c1	ZINC000853726406	GF	On-Demand	Anodyne	MTNR1A	23	43
COC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)C)CC1)c1cccc(OC)c1	ZINC000853726406	GF	On-Demand	Anodyne	MTNR1B	31	43
COC[C@@H](NC(=O)NC1CCN(C(=O)OC(C)C)CC1)c1cccc(OC)c1	ZINC000853726406	GF	On-Demand	Anodyne	EPHX2	32	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3c(C)cccc3c2=O)CC1	ZINC000853726407	FE	On-Demand	Anodyne	NR5A1	29	42
COC[C@H](NC(=O)NC1CCN(C(=O)OC(C)C)CC1)c1cccc(OC)c1	ZINC000853726408	GF	On-Demand	Anodyne	MTNR1A	23	43
COC[C@H](NC(=O)NC1CCN(C(=O)OC(C)C)CC1)c1cccc(OC)c1	ZINC000853726408	GF	On-Demand	Anodyne	MTNR1B	31	43
COC[C@H](NC(=O)NC1CCN(C(=O)OC(C)C)CC1)c1cccc(OC)c1	ZINC000853726408	GF	On-Demand	Anodyne	EPHX2	32	42
COc1cccc(C[C@@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726418	CD	On-Demand	Anodyne	HRH2	23	42
COc1cccc(C[C@@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726418	CD	On-Demand	Anodyne	MTNR1A	61	45
COc1cccc(C[C@@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726418	CD	On-Demand	Anodyne	MTNR1B	58	45
COc1cccc(C[C@@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726418	CD	On-Demand	Anodyne	ROCK2	40	40
COc1cccc(C[C@@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726418	CD	On-Demand	Anodyne	HSD17B2	20	41
COc1cccc(C[C@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726420	CD	On-Demand	Anodyne	HRH2	23	42
COc1cccc(C[C@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726420	CD	On-Demand	Anodyne	MTNR1A	61	45
COc1cccc(C[C@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726420	CD	On-Demand	Anodyne	MTNR1B	58	45
COc1cccc(C[C@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726420	CD	On-Demand	Anodyne	ROCK2	40	40
COc1cccc(C[C@H](C)NC(=O)NCCN(C)OC)c1	ZINC000853726420	CD	On-Demand	Anodyne	HSD17B2	20	41
O=[S@@](=NCc1ccc2c(c1)OCCO2)(c1ccccc1)C(F)(F)F	ZINC000853726427	FI	On-Demand	Anodyne	PKM	33	43
O=[S@](=NCc1ccc2c(c1)OCCO2)(c1ccccc1)C(F)(F)F	ZINC000853726428	FI	On-Demand	Anodyne	PKM	33	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CC1	ZINC000853726450	DE	On-Demand	Anodyne	SFRP1	101	34
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CC1	ZINC000853726450	DE	On-Demand	Anodyne	WNT3	64	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CC1	ZINC000853726451	DE	On-Demand	Anodyne	SFRP1	101	34
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CC1	ZINC000853726451	DE	On-Demand	Anodyne	WNT3	64	33
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccnc(Br)c1	ZINC000853726579	EC	On-Demand	Anodyne	GYS1	25	42
O=C(CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F)NC1CCCC1	ZINC000853726585	FG	On-Demand	Anodyne	EPHX2	19	42
O=C(CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F)NC1CCCC1	ZINC000853726586	FG	On-Demand	Anodyne	EPHX2	19	42
COCCN(CCF)C(=O)N[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000853726603	ED	On-Demand	Anodyne	ACKR3	49	31
O=C(NC/C=C\c1ccccc1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853726639	GD	On-Demand	Anodyne	F13A1	51	35
O=C(NC/C=C/c1ccccc1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853726640	GD	On-Demand	Anodyne	F13A1	51	35
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1cccc(SC(F)(F)F)c1	ZINC000853726652	FE	On-Demand	Anodyne	GYS1	26	44
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CHRM2	25	46
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CHRM1	28	46
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	ACE	42	39
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	DRD2	31	52
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	DRD4	66	52
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	ACHE	49	48
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	HRH1	20	40
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	DRD3	20	52
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	SLC6A3	17	42
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	KCNH2	17	45
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	HTR4	31	48
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CHRM3	39	46
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	LTA4H	24	43
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	SIGMAR1	64	57
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	SSTR5	86	43
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	BCHE	18	40
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CCR3	40	44
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	SLC6A5	19	43
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CAPN2	49	37
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	EPHX2	17	47
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CXCR3	29	41
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	NPR	43	33
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	MCHR1	57	51
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CACNA1G	34	42
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	CCR8	30	44
CCOC(=O)NO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726709	ED	On-Demand	Anodyne	BIRC2	33	41
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CHRM2	25	46
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CHRM1	28	46
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	ACE	42	39
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	DRD2	31	52
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	DRD4	66	52
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	ACHE	49	48
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	HRH1	20	40
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	DRD3	20	52
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	SLC6A3	17	42
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	KCNH2	17	45
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	HTR4	31	48
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CHRM3	39	46
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	LTA4H	24	43
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	SIGMAR1	64	57
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	SSTR5	86	43
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	BCHE	18	40
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CCR3	40	44
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	TIMP3	62	36
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	SLC6A5	19	43
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CAPN2	49	37
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	EPHX2	17	47
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CXCR3	29	41
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	NPR	43	33
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	MCHR1	57	51
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CACNA1G	34	42
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	CCR8	30	44
CCOC(=O)NO[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853726710	ED	On-Demand	Anodyne	BIRC2	33	41
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCCCC1	ZINC000853726737	EG	On-Demand	Anodyne	SFRP1	107	38
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCCCC1	ZINC000853726737	EG	On-Demand	Anodyne	WNT3	75	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCCCC1	ZINC000853726740	EG	On-Demand	Anodyne	SFRP1	107	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCCCC1	ZINC000853726740	EG	On-Demand	Anodyne	WNT3	75	38
CCOC(=O)NOCC(=O)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000853726745	FD	On-Demand	Anodyne	EPHX2	17	41
CCOC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726752	CD	On-Demand	Anodyne	CHRM1	15	54
CCOC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726752	CD	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726752	CD	On-Demand	Anodyne	GRIN2B	42	36
CCOC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726752	CD	On-Demand	Anodyne	SMO	42	38
CCOC(=O)NOC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726752	CD	On-Demand	Anodyne	L3MBTL3	55	35
CCOC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726755	CD	On-Demand	Anodyne	CHRM1	15	54
CCOC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726755	CD	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726755	CD	On-Demand	Anodyne	GRIN2B	42	36
CCOC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726755	CD	On-Demand	Anodyne	SMO	42	38
CCOC(=O)NOC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853726755	CD	On-Demand	Anodyne	L3MBTL3	55	35
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc2ccccc2c1	ZINC000853726828	FD	On-Demand	Anodyne	ENPP1	50	31
COC(=O)c1cccc(NNC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1C	ZINC000853726833	GE	On-Demand	Reactive	EPHX2	27	42
COC(=O)c1cccc(NNC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1C	ZINC000853726833	GE	On-Demand	Reactive	CCR8	59	36
COC(=O)c1cccc(NNC(=O)NC2CCN(C(=O)OC(C)C)CC2)c1C	ZINC000853726833	GE	On-Demand	Reactive	GPR119	30	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc3ccc(Cl)cc3c2=O)CC1	ZINC000853726837	GD	On-Demand	Anodyne	P2RY12	46	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc3ccc(Cl)cc3c2=O)CC1	ZINC000853726837	GD	On-Demand	Anodyne	MC4R	48	36
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)[C@@H]1CCCOC1	ZINC000853726838	EE	On-Demand	Anodyne	L3MBTL3	48	34
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)[C@@H]1CCCOC1	ZINC000853726840	EE	On-Demand	Anodyne	L3MBTL3	48	34
N=C(NOC[C@H]1CCN(C(=O)c2ccccc2)C1)[C@H]1CCCOC1	ZINC000853726842	EE	On-Demand	Anodyne	L3MBTL3	48	34
N=C(NOC[C@@H]1CCN(C(=O)c2ccccc2)C1)[C@H]1CCCOC1	ZINC000853726843	EE	On-Demand	Anodyne	L3MBTL3	48	34
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc3ccc(Cl)cc3c2=O)CC1	ZINC000853726844	GD	On-Demand	Anodyne	P2RY12	46	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc3ccc(Cl)cc3c2=O)CC1	ZINC000853726844	GD	On-Demand	Anodyne	MC4R	48	36
CS(=O)(=O)N1CC[C@H](COc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000853726866	FF	On-Demand	Clean	CASP3	41	34
CS(=O)(=O)N1CC[C@H](COc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000853726866	FF	On-Demand	Clean	CHRNA10	28	40
CS(=O)(=O)N1CC[C@H](COc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000853726866	FF	On-Demand	Clean	CASP7	54	34
CS(=O)(=O)N1CC[C@@H](COc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000853726867	FF	On-Demand	Clean	CASP3	41	34
CS(=O)(=O)N1CC[C@@H](COc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000853726867	FF	On-Demand	Clean	CHRNA10	28	40
CS(=O)(=O)N1CC[C@@H](COc2ccc(N3CCCCC3)c(Cl)c2)C1	ZINC000853726867	FF	On-Demand	Clean	CASP7	54	34
O=C(NC/C=C\c1ccccc1)N(CCN1CCOCC1)CC1CC1	ZINC000853726899	EE	On-Demand	Anodyne	CASR	58	42
O=C(NC/C=C/c1ccccc1)N(CCN1CCOCC1)CC1CC1	ZINC000853726900	EE	On-Demand	Anodyne	CASR	58	42
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC(C)C)cc1	ZINC000853726913	ED	On-Demand	Anodyne	GYS1	25	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2cccn3ccnc23)C1	ZINC000853726920	EE	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCO[C@H](COc2cccn3ccnc23)C1	ZINC000853726921	EE	On-Demand	Anodyne	GPR119	32	41
COc1cccc(OCCN=[S@](=O)(c2ccccc2)C(F)(F)F)c1	ZINC000853726979	FI	On-Demand	Anodyne	MTNR1A	20	45
COc1cccc(OCCN=[S@](=O)(c2ccccc2)C(F)(F)F)c1	ZINC000853726979	FI	On-Demand	Anodyne	MTNR1B	23	45
COc1cccc(OCCN=[S@](=O)(c2ccccc2)C(F)(F)F)c1	ZINC000853726979	FI	On-Demand	Anodyne	PDS	48	35
O=[S@](=NCc1cccc(CN2CCOCC2)c1)(c1ccccc1)C(F)(F)F	ZINC000853726980	GI	On-Demand	Anodyne	SIGMAR1	23	40
COc1cccc(OCCN=[S@@](=O)(c2ccccc2)C(F)(F)F)c1	ZINC000853726981	FI	On-Demand	Anodyne	MTNR1A	20	45
COc1cccc(OCCN=[S@@](=O)(c2ccccc2)C(F)(F)F)c1	ZINC000853726981	FI	On-Demand	Anodyne	MTNR1B	23	45
COc1cccc(OCCN=[S@@](=O)(c2ccccc2)C(F)(F)F)c1	ZINC000853726981	FI	On-Demand	Anodyne	PDS	48	35
O=[S@@](=NCc1cccc(CN2CCOCC2)c1)(c1ccccc1)C(F)(F)F	ZINC000853726983	GI	On-Demand	Anodyne	SIGMAR1	23	40
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(CC(C)C)cc1	ZINC000853727017	ED	On-Demand	Anodyne	TIMP3	50	32
CC[C@H](C)N(CC)C(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000853727019	DF	On-Demand	Anodyne	EPHX2	17	41
O=C(c1ccccc1)N1CC[C@@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727164	GI	On-Demand	Anodyne	ST14	47	35
O=C(c1ccccc1)N1CC[C@@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727164	GI	On-Demand	Anodyne	AKR1C3	45	35
O=C(c1ccccc1)N1CC[C@@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727164	GI	On-Demand	Anodyne	SFRP1	117	42
O=C(c1ccccc1)N1CC[C@@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727164	GI	On-Demand	Anodyne	WNT3	75	36
O=C(c1ccccc1)N1CC[C@@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727166	GI	On-Demand	Anodyne	ST14	47	35
O=C(c1ccccc1)N1CC[C@@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727166	GI	On-Demand	Anodyne	AKR1C3	45	35
O=C(c1ccccc1)N1CC[C@@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727166	GI	On-Demand	Anodyne	SFRP1	117	42
O=C(c1ccccc1)N1CC[C@@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727166	GI	On-Demand	Anodyne	WNT3	75	36
O=C(c1ccccc1)N1CC[C@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727169	GI	On-Demand	Anodyne	ST14	47	35
O=C(c1ccccc1)N1CC[C@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727169	GI	On-Demand	Anodyne	AKR1C3	45	35
O=C(c1ccccc1)N1CC[C@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727169	GI	On-Demand	Anodyne	SFRP1	117	42
O=C(c1ccccc1)N1CC[C@H](CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727169	GI	On-Demand	Anodyne	WNT3	75	36
O=C(c1ccccc1)N1CC[C@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727171	GI	On-Demand	Anodyne	ST14	47	35
O=C(c1ccccc1)N1CC[C@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727171	GI	On-Demand	Anodyne	AKR1C3	45	35
O=C(c1ccccc1)N1CC[C@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727171	GI	On-Demand	Anodyne	SFRP1	117	42
O=C(c1ccccc1)N1CC[C@H](CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727171	GI	On-Demand	Anodyne	WNT3	75	36
COc1cccc(C[C@H](C)NC(=O)N2CCC[C@@H](c3nnc(S)n3C)C2)c1	ZINC000853727177	GF	On-Demand	Anodyne	CCR3	15	40
COc1cccc(C[C@H](C)NC(=O)N2CCC[C@@H](c3nnc(S)n3C)C2)c1	ZINC000853727177	GF	On-Demand	Anodyne	BIRC2	24	42
COc1cccc(C[C@@H](C)NC(=O)N2CCC[C@H](c3nnc(S)n3C)C2)c1	ZINC000853727179	GF	On-Demand	Anodyne	CCR3	15	40
COc1cccc(C[C@@H](C)NC(=O)N2CCC[C@H](c3nnc(S)n3C)C2)c1	ZINC000853727179	GF	On-Demand	Anodyne	BIRC2	24	42
COc1cccc(C[C@@H](C)NC(=O)N2CCC[C@@H](c3nnc(S)n3C)C2)c1	ZINC000853727181	GF	On-Demand	Anodyne	CCR3	15	40
COc1cccc(C[C@@H](C)NC(=O)N2CCC[C@@H](c3nnc(S)n3C)C2)c1	ZINC000853727181	GF	On-Demand	Anodyne	BIRC2	24	42
COc1cccc(C[C@H](C)NC(=O)N2CCC[C@H](c3nnc(S)n3C)C2)c1	ZINC000853727183	GF	On-Demand	Anodyne	CCR3	15	40
COc1cccc(C[C@H](C)NC(=O)N2CCC[C@H](c3nnc(S)n3C)C2)c1	ZINC000853727183	GF	On-Demand	Anodyne	BIRC2	24	42
C=CCN(CC=C)C(=O)CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853727236	FG	On-Demand	Mild	LSS	21	40
C=CCN(CC=C)C(=O)CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853727237	FG	On-Demand	Mild	LSS	21	40
Cn1nccc1COc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853727242	DG	On-Demand	Anodyne	HRH3	23	51
CN(C(=O)NC/C=C/c1ccccc1)[C@@H](CO)Cc1ccccc1	ZINC000853727259	DF	On-Demand	Anodyne	NPY5R	21	45
CN(C(=O)NC/C=C/c1ccccc1)[C@H](CO)Cc1ccccc1	ZINC000853727260	DF	On-Demand	Anodyne	NPY5R	21	45
CN(C(=O)NC/C=C\c1ccccc1)[C@@H](CO)Cc1ccccc1	ZINC000853727261	DF	On-Demand	Anodyne	NPY5R	21	45
CN(C(=O)NC/C=C\c1ccccc1)[C@H](CO)Cc1ccccc1	ZINC000853727262	DF	On-Demand	Anodyne	NPY5R	21	45
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	SIGMAR1	17	45
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	MMP13	36	65
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	MMP2	18	74
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	MMP3	44	38
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	GYS1	27	46
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	MMP9	35	74
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	MMP1	44	65
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)cc1	ZINC000853727268	CC	On-Demand	Anodyne	PROKR1	52	31
CCOc1ccc(-n2c(C)cc(C(=O)COc3c(C)[nH]ccc3=O)c2C)cc1	ZINC000853727275	GH	On-Demand	Clean	CACNA2D1	48	36
FC(F)OCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853727281	DH	On-Demand	Anodyne	HRH3	35	46
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(Cl)nc1C(F)(F)F	ZINC000853727292	FD	On-Demand	Anodyne	P2RX7	15	43
COC(=O)[C@H]1CCS(=O)(=O)N1CCCOc1ccc(C#N)cc1	ZINC000853727304	EC	On-Demand	Mild	HRH3	29	45
COC(=O)[C@H]1CCS(=O)(=O)N1CCCOc1ccc(C#N)cc1	ZINC000853727304	EC	On-Demand	Mild	MEN1	43	40
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCCC1	ZINC000853727373	DF	On-Demand	Anodyne	SFRP1	108	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCCC1	ZINC000853727373	DF	On-Demand	Anodyne	WNT3	76	38
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCCC1	ZINC000853727375	DF	On-Demand	Anodyne	SFRP1	108	38
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCCC1	ZINC000853727375	DF	On-Demand	Anodyne	WNT3	76	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCCC1	ZINC000853727388	FH	On-Demand	Anodyne	EPHX2	27	46
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCCC1	ZINC000853727388	FH	On-Demand	Anodyne	SFRP1	91	33
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCCC1	ZINC000853727388	FH	On-Demand	Anodyne	WNT3	59	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCCC1	ZINC000853727389	FH	On-Demand	Anodyne	EPHX2	27	46
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCCC1	ZINC000853727389	FH	On-Demand	Anodyne	SFRP1	91	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCCC1	ZINC000853727389	FH	On-Demand	Anodyne	WNT3	59	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCCc2ccccc21	ZINC000853727392	GI	On-Demand	Anodyne	AVPR2	37	44
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCCc2ccccc21	ZINC000853727394	GI	On-Demand	Anodyne	AVPR2	37	44
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	HTR1A	16	49
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	HTR1D	38	49
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	HTR1B	34	45
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	NQO2	31	60
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	MPO	69	39
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	HTR1E	22	45
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	MTNR1A	93	64
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	MTNR1B	68	60
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727400	EE	On-Demand	Mild	ABCG2	27	45
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2CCCOC2)CC1	ZINC000853727461	GE	On-Demand	Anodyne	SIGMAR1	16	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2CCCOC2)CC1	ZINC000853727463	GE	On-Demand	Anodyne	SIGMAR1	16	42
O=C(NCCCN=[S@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727509	FH	On-Demand	Anodyne	FKBP1A	15	45
O=C(NCCCN=[S@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727509	FH	On-Demand	Anodyne	SFRP1	102	33
O=C(NCCCN=[S@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727509	FH	On-Demand	Anodyne	WNT3	72	33
O=C(NCCCN=[S@@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727512	FH	On-Demand	Anodyne	FKBP1A	15	45
O=C(NCCCN=[S@@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727512	FH	On-Demand	Anodyne	SFRP1	102	33
O=C(NCCCN=[S@@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727512	FH	On-Demand	Anodyne	WNT3	72	33
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727513	GF	On-Demand	Mild	HTR1D	30	45
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727513	GF	On-Demand	Mild	HTR1B	30	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727513	GF	On-Demand	Mild	NQO2	34	58
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727513	GF	On-Demand	Mild	MPO	48	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727513	GF	On-Demand	Mild	MTNR1A	80	59
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727513	GF	On-Demand	Mild	MTNR1B	60	58
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727513	GF	On-Demand	Mild	ABCG2	30	42
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	HTR1A	21	51
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	HTR1D	45	51
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	HTR1B	36	47
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	NQO2	35	63
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	MPO	81	42
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	HTR1E	23	46
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	MTNR1A	98	64
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	MTNR1B	75	63
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(OC)cc12	ZINC000853727535	EE	On-Demand	Anodyne	ABCG2	28	46
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853727544	GE	On-Demand	Anodyne	HTR1A	20	45
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853727544	GE	On-Demand	Anodyne	HTR1D	68	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853727544	GE	On-Demand	Anodyne	HTR1B	55	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853727544	GE	On-Demand	Anodyne	NQO2	30	55
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853727544	GE	On-Demand	Anodyne	MTNR1A	80	56
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853727544	GE	On-Demand	Anodyne	MTNR1B	62	55
COc1ccc2[nH]cc(CCNC(=O)N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853727544	GE	On-Demand	Anodyne	ABCG2	26	44
C[C@@H]1C[C@@H](C)CN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727561	FH	On-Demand	Anodyne	SFRP1	59	34
C[C@@H]1C[C@@H](C)CN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727562	FH	On-Demand	Anodyne	SFRP1	59	34
C[C@H]1C[C@@H](C)CN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727563	FH	On-Demand	Anodyne	SFRP1	59	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc3c(Cl)cccc3c2=O)CC1	ZINC000853727596	GD	On-Demand	Anodyne	P2RY12	54	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc3c(Cl)cccc3c2=O)CC1	ZINC000853727597	GD	On-Demand	Anodyne	P2RY12	54	36
COC[C@@H](NC(=O)NC/C=C\c1ccccc1)c1cccc(OC)c1	ZINC000853727640	EG	On-Demand	Anodyne	MTNR1A	31	41
COC[C@@H](NC(=O)NC/C=C\c1ccccc1)c1cccc(OC)c1	ZINC000853727640	EG	On-Demand	Anodyne	MTNR1B	35	41
COC[C@H](NC(=O)NC/C=C\c1ccccc1)c1cccc(OC)c1	ZINC000853727641	EG	On-Demand	Anodyne	MTNR1A	31	41
COC[C@H](NC(=O)NC/C=C\c1ccccc1)c1cccc(OC)c1	ZINC000853727641	EG	On-Demand	Anodyne	MTNR1B	35	41
COC[C@@H](NC(=O)NC/C=C/c1ccccc1)c1cccc(OC)c1	ZINC000853727642	EG	On-Demand	Anodyne	MTNR1A	31	41
COC[C@@H](NC(=O)NC/C=C/c1ccccc1)c1cccc(OC)c1	ZINC000853727642	EG	On-Demand	Anodyne	MTNR1B	35	41
COC[C@H](NC(=O)NC/C=C/c1ccccc1)c1cccc(OC)c1	ZINC000853727643	EG	On-Demand	Anodyne	MTNR1A	31	41
COC[C@H](NC(=O)NC/C=C/c1ccccc1)c1cccc(OC)c1	ZINC000853727643	EG	On-Demand	Anodyne	MTNR1B	35	41
COC(=O)[C@H]1CCS(=O)(=O)N1CC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853727651	GD	On-Demand	Anodyne	GPR119	32	42
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc([N+](=O)[O-])c(F)c1	ZINC000853727656	EC	On-Demand	Bother	GYS1	26	43
CCCCC[C@@H](C)NC(=O)CN1[C@H](C(=O)OC)CCS1(=O)=O	ZINC000853727663	EC	On-Demand	Anodyne	NOD1	46	33
CCCCC[C@@H](C)NC(=O)CN1[C@@H](C(=O)OC)CCS1(=O)=O	ZINC000853727667	EC	On-Demand	Anodyne	NOD1	46	33
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(OC)c(SC(F)(F)F)c1	ZINC000853727671	GE	On-Demand	Anodyne	GYS1	27	44
O=[S@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727718	EH	On-Demand	Anodyne	HRH3	56	45
O=[S@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727718	EH	On-Demand	Anodyne	SIGMAR1	28	43
O=[S@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727718	EH	On-Demand	Anodyne	HNMT	54	34
O=[S@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727718	EH	On-Demand	Anodyne	SFRP1	67	41
O=[S@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727718	EH	On-Demand	Anodyne	WNT3	46	36
O=[S@@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727720	EH	On-Demand	Anodyne	HRH3	56	45
O=[S@@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727720	EH	On-Demand	Anodyne	SIGMAR1	28	43
O=[S@@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727720	EH	On-Demand	Anodyne	HNMT	54	34
O=[S@@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727720	EH	On-Demand	Anodyne	SFRP1	67	41
O=[S@@](=NCCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853727720	EH	On-Demand	Anodyne	WNT3	46	36
CCCCNC(=O)CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853727734	EG	On-Demand	Anodyne	ASAH1	55	31
CCCCNC(=O)CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853727736	EG	On-Demand	Anodyne	ASAH1	55	31
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(Cl)cc1C	ZINC000853727740	DD	On-Demand	Anodyne	P2RX7	33	51
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(Cl)cc1C	ZINC000853727740	DD	On-Demand	Anodyne	GYS1	24	40
CO[C@@H](CN=[S@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727771	EI	On-Demand	Anodyne	AMY2	43	30
CO[C@@H](CN=[S@@](=O)(c1ccccc1)C(F)(F)F)C1CCCC1	ZINC000853727774	EI	On-Demand	Anodyne	AMY2	43	30
O=C(NC[C@@H]1OCCc2ccccc21)N1CCC(N2CCOC2=O)CC1	ZINC000853727788	FD	On-Demand	Anodyne	SMO	18	41
O=C(NC[C@H]1OCCc2ccccc21)N1CCC(N2CCOC2=O)CC1	ZINC000853727789	FD	On-Demand	Anodyne	SMO	18	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3c2CCC3)CC1	ZINC000853727795	EE	On-Demand	Anodyne	P2RY12	46	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3c2CCC3)CC1	ZINC000853727796	EE	On-Demand	Anodyne	P2RY12	46	39
C[C@H]1C[C@@H](C)CN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853727797	FH	On-Demand	Anodyne	SFRP1	59	34
Nc1ncnc2c1ncn2CCOC(F)F	ZINC000853727848	BC	On-Demand	Anodyne	ADA	42	38
Nc1ncnc2c1ncn2CCOC(F)F	ZINC000853727848	BC	On-Demand	Anodyne	AHCY	92	51
Nc1ncnc2c1ncn2CCOC(F)F	ZINC000853727848	BC	On-Demand	Anodyne	OXGR1	60	34
COc1cccc(C[C@@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853727855	GF	On-Demand	Anodyne	MTNR1A	42	41
COc1cccc(C[C@@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853727855	GF	On-Demand	Anodyne	MTNR1B	38	41
COc1cccc(C[C@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853727857	GF	On-Demand	Anodyne	MTNR1A	42	41
COc1cccc(C[C@H](C)NC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853727857	GF	On-Demand	Anodyne	MTNR1B	38	41
C=C[C@H](CO)NC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000853727859	CC	On-Demand	Mild	EPHX2	21	41
CON(C)CCNC(=O)NCc1ccccc1CN1CCCCCC1	ZINC000853727867	EE	On-Demand	Anodyne	HRH2	27	45
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCOCC1	ZINC000853727890	FE	On-Demand	Anodyne	SFRP1	55	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCOCC1	ZINC000853727891	FE	On-Demand	Anodyne	SFRP1	55	35
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727920	EE	On-Demand	Anodyne	AHCY	72	41
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727920	EE	On-Demand	Anodyne	OXGR1	101	35
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727920	EE	On-Demand	Anodyne	GPR119	48	40
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727920	EE	On-Demand	Anodyne	DOT1L	46	32
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727922	EE	On-Demand	Anodyne	AHCY	72	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727922	EE	On-Demand	Anodyne	OXGR1	101	35
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727922	EE	On-Demand	Anodyne	GPR119	48	40
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc3c(N)ncnc32)C1	ZINC000853727922	EE	On-Demand	Anodyne	DOT1L	46	32
Cc1cccc(C(C)C)c1NC(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853727936	GK	On-Demand	Anodyne	SOAT1	49	38
Cc1cccc(C(C)C)c1NC(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853727937	GK	On-Demand	Anodyne	SOAT1	49	38
CC(C)(C)OC(=O)N1CCc2ccc(Cn3cnc4c(N)ncnc43)cc2C1	ZINC000853727945	GF	On-Demand	Anodyne	AHCY	59	38
CC(C)(C)OC(=O)N1CCc2ccc(Cn3cnc4c(N)ncnc43)cc2C1	ZINC000853727945	GF	On-Demand	Anodyne	OXGR1	85	33
C#CCN1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853727951	FD	On-Demand	Mild	SFRP1	76	36
C#CCN1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853727951	FD	On-Demand	Mild	WNT3	47	36
C#CCN1CCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853727953	FD	On-Demand	Mild	SFRP1	76	36
C#CCN1CCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853727953	FD	On-Demand	Mild	WNT3	47	36
CON(C)CCNC(=O)NCCNC(=O)c1c(F)cccc1F	ZINC000853727954	EC	On-Demand	Anodyne	DAC	22	41
Nc1ncnc2c1ncn2CC1OCCO1	ZINC000853727957	BB	On-Demand	Anodyne	ADA	38	44
Nc1ncnc2c1ncn2CC1OCCO1	ZINC000853727957	BB	On-Demand	Anodyne	ADK	19	44
Nc1ncnc2c1ncn2CC1OCCO1	ZINC000853727957	BB	On-Demand	Anodyne	AHCY	108	53
Nc1ncnc2c1ncn2CC1OCCO1	ZINC000853727957	BB	On-Demand	Anodyne	ADCY5	40	39
Nc1ncnc2c1ncn2CC1OCCO1	ZINC000853727957	BB	On-Demand	Anodyne	OXGR1	117	40
Nc1ncnc2c1ncn2CC1OCCO1	ZINC000853727957	BB	On-Demand	Anodyne	DOT1L	45	37
CCCCCNC(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853727961	EG	On-Demand	Anodyne	ASAH1	85	37
CCCCCNC(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853727963	EG	On-Demand	Anodyne	ASAH1	85	37
O=C(NCCNC(=O)c1c(F)cccc1F)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853727966	GE	On-Demand	Anodyne	PPIA	24	41
O=C(NCCNC(=O)c1c(F)cccc1F)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853727968	GE	On-Demand	Anodyne	PPIA	24	41
O=C(NCCNC(=O)c1c(F)cccc1F)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853727970	GE	On-Demand	Anodyne	PPIA	24	41
O=C(NCCNC(=O)c1c(F)cccc1F)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853727972	GE	On-Demand	Anodyne	PPIA	24	41
CCOC(=O)NOCc1cccc(C(C)C)c1	ZINC000853727992	BF	On-Demand	Anodyne	CAPN2	51	35
CCOC(=O)NOCc1cccc(C(C)C)c1	ZINC000853727992	BF	On-Demand	Anodyne	PDS	31	42
COc1cccc(C[C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853728010	EG	On-Demand	Anodyne	MTNR1A	32	40
COc1cccc(C[C@H](C)NC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853728010	EG	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(C[C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853728011	EG	On-Demand	Anodyne	MTNR1A	32	40
COc1cccc(C[C@H](C)NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853728011	EG	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(C[C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853728012	EG	On-Demand	Anodyne	MTNR1A	32	40
COc1cccc(C[C@H](C)NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853728012	EG	On-Demand	Anodyne	MTNR1B	35	40
COc1cccc(C[C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853728013	EG	On-Demand	Anodyne	MTNR1A	32	40
COc1cccc(C[C@H](C)NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853728013	EG	On-Demand	Anodyne	MTNR1B	35	40
Cc1nonc1COc1cccc(CN2CCc3ccccc3C2)c1	ZINC000853728110	EH	On-Demand	Anodyne	NOD2	44	39
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(CF)cc1	ZINC000853728135	DD	On-Demand	Anodyne	GYS1	25	41
C#CCN1CCN(C(=O)COc2ccc(CN3CCCC3)c(Cl)c2)CC1	ZINC000853728143	GE	On-Demand	Mild	HTR1D	15	41
C#CCN1CCN(C(=O)COc2ccc(CN3CCCC3)c(Cl)c2)CC1	ZINC000853728143	GE	On-Demand	Mild	HTR1B	18	41
O=C(NC/C=C\c1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853728145	DF	On-Demand	Anodyne	CPT1A	125	41
O=C(NC/C=C/c1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853728147	DF	On-Demand	Anodyne	CPT1A	125	41
O=C(NC/C=C/c1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853728149	DF	On-Demand	Anodyne	CPT1A	125	41
O=C(NC/C=C\c1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853728150	DF	On-Demand	Anodyne	CPT1A	125	41
C[C@H](C#N)OCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853728152	DG	On-Demand	Mild	HRH3	30	42
C[C@@H](C#N)OCCOc1ccc(CN2CCCC2)c(Cl)c1	ZINC000853728154	DG	On-Demand	Mild	HRH3	30	42
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(Cl)nc1	ZINC000853728155	DC	On-Demand	Anodyne	GYS1	24	40
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(Cl)nc1	ZINC000853728155	DC	On-Demand	Anodyne	NACHRBETA2	51	35
CCC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)c(OC)c1	ZINC000853728162	EH	On-Demand	Anodyne	TNFRSF1A	25	60
CCC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)c(OC)c1	ZINC000853728162	EH	On-Demand	Anodyne	MTNR1A	42	44
CCC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)c(OC)c1	ZINC000853728162	EH	On-Demand	Anodyne	MTNR1B	36	43
CCC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)c(OC)c1	ZINC000853728162	EH	On-Demand	Anodyne	SLC6A5	17	41
CCC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)c(OC)c1	ZINC000853728162	EH	On-Demand	Anodyne	TUBB2B	24	40
CCC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)c(OC)c1	ZINC000853728162	EH	On-Demand	Anodyne	TUBB1	48	40
CCC(=O)c1cc(OC)c(OCc2ccc(OC)cc2)c(OC)c1	ZINC000853728162	EH	On-Demand	Anodyne	FFAR1	23	40
O=C(CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F)NC1CCCCCC1	ZINC000853728206	GI	On-Demand	Anodyne	EPHX2	25	43
O=C(CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F)NC1CCCCCC1	ZINC000853728207	GI	On-Demand	Anodyne	EPHX2	25	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C#N)cc2=O)CC1	ZINC000853728226	EB	On-Demand	Mild	P2RY12	82	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C#N)cc2=O)CC1	ZINC000853728228	EB	On-Demand	Mild	P2RY12	82	37
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853728231	GI	On-Demand	Anodyne	DRD4	25	48
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853728231	GI	On-Demand	Anodyne	TPP2	46	34
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853728235	GI	On-Demand	Anodyne	DRD4	25	48
C[C@@H]1Cc2ccccc2N1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853728235	GI	On-Demand	Anodyne	TPP2	46	34
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728240	GF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728240	GF	On-Demand	Anodyne	CCR2	36	47
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728240	GF	On-Demand	Anodyne	SFRP1	121	36
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728240	GF	On-Demand	Anodyne	WNT3	80	34
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728241	GF	On-Demand	Anodyne	SIGMAR1	17	41
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728241	GF	On-Demand	Anodyne	CCR2	36	47
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728241	GF	On-Demand	Anodyne	SFRP1	121	36
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCN(C2CC2)CC1	ZINC000853728241	GF	On-Demand	Anodyne	WNT3	80	34
CCOC(=O)NOCc1oc2ccccc2c1Br	ZINC000853728243	DG	On-Demand	Anodyne	CYP2C9	15	40
CCOC(=O)NOCc1oc2ccccc2c1Br	ZINC000853728243	DG	On-Demand	Anodyne	SLC22A12	32	40
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728257	GE	On-Demand	Anodyne	BIRC2	27	41
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728257	GE	On-Demand	Anodyne	SFRP1	126	37
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728257	GE	On-Demand	Anodyne	WNT3	87	37
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728259	GE	On-Demand	Anodyne	BIRC2	27	41
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728259	GE	On-Demand	Anodyne	SFRP1	126	37
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728259	GE	On-Demand	Anodyne	WNT3	87	37
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728262	GE	On-Demand	Anodyne	BIRC2	27	41
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728262	GE	On-Demand	Anodyne	SFRP1	126	37
CC(=O)N[C@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728262	GE	On-Demand	Anodyne	WNT3	87	37
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728264	GE	On-Demand	Anodyne	BIRC2	27	41
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728264	GE	On-Demand	Anodyne	SFRP1	126	37
CC(=O)N[C@@H]1CCCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)C1	ZINC000853728264	GE	On-Demand	Anodyne	WNT3	87	37
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCc2ccccc2C1	ZINC000853728266	GH	On-Demand	Anodyne	DPP8	16	45
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCc2ccccc2C1	ZINC000853728266	GH	On-Demand	Anodyne	AKR1C3	62	44
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCc2ccccc2C1	ZINC000853728267	GH	On-Demand	Anodyne	DPP8	16	45
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCc2ccccc2C1	ZINC000853728267	GH	On-Demand	Anodyne	AKR1C3	62	44
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	CHRM1	23	43
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	DRD4	24	55
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	CHRM3	18	51
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	SIGMAR1	23	49
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	SSTR5	54	41
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	CCR3	16	41
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	MCHR1	28	41
CCOC(=O)NOCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000853728308	ED	On-Demand	Anodyne	CCR8	45	41
CN(c1nc(CN=[S@](=O)(c2ccccc2)C(F)(F)F)cs1)C1CC1	ZINC000853728336	GI	On-Demand	Anodyne	AMY2	44	31
CN(c1nc(CN=[S@@](=O)(c2ccccc2)C(F)(F)F)cs1)C1CC1	ZINC000853728337	GI	On-Demand	Anodyne	AMY2	44	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3cc(F)ccc3c2=O)CC1	ZINC000853728365	GE	On-Demand	Anodyne	P2RY12	42	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3cc(F)ccc3c2=O)CC1	ZINC000853728366	GE	On-Demand	Anodyne	P2RY12	42	36
C#CCCN(CCOC)C(=O)N[C@@H](C)Cc1cccc(OC)c1	ZINC000853728380	DE	On-Demand	Mild	ROCK2	43	36
C#CCCN(CCOC)C(=O)N[C@@H](C)Cc1cccc(OC)c1	ZINC000853728380	DE	On-Demand	Mild	PTGES	20	48
C#CCCN(CCOC)C(=O)N[C@H](C)Cc1cccc(OC)c1	ZINC000853728381	DE	On-Demand	Mild	ROCK2	43	36
C#CCCN(CCOC)C(=O)N[C@H](C)Cc1cccc(OC)c1	ZINC000853728381	DE	On-Demand	Mild	PTGES	20	48
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853728404	GD	On-Demand	Anodyne	PRNP	38	40
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853728404	GD	On-Demand	Anodyne	HDAC3	15	42
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853728404	GD	On-Demand	Anodyne	HDAC6	17	42
COC(=O)[C@H]1CCS(=O)(=O)N1CC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853728404	GD	On-Demand	Anodyne	SLC1A2	21	40
C=CCCC(C)(C)NC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000853728417	EG	On-Demand	Mild	EPHX2	24	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)Cc1cccc(OC)c1	ZINC000853728427	FF	On-Demand	Mild	PTGES	17	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)Cc1cccc(OC)c1	ZINC000853728430	FF	On-Demand	Mild	PTGES	17	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(C)C)cn2)CC1	ZINC000853728533	DD	On-Demand	Anodyne	P2RY12	61	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(C)C)cn2)CC1	ZINC000853728534	DD	On-Demand	Anodyne	P2RY12	61	39
COC(=O)[C@H]1CCS(=O)(=O)N1CCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853728542	GD	On-Demand	Anodyne	GPR119	33	48
O=C(Nc1ccccc1)c1ccc(CON=Cc2ccc(N3CCOCC3)cc2)cc1	ZINC000853728597	HI	On-Demand	Mild	PRNP	55	44
O=C(Nc1ccccc1)c1ccc(CON=Cc2ccc(N3CCOCC3)cc2)cc1	ZINC000853728597	HI	On-Demand	Mild	FLT3	15	40
O=C(Nc1ccccc1)c1ccc(CON=Cc2ccc(N3CCOCC3)cc2)cc1	ZINC000853728597	HI	On-Demand	Mild	DGAT1	15	44
O=C(Nc1ccccc1)c1ccc(CON=Cc2ccc(N3CCOCC3)cc2)cc1	ZINC000853728597	HI	On-Demand	Mild	NOD2	43	37
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728598	FF	On-Demand	Anodyne	DRD4	31	40
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728598	FF	On-Demand	Anodyne	SIGMAR1	34	50
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728598	FF	On-Demand	Anodyne	CCR3	29	43
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728598	FF	On-Demand	Anodyne	MCHR1	16	44
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728599	FF	On-Demand	Anodyne	DRD4	31	40
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728599	FF	On-Demand	Anodyne	SIGMAR1	34	50
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728599	FF	On-Demand	Anodyne	CCR3	29	43
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853728599	FF	On-Demand	Anodyne	MCHR1	16	44
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728600	FF	On-Demand	Anodyne	DRD4	31	40
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728600	FF	On-Demand	Anodyne	SIGMAR1	34	50
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728600	FF	On-Demand	Anodyne	CCR3	29	43
O=C(NC/C=C\c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728600	FF	On-Demand	Anodyne	MCHR1	16	44
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728601	FF	On-Demand	Anodyne	DRD4	31	40
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728601	FF	On-Demand	Anodyne	SIGMAR1	34	50
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728601	FF	On-Demand	Anodyne	CCR3	29	43
O=C(NC/C=C/c1ccccc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853728601	FF	On-Demand	Anodyne	MCHR1	16	44
CN(Cc1cnn(C)c1)C(=O)CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853728608	GF	On-Demand	Anodyne	PLA2G7	65	44
CN(Cc1cnn(C)c1)C(=O)CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F	ZINC000853728609	GF	On-Demand	Anodyne	PLA2G7	65	44
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000853728622	ED	On-Demand	Bother	P2RX7	18	47
CCN1CC[C@H](N(CC)C(=O)NC/C=C\c2ccccc2)C1	ZINC000853728624	DF	On-Demand	Anodyne	CCR5	40	49
CCN1CC[C@@H](N(CC)C(=O)NC/C=C\c2ccccc2)C1	ZINC000853728625	DF	On-Demand	Anodyne	CCR5	40	49
CCN1CC[C@@H](N(CC)C(=O)NC/C=C/c2ccccc2)C1	ZINC000853728626	DF	On-Demand	Anodyne	CCR5	40	49
CCN1CC[C@H](N(CC)C(=O)NC/C=C/c2ccccc2)C1	ZINC000853728627	DF	On-Demand	Anodyne	CCR5	40	49
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853728652	FD	On-Demand	Anodyne	HTR1A	19	44
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853728652	FD	On-Demand	Anodyne	HTR1D	66	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853728652	FD	On-Demand	Anodyne	HTR1B	53	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853728652	FD	On-Demand	Anodyne	NQO2	30	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853728652	FD	On-Demand	Anodyne	MTNR1A	73	55
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853728652	FD	On-Demand	Anodyne	MTNR1B	54	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853728652	FD	On-Demand	Anodyne	ABCG2	26	43
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853728653	FD	On-Demand	Anodyne	HTR1A	19	44
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853728653	FD	On-Demand	Anodyne	HTR1D	66	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853728653	FD	On-Demand	Anodyne	HTR1B	53	42
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853728653	FD	On-Demand	Anodyne	NQO2	30	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853728653	FD	On-Demand	Anodyne	MTNR1A	73	55
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853728653	FD	On-Demand	Anodyne	MTNR1B	54	54
COc1ccc2[nH]cc(CCNC(=O)N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853728653	FD	On-Demand	Anodyne	ABCG2	26	43
CON(C)CCNC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000853728662	DC	On-Demand	Anodyne	EPHX2	28	44
CON(C)CCNC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000853728662	DC	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1CCc2c(cccc2Cn2cnc3c(N)ncnc32)C1	ZINC000853728665	GF	On-Demand	Anodyne	AHCY	42	37
CC(C)(C)OC(=O)N1CCc2c(cccc2Cn2cnc3c(N)ncnc32)C1	ZINC000853728665	GF	On-Demand	Anodyne	EIF2AK3	40	30
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCC1	ZINC000853728674	EG	On-Demand	Anodyne	EPHX2	27	46
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCC1	ZINC000853728674	EG	On-Demand	Anodyne	SFRP1	91	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCC1	ZINC000853728674	EG	On-Demand	Anodyne	WNT3	59	33
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCC1	ZINC000853728675	EG	On-Demand	Anodyne	EPHX2	27	46
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCC1	ZINC000853728675	EG	On-Demand	Anodyne	SFRP1	91	33
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NC1CCCCC1	ZINC000853728675	EG	On-Demand	Anodyne	WNT3	59	33
O=[S@](=NCc1noc(C2CC2)n1)(c1ccccc1)C(F)(F)F	ZINC000853728694	EG	On-Demand	Anodyne	ETHR	42	38
O=[S@@](=NCc1noc(C2CC2)n1)(c1ccccc1)C(F)(F)F	ZINC000853728695	EG	On-Demand	Anodyne	ETHR	42	38
Cc1ccc(CC2CN(C(=O)NC3CCN(C(=O)OC(C)C)CC3)C2)cc1	ZINC000853728700	FG	On-Demand	Anodyne	EPHX2	22	42
Cc1ccc(CC2CN(C(=O)NC3CCN(C(=O)OC(C)C)CC3)C2)cc1	ZINC000853728700	FG	On-Demand	Anodyne	GPR119	35	40
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCC1CC1	ZINC000853728705	DF	On-Demand	Anodyne	SFRP1	54	34
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCC1CC1	ZINC000853728706	DF	On-Demand	Anodyne	SFRP1	54	34
O=[S@@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728709	DH	On-Demand	Anodyne	LTA4H	21	40
O=[S@@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728709	DH	On-Demand	Anodyne	HRH3	24	41
O=[S@@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728709	DH	On-Demand	Anodyne	SIGMAR1	15	40
O=[S@@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728709	DH	On-Demand	Anodyne	PSMB1	40	38
O=[S@@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728709	DH	On-Demand	Anodyne	SFRP1	76	38
O=[S@@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728709	DH	On-Demand	Anodyne	WNT3	49	36
O=[S@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728710	DH	On-Demand	Anodyne	LTA4H	21	40
O=[S@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728710	DH	On-Demand	Anodyne	HRH3	24	41
O=[S@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728710	DH	On-Demand	Anodyne	SIGMAR1	15	40
O=[S@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728710	DH	On-Demand	Anodyne	PSMB1	40	38
O=[S@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728710	DH	On-Demand	Anodyne	SFRP1	76	38
O=[S@](=NCCN1CCCCC1)(c1ccccc1)C(F)(F)F	ZINC000853728710	DH	On-Demand	Anodyne	WNT3	49	36
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCC1CCCCC1	ZINC000853728721	FH	On-Demand	Anodyne	AMY2	43	30
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCC1CCCCC1	ZINC000853728721	FH	On-Demand	Anodyne	SFRP1	44	34
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCC1CCCCC1	ZINC000853728722	FH	On-Demand	Anodyne	AMY2	43	30
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCC1CCCCC1	ZINC000853728722	FH	On-Demand	Anodyne	SFRP1	44	34
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCC1CCC1	ZINC000853728734	EF	On-Demand	Anodyne	SFRP1	47	33
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCC1CCC1	ZINC000853728735	EF	On-Demand	Anodyne	SFRP1	47	33
CC(C)(C)OC(=O)N1CCO[C@@H](CONC(=N)c2ccc(F)cc2F)C1	ZINC000853728774	FE	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1CCO[C@H](CONC(=N)c2ccc(F)cc2F)C1	ZINC000853728775	FE	On-Demand	Anodyne	GPR119	24	42
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(F)cc1C#N	ZINC000853728848	DC	On-Demand	Mild	P2RX7	16	45
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccnc(Cl)c1	ZINC000853728879	DC	On-Demand	Anodyne	GYS1	26	43
O=C(CN=[S@](=O)(c1ccc(F)cc1)C(F)(F)F)NC1CCCCC1	ZINC000853728904	FH	On-Demand	Anodyne	EPHX2	25	43
O=C(CN=[S@@](=O)(c1ccc(F)cc1)C(F)(F)F)NC1CCCCC1	ZINC000853728905	FH	On-Demand	Anodyne	EPHX2	25	43
O=C(NC/C=C/c1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853728934	GI	On-Demand	Anodyne	CPT1A	72	39
O=C(NC/C=C/c1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853728934	GI	On-Demand	Anodyne	SFRP1	48	33
O=C(NC/C=C/c1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853728934	GI	On-Demand	Anodyne	WNT3	48	33
O=C(NC/C=C/c1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853728935	GI	On-Demand	Anodyne	CPT1A	72	39
O=C(NC/C=C/c1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853728935	GI	On-Demand	Anodyne	SFRP1	48	33
O=C(NC/C=C/c1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853728935	GI	On-Demand	Anodyne	WNT3	48	33
O=C(NC/C=C\c1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853728936	GI	On-Demand	Anodyne	CPT1A	72	39
O=C(NC/C=C\c1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853728936	GI	On-Demand	Anodyne	SFRP1	48	33
O=C(NC/C=C\c1ccccc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853728936	GI	On-Demand	Anodyne	WNT3	48	33
O=C(NC/C=C\c1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853728937	GI	On-Demand	Anodyne	CPT1A	72	39
O=C(NC/C=C\c1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853728937	GI	On-Demand	Anodyne	SFRP1	48	33
O=C(NC/C=C\c1ccccc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853728937	GI	On-Demand	Anodyne	WNT3	48	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728979	GH	On-Demand	Anodyne	CA2	15	43
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728979	GH	On-Demand	Anodyne	CA1	15	43
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728979	GH	On-Demand	Anodyne	CA5B	33	43
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728979	GH	On-Demand	Anodyne	CA5A	33	43
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728979	GH	On-Demand	Anodyne	CES1	19	40
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728979	GH	On-Demand	Anodyne	AMP1_PLAFQ	21	40
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728979	GH	On-Demand	Anodyne	CRTM	36	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728981	GH	On-Demand	Anodyne	CA2	15	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728981	GH	On-Demand	Anodyne	CA1	15	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728981	GH	On-Demand	Anodyne	CA5B	33	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728981	GH	On-Demand	Anodyne	CA5A	33	43
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728981	GH	On-Demand	Anodyne	CES1	19	40
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728981	GH	On-Demand	Anodyne	AMP1_PLAFQ	21	40
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)NCCCc1ccccc1	ZINC000853728981	GH	On-Demand	Anodyne	CRTM	36	43
O=C(N[C@H]1CCN(c2ccccc2F)C1=O)N1CCC(N2CCOC2=O)CC1	ZINC000853728984	GD	On-Demand	Anodyne	CALCRL	41	36
O=C(N[C@@H]1CCN(c2ccccc2F)C1=O)N1CCC(N2CCOC2=O)CC1	ZINC000853728986	GD	On-Demand	Anodyne	CALCRL	41	36
Nc1ncnc2c1ncn2CCC1SCCS1	ZINC000853728996	CD	On-Demand	Anodyne	AHCY	91	48
Nc1ncnc2c1ncn2CCC1SCCS1	ZINC000853728996	CD	On-Demand	Anodyne	OXGR1	96	33
O=[S@](=NCc1cc2n(n1)CCCC2)(c1ccccc1)C(F)(F)F	ZINC000853729014	EH	On-Demand	Anodyne	SFRP1	59	31
O=[S@@](=NCc1cc2n(n1)CCCC2)(c1ccccc1)C(F)(F)F	ZINC000853729018	EH	On-Demand	Anodyne	SFRP1	59	31
COC(=O)[C@H]1CCS(=O)(=O)N1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000853729038	ED	On-Demand	Bother	GYS1	24	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2ccc(F)cc2F)CC1	ZINC000853729054	GD	On-Demand	Anodyne	P2RY12	96	40
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2ccc(F)cc2F)CC1	ZINC000853729057	GD	On-Demand	Anodyne	P2RY12	96	40
O=[S@](=NCCC1CC1)(c1ccccc1)C(F)(F)F	ZINC000853729058	CH	On-Demand	Anodyne	SFRP1	49	32
O=[S@@](=NCCC1CC1)(c1ccccc1)C(F)(F)F	ZINC000853729061	CH	On-Demand	Anodyne	SFRP1	49	32
COC(=O)C1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853729100	GE	On-Demand	Anodyne	SFRP1	131	41
COC(=O)C1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853729100	GE	On-Demand	Anodyne	WNT3	90	41
COC(=O)C1CCN(C(=O)CN=[S@@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853729100	GE	On-Demand	Anodyne	PTR1	43	32
COC(=O)C1CCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853729103	GE	On-Demand	Anodyne	SFRP1	131	41
COC(=O)C1CCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853729103	GE	On-Demand	Anodyne	WNT3	90	41
COC(=O)C1CCN(C(=O)CN=[S@](=O)(c2ccccc2)C(F)(F)F)CC1	ZINC000853729103	GE	On-Demand	Anodyne	PTR1	43	32
CC[C@@H](O)CNC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000853729105	DD	On-Demand	Anodyne	EPHX2	31	46
CC[C@@H](O)CNC(=O)NC1CCN(C(=O)OC(C)C)CC1	ZINC000853729105	DD	On-Demand	Anodyne	GPR119	22	44
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cn(C)nn2)CC1	ZINC000853729189	GC	On-Demand	Anodyne	DRD4	17	48
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cn(C)nn2)CC1	ZINC000853729189	GC	On-Demand	Anodyne	SIGMAR1	15	44
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)c2cn(C)nn2)CC1	ZINC000853729189	GC	On-Demand	Anodyne	CCR8	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3cnsc3c2)CC1	ZINC000853729190	FE	On-Demand	Anodyne	P2RY12	96	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3cnsc3c2)CC1	ZINC000853729192	FE	On-Demand	Anodyne	P2RY12	96	38
CC[C@@](C)(NC(=O)NC1CCN(C(=O)OC(C)C)CC1)C1CC1	ZINC000853729215	EF	On-Demand	Anodyne	EPHX2	29	42
CCCCNC(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729220	DF	On-Demand	Anodyne	ASAH1	41	33
CCCCNC(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729222	DF	On-Demand	Anodyne	ASAH1	41	33
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N(C1CCCC1)C1CC1	ZINC000853729225	FH	On-Demand	Anodyne	AMY2	43	30
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N(C1CCCC1)C1CC1	ZINC000853729227	FH	On-Demand	Anodyne	AMY2	43	30
COc1ccc2[nH]cc(CCNC(=O)N3CCC4=C(CCC(=O)N4)C3)c2c1	ZINC000853729238	FE	On-Demand	Anodyne	HTR1D	47	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC4=C(CCC(=O)N4)C3)c2c1	ZINC000853729238	FE	On-Demand	Anodyne	HTR1B	38	42
COc1ccc2[nH]cc(CCNC(=O)N3CCC4=C(CCC(=O)N4)C3)c2c1	ZINC000853729238	FE	On-Demand	Anodyne	NQO2	33	56
COc1ccc2[nH]cc(CCNC(=O)N3CCC4=C(CCC(=O)N4)C3)c2c1	ZINC000853729238	FE	On-Demand	Anodyne	MTNR1A	79	56
COc1ccc2[nH]cc(CCNC(=O)N3CCC4=C(CCC(=O)N4)C3)c2c1	ZINC000853729238	FE	On-Demand	Anodyne	MTNR1B	59	56
COc1ccc2[nH]cc(CCNC(=O)N3CCC4=C(CCC(=O)N4)C3)c2c1	ZINC000853729238	FE	On-Demand	Anodyne	ABCG2	26	44
CCOC(=O)NOCCc1ccc(C#N)cc1	ZINC000853729240	BD	On-Demand	Mild	CTRB_BOVIN	51	38
CC(C)(C)OC(=O)N1CCO[C@H](Cn2cnc3c(N)ncnc32)C1	ZINC000853729260	ED	On-Demand	Anodyne	AHCY	78	40
CC(C)(C)OC(=O)N1CCO[C@H](Cn2cnc3c(N)ncnc32)C1	ZINC000853729260	ED	On-Demand	Anodyne	OXGR1	106	36
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2cnc3c(N)ncnc32)C1	ZINC000853729261	ED	On-Demand	Anodyne	AHCY	78	40
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2cnc3c(N)ncnc32)C1	ZINC000853729261	ED	On-Demand	Anodyne	OXGR1	106	36
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCOc2ccccc21	ZINC000853729294	GH	On-Demand	Anodyne	BDKRB1	38	44
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCOc2ccccc21	ZINC000853729294	GH	On-Demand	Anodyne	LUXR	65	38
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCOc2ccccc21	ZINC000853729294	GH	On-Demand	Anodyne	TRAR	76	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCOc2ccccc21	ZINC000853729295	GH	On-Demand	Anodyne	BDKRB1	38	44
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCOc2ccccc21	ZINC000853729295	GH	On-Demand	Anodyne	LUXR	65	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@H]1CCOc2ccccc21	ZINC000853729295	GH	On-Demand	Anodyne	TRAR	76	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCOc2ccccc21	ZINC000853729297	GH	On-Demand	Anodyne	BDKRB1	38	44
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCOc2ccccc21	ZINC000853729297	GH	On-Demand	Anodyne	LUXR	65	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCOc2ccccc21	ZINC000853729297	GH	On-Demand	Anodyne	TRAR	76	38
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCOc2ccccc21	ZINC000853729300	GH	On-Demand	Anodyne	BDKRB1	38	44
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCOc2ccccc21	ZINC000853729300	GH	On-Demand	Anodyne	LUXR	65	38
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N[C@@H]1CCOc2ccccc21	ZINC000853729300	GH	On-Demand	Anodyne	TRAR	76	38
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@@H]2CCCC[C@@H]21	ZINC000853729349	GI	On-Demand	Anodyne	SFRP1	108	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@@H]2CCCC[C@@H]21	ZINC000853729349	GI	On-Demand	Anodyne	WNT3	80	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@H]2CCCC[C@@H]21	ZINC000853729351	GI	On-Demand	Anodyne	SFRP1	108	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@H]2CCCC[C@@H]21	ZINC000853729351	GI	On-Demand	Anodyne	WNT3	80	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@H]2CCCC[C@H]21	ZINC000853729353	GI	On-Demand	Anodyne	SFRP1	108	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@H]2CCCC[C@H]21	ZINC000853729353	GI	On-Demand	Anodyne	WNT3	80	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@@H]2CCCC[C@H]21	ZINC000853729356	GI	On-Demand	Anodyne	SFRP1	108	35
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCC[C@@H]2CCCC[C@H]21	ZINC000853729356	GI	On-Demand	Anodyne	WNT3	80	35
CC(C)(C)OC(=O)N1CCC(CCCn2cnc3c(N)ncnc32)CC1	ZINC000853729383	FF	On-Demand	Anodyne	AHCY	79	42
CC(C)(C)OC(=O)N1CCC(CCCn2cnc3c(N)ncnc32)CC1	ZINC000853729383	FF	On-Demand	Anodyne	ADCY5	25	40
CC(C)(C)OC(=O)N1CCC(CCCn2cnc3c(N)ncnc32)CC1	ZINC000853729383	FF	On-Demand	Anodyne	OXGR1	108	36
CC(C)(C)OC(=O)N1CCC(CCCn2cnc3c(N)ncnc32)CC1	ZINC000853729383	FF	On-Demand	Anodyne	GPR119	52	43
CC(C)(C)OC(=O)N1CCC(CCCn2cnc3c(N)ncnc32)CC1	ZINC000853729383	FF	On-Demand	Anodyne	DOT1L	56	33
C[C@@H]1CCCC[C@@H]1NC(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729388	FH	On-Demand	Anodyne	SFRP1	63	32
C[C@@H]1CCCC[C@@H]1NC(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729388	FH	On-Demand	Anodyne	WNT3	53	31
C[C@@H]1CCCC[C@@H]1NC(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729389	FH	On-Demand	Anodyne	SFRP1	63	32
C[C@@H]1CCCC[C@@H]1NC(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729389	FH	On-Demand	Anodyne	WNT3	53	31
C[C@@H]1CCCC[C@H]1NC(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729390	FH	On-Demand	Anodyne	SFRP1	63	32
C[C@@H]1CCCC[C@H]1NC(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729390	FH	On-Demand	Anodyne	WNT3	53	31
C[C@@H]1CCCC[C@H]1NC(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729391	FH	On-Demand	Anodyne	SFRP1	63	32
C[C@@H]1CCCC[C@H]1NC(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729391	FH	On-Demand	Anodyne	WNT3	53	31
COCC1(NC(=O)NC2CCN(C(=O)OC(C)C)CC2)CCCC1	ZINC000853729395	EE	On-Demand	Anodyne	EPHX2	36	43
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	HTR1A	16	49
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	HTR1D	49	48
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	HTR1B	36	48
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	NQO2	32	61
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	MPO	44	37
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	HTR1E	15	41
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	MTNR1A	99	72
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	MTNR1B	74	61
COc1ccc2[nH]cc(CCNC(=O)NCCc3nnc(S)n3C)c2c1	ZINC000853729428	FD	On-Demand	Anodyne	ABCG2	26	44
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCOCC1	ZINC000853729434	ED	On-Demand	Anodyne	AKR1C3	17	42
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCOCC1	ZINC000853729434	ED	On-Demand	Anodyne	SFRP1	37	41
O=C(CN=[S@@](=O)(c1ccccc1)C(F)(F)F)N1CCOCC1	ZINC000853729434	ED	On-Demand	Anodyne	WNT3	22	41
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCOCC1	ZINC000853729435	ED	On-Demand	Anodyne	AKR1C3	17	42
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCOCC1	ZINC000853729435	ED	On-Demand	Anodyne	SFRP1	37	41
O=C(CN=[S@](=O)(c1ccccc1)C(F)(F)F)N1CCOCC1	ZINC000853729435	ED	On-Demand	Anodyne	WNT3	22	41
C[C@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729448	EG	On-Demand	Anodyne	FKBP1A	40	36
C[C@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729448	EG	On-Demand	Anodyne	CPT1A	43	35
C[C@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729448	EG	On-Demand	Anodyne	SFRP1	113	37
C[C@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729448	EG	On-Demand	Anodyne	WNT3	82	37
C[C@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729450	EG	On-Demand	Anodyne	FKBP1A	40	36
C[C@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729450	EG	On-Demand	Anodyne	CPT1A	43	35
C[C@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729450	EG	On-Demand	Anodyne	SFRP1	113	37
C[C@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729450	EG	On-Demand	Anodyne	WNT3	82	37
C[C@@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729452	EG	On-Demand	Anodyne	FKBP1A	40	36
C[C@@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729452	EG	On-Demand	Anodyne	CPT1A	43	35
C[C@@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729452	EG	On-Demand	Anodyne	SFRP1	113	37
C[C@@H]1CCCCN1C(=O)CN=[S@@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729452	EG	On-Demand	Anodyne	WNT3	82	37
C[C@@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729454	EG	On-Demand	Anodyne	FKBP1A	40	36
C[C@@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729454	EG	On-Demand	Anodyne	CPT1A	43	35
C[C@@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729454	EG	On-Demand	Anodyne	SFRP1	113	37
C[C@@H]1CCCCN1C(=O)CN=[S@](=O)(c1ccccc1)C(F)(F)F	ZINC000853729454	EG	On-Demand	Anodyne	WNT3	82	37
CC(C)(C)OC(=O)NCc1nc(Cn2cnc3c(N)ncnc32)no1	ZINC000853729476	EC	On-Demand	Anodyne	AHCY	60	40
CC(C)(C)OC(=O)NCc1nc(Cn2cnc3c(N)ncnc32)no1	ZINC000853729476	EC	On-Demand	Anodyne	OXGR1	99	36
CC(C)(C)OC(=O)NCc1nc(Cn2cnc3c(N)ncnc32)no1	ZINC000853729476	EC	On-Demand	Anodyne	DOT1L	54	34
COC(=O)c1ccc(CNC(=O)NC2CCN(C(=O)OC(C)C)CC2)c(F)c1	ZINC000853729488	GE	On-Demand	Anodyne	EPHX2	45	42
COC(=O)c1ccc(CNC(=O)NC2CCN(C(=O)OC(C)C)CC2)c(F)c1	ZINC000853729488	GE	On-Demand	Anodyne	GPR119	37	46
CCOC(=O)N1CCN(C(=O)[C@H](C)ONC(=N)c2cn(C)nn2)CC1	ZINC000853729501	FB	On-Demand	Anodyne	P2RY12	94	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)ONC(=N)c2cn(C)nn2)CC1	ZINC000853729503	FB	On-Demand	Anodyne	P2RY12	94	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2c(C=O)cccc2CC)CC1	ZINC000853729769	FE	On-Demand	Anodyne	P2RY12	40	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2c(C=O)cccc2CC)CC1	ZINC000853729770	FE	On-Demand	Anodyne	P2RY12	40	37
C[C@H](NC(C)(C)CNC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853729800	GF	On-Demand	Anodyne	SMO	18	40
C[C@@H](NC(C)(C)CNC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853729801	GF	On-Demand	Anodyne	SMO	18	40
CCCCC[C@@H](C)NC(=O)Cn1cnc(C(C)C)n1	ZINC000853729875	CE	On-Demand	Anodyne	NOD1	41	33
COc1ccc(N2CCN(C(=O)Cn3cnc(C(C)C)n3)CC2)cc1	ZINC000853729953	ED	On-Demand	Clean	CCR1	24	44
c1cn(-c2cc(CNc3nc(C4CCOCC4)no3)ccn2)cn1	ZINC000853729979	EE	On-Demand	Anodyne	NOS2	88	34
COc1ccc(Cn2cc(C3CCC3)cn2)cc1	ZINC000853729983	BG	On-Demand	Anodyne	SLC18A2	15	42
COc1ccc(Cn2cc(C3CCC3)cn2)cc1	ZINC000853729983	BG	On-Demand	Anodyne	PROKR1	47	31
Cc1nocc1COc1ccc(NC(=O)OC(C)C)cc1Cl	ZINC000853730011	DI	On-Demand	Anodyne	PTGER1	17	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(C)C)n2)CC1	ZINC000853730030	DD	On-Demand	Anodyne	P2RY12	75	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(C)C)n2)CC1	ZINC000853730032	DD	On-Demand	Anodyne	P2RY12	75	39
C#CCOCCOc1cccc(OC(=O)NCC)c1	ZINC000853730096	CD	On-Demand	Mild	MTNR1A	22	40
C#CCOCCOc1cccc(OC(=O)NCC)c1	ZINC000853730096	CD	On-Demand	Mild	MTNR1B	17	40
C#CCOCCOc1cccc(OC(=O)NCC)c1	ZINC000853730096	CD	On-Demand	Mild	FAAH	30	43
C#CCOCCOc1cccc(OC(=O)NCC)c1	ZINC000853730096	CD	On-Demand	Mild	PDS	50	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccnc3c2CCCC3)CC1	ZINC000853730098	FE	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccnc3c2CCCC3)CC1	ZINC000853730100	FE	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C=O)c(F)c2)CC1	ZINC000853730105	FD	On-Demand	Anodyne	P2RY12	49	37
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C=O)c(F)c2)CC1	ZINC000853730106	FD	On-Demand	Anodyne	P2RY12	49	37
C[C@H](NC1(CNC(=O)NNC(=O)c2cccc(F)n2)CCCC1)c1ccccc1	ZINC000853730121	GF	On-Demand	Reactive	HCN1	48	34
C[C@@H](NC1(CNC(=O)NNC(=O)c2cccc(F)n2)CCCC1)c1ccccc1	ZINC000853730122	GF	On-Demand	Reactive	HCN1	48	34
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@H]3COC[C@@H]3C2)C1	ZINC000853730152	FE	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@@H]3COC[C@H]3C2)C1	ZINC000853730153	FE	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@@H]3COC[C@@H]3C2)C1	ZINC000853730154	FE	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@H]3COC[C@H]3C2)C1	ZINC000853730155	FE	On-Demand	Anodyne	GPR119	27	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)OCc2n[nH]cc2C)CC1	ZINC000853730324	DC	On-Demand	Anodyne	P2RY12	76	39
CCOC(=O)N1CCN(C(=O)[C@H](C)OCc2n[nH]cc2C)CC1	ZINC000853730325	DC	On-Demand	Anodyne	P2RY12	76	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@@H]3C[C@H]3C2)C1	ZINC000853730431	EF	On-Demand	Anodyne	GPR119	25	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@@H]3C[C@@H]3C2)C1	ZINC000853730432	EF	On-Demand	Anodyne	GPR119	25	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@H]3C[C@H]3C2)C1	ZINC000853730433	EF	On-Demand	Anodyne	GPR119	25	43
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@H]3C[C@@H]3C2)C1	ZINC000853730434	EF	On-Demand	Anodyne	GPR119	25	43
COc1ccc(N2CC[C@H](NC(=O)NCc3cc4c(nc3O)CCC4)C2)cc1	ZINC000853730497	GE	On-Demand	Clean	MTNR1B	15	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnn(C(C)C)c2)CC1	ZINC000853730507	ED	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnn(C(C)C)c2)CC1	ZINC000853730508	ED	On-Demand	Anodyne	P2RY12	43	35
C[C@H](CCNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853730514	FE	On-Demand	Anodyne	CHRNA3	21	42
C[C@H](CCNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853730514	FE	On-Demand	Anodyne	CHRNA4	15	44
C[C@@H](CCNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853730515	FE	On-Demand	Anodyne	CHRNA3	21	42
C[C@@H](CCNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853730515	FE	On-Demand	Anodyne	CHRNA4	15	44
C[C@@H](CCNC(=O)N[C@@H]1CCCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853730517	FE	On-Demand	Anodyne	CHRNA3	21	42
C[C@@H](CCNC(=O)N[C@@H]1CCCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853730517	FE	On-Demand	Anodyne	CHRNA4	15	44
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853730669	FE	On-Demand	Anodyne	EPHX2	15	43
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853730671	FE	On-Demand	Anodyne	EPHX2	15	43
O=C(NCC1CCSCC1)NNc1cc(F)cc(Cl)c1	ZINC000853730771	DG	On-Demand	Reactive	CACNA1I	67	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(=O)c3cccs3)n2)CC1	ZINC000853730782	GD	On-Demand	Anodyne	P2RY12	51	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(=O)c3cccs3)n2)CC1	ZINC000853730783	GD	On-Demand	Anodyne	P2RY12	51	35
CC(C)(C)OC(=O)N1CCC(CCn2cnc(Cc3ccccc3)n2)CC1	ZINC000853730787	FH	On-Demand	Anodyne	GRIN2B	45	42
CC(C)(C)OC(=O)N1CCC(CCn2cnc(Cc3ccccc3)n2)CC1	ZINC000853730787	FH	On-Demand	Anodyne	GPR119	54	48
O=C(CCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000853730808	GE	On-Demand	Clean	CCR3	24	42
O=C(CCNC(=O)NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1	ZINC000853730808	GE	On-Demand	Clean	STAT6	15	41
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853730859	GG	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853730861	GG	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853730863	GG	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853730866	GG	On-Demand	Anodyne	BIRC2	17	40
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(C(=O)c3cccs3)n2)C1	ZINC000853730873	GG	On-Demand	Anodyne	GPR119	41	39
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(C(=O)c3cccs3)n2)C1	ZINC000853730875	GG	On-Demand	Anodyne	GPR119	41	39
C[C@@]1(CNC(=O)NNc2nc3ccc(Cl)cc3s2)CCOC1	ZINC000853730890	EG	On-Demand	Reactive	CSNK1D	36	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(-c3ccccn3)ccc2=O)CC1	ZINC000853730901	GD	On-Demand	Anodyne	P2RY12	182	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(-c3ccccn3)ccc2=O)CC1	ZINC000853730902	GD	On-Demand	Anodyne	P2RY12	182	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(-c3ccncn3)cn2)CC1	ZINC000853731015	FD	On-Demand	Anodyne	P2RY12	64	38
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(-c3ccncn3)cn2)CC1	ZINC000853731017	FD	On-Demand	Anodyne	P2RY12	64	38
CCCCCCn1cnc(C(C)C)n1	ZINC000853731100	AF	On-Demand	Anodyne	ADA	45	42
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CCC(c3ccon3)CC2)C1	ZINC000853731106	GG	On-Demand	Anodyne	SMO	21	41
COC(=O)c1ccc(Br)cc1Cn1cnc(C(C)C)n1	ZINC000853731107	EF	On-Demand	Anodyne	MT-CYB	46	31
CC(C)(C)OC(=O)N1CCCC[C@@H](NC(=O)N2CCC(c3ccon3)CC2)C1	ZINC000853731109	GG	On-Demand	Anodyne	SMO	21	41
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853731182	GG	On-Demand	Anodyne	KCNQ2	28	43
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853731182	GG	On-Demand	Anodyne	STAT6	25	41
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853731191	GE	On-Demand	Anodyne	PIK3CA	30	40
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853731191	GE	On-Demand	Anodyne	MTOR	52	40
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853731191	GE	On-Demand	Anodyne	PIK3CG	21	40
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853731191	GE	On-Demand	Anodyne	STAT6	76	42
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853731191	GE	On-Demand	Anodyne	DGAT1	19	44
CC(C)(C)OC(=O)N1CCC(Cn2cnc(Cc3ccccc3)n2)CC1	ZINC000853731204	FH	On-Demand	Anodyne	GRIN2B	43	43
CC(C)(C)OC(=O)N1CCC(Cn2cnc(Cc3ccccc3)n2)CC1	ZINC000853731204	FH	On-Demand	Anodyne	GPR119	52	46
CC(C)(C)OC(=O)N1CCC(Cn2cnc(Cc3ccccc3)n2)CC1	ZINC000853731204	FH	On-Demand	Anodyne	SFRP1	17	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2nnc3cc(C)ccc3c2=O)CC1	ZINC000853731254	FC	On-Demand	Anodyne	P2RY12	44	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2nnc3cc(C)ccc3c2=O)CC1	ZINC000853731255	FC	On-Demand	Anodyne	P2RY12	44	42
O=C(NCc1ccnc(OC2CCOCC2)c1)NNc1cc(F)cc(Cl)c1	ZINC000853731284	GG	On-Demand	Reactive	MAPK1	44	37
O=C(Cn1cnc(Cc2ccccc2)n1)NC1CCCCCCC1	ZINC000853731319	EG	On-Demand	Anodyne	CNR1	16	42
O=C(Cn1cnc(Cc2ccccc2)n1)NC1CCCCCCC1	ZINC000853731319	EG	On-Demand	Anodyne	CNR2	19	42
O=C(Cn1cnc(Cc2ccccc2)n1)NC1CCCCCCC1	ZINC000853731319	EG	On-Demand	Anodyne	SIGMAR1	18	47
O=C(Cn1cnc(Cc2ccccc2)n1)NC1CCCCCCC1	ZINC000853731319	EG	On-Demand	Anodyne	EPHX2	20	51
O=C(Cn1cnc(Cc2ccccc2)n1)NC1CCCCCCC1	ZINC000853731319	EG	On-Demand	Anodyne	BIRC2	32	42
C[C@@H](CNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853731336	GG	On-Demand	Anodyne	EPHX2	23	41
C[C@@H](CNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853731336	GG	On-Demand	Anodyne	BIRC2	29	41
C[C@@H](CNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853731336	GG	On-Demand	Anodyne	GPR119	36	43
C[C@@H](CNC(=O)N[C@H]1CCCCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853731336	GG	On-Demand	Anodyne	WNT3	41	33
Cc1c(C)n(Cc2ccccc2)c2ncn(CCCCCCO)c(=O)c12	ZINC000853731382	FG	On-Demand	Anodyne	NOX4	55	38
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CCc3nccnc3C2)C1	ZINC000853731393	GE	On-Demand	Anodyne	GPR119	28	41
CC(C)(C)OC(=O)N1CCCC[C@@H](NC(=O)N2CCc3nccnc3C2)C1	ZINC000853731394	GE	On-Demand	Anodyne	GPR119	28	41
C[C@H](NC1(CNC(=O)NNC(=O)c2cn(C)nn2)CCCC1)c1ccccc1	ZINC000853731410	GD	On-Demand	Reactive	HCN1	69	36
C[C@H](NC1(CNC(=O)NNC(=O)c2cn(C)nn2)CCCC1)c1ccccc1	ZINC000853731410	GD	On-Demand	Reactive	HCN4	51	36
C[C@@H](NC1(CNC(=O)NNC(=O)c2cn(C)nn2)CCCC1)c1ccccc1	ZINC000853731411	GD	On-Demand	Reactive	HCN1	69	36
C[C@@H](NC1(CNC(=O)NNC(=O)c2cn(C)nn2)CCCC1)c1ccccc1	ZINC000853731411	GD	On-Demand	Reactive	HCN4	51	36
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(Cc3ccccc3)n2)C1	ZINC000853731479	FH	On-Demand	Anodyne	GPR119	48	43
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(Cc3ccccc3)n2)C1	ZINC000853731481	FH	On-Demand	Anodyne	GPR119	48	43
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(=O)C3CCCCC3)n2)CC1	ZINC000853731482	GD	On-Demand	Anodyne	P2RY12	52	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(=O)C3CCCCC3)n2)CC1	ZINC000853731484	GD	On-Demand	Anodyne	P2RY12	52	38
O=C(c1ncn(Cc2nc3ccccc3s2)n1)C1CCCCC1	ZINC000853731488	EH	On-Demand	Anodyne	AKR1B1	30	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(C(=O)C3CCCCC3)n2)C1	ZINC000853731496	GH	On-Demand	Anodyne	GPR119	37	40
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(C(=O)C3CCCCC3)n2)C1	ZINC000853731498	GH	On-Demand	Anodyne	GPR119	37	40
COc1ccc(N2CCN(C(=O)Cn3cnc(Cc4ccccc4)n3)CC2)cc1	ZINC000853731529	GE	On-Demand	Clean	CCR1	21	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(CC)cn2)CC1	ZINC000853731540	DD	On-Demand	Anodyne	P2RY12	42	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(CC)cn2)CC1	ZINC000853731543	DD	On-Demand	Anodyne	P2RY12	42	37
C#CCOCCOc1cnc2c(C(F)(F)F)cccc2c1	ZINC000853731549	CG	On-Demand	Mild	NR1H3	48	35
C#CCOCCOc1cnc2c(C(F)(F)F)cccc2c1	ZINC000853731549	CG	On-Demand	Mild	NR1H2	53	35
O=C(NCC1CCSCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853731559	FH	On-Demand	Reactive	CSNK1D	43	48
CON(C)CCNC(=O)NCCC(=O)Nc1ccccc1	ZINC000853731680	CC	On-Demand	Anodyne	LTA4H	40	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000853731691	GF	On-Demand	Anodyne	EPHX2	18	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCC(=O)Nc2ccccc2)C1	ZINC000853731692	GF	On-Demand	Anodyne	EPHX2	18	40
O=C(Cn1cnc(C(=O)c2cccs2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853731701	GE	On-Demand	Anodyne	STAT6	53	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C3CCC3)cn2)CC1	ZINC000853731772	EE	On-Demand	Anodyne	P2RY12	55	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C3CCC3)cn2)CC1	ZINC000853731774	EE	On-Demand	Anodyne	P2RY12	55	36
COC[C@@H](COc1ccc(NC(=O)OC(C)C)cc1Cl)OC	ZINC000853731797	EG	On-Demand	Anodyne	GRM4	17	42
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2C[C@H]2C)CC1	ZINC000853731830	FE	On-Demand	Anodyne	DRD4	20	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2C[C@H]2C)CC1	ZINC000853731830	FE	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2C[C@H]2C)CC1	ZINC000853731830	FE	On-Demand	Anodyne	MCHR1	27	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2C[C@@H]2C)CC1	ZINC000853731831	FE	On-Demand	Anodyne	DRD4	20	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2C[C@@H]2C)CC1	ZINC000853731831	FE	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@@H]2C[C@@H]2C)CC1	ZINC000853731831	FE	On-Demand	Anodyne	MCHR1	27	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2C[C@H]2C)CC1	ZINC000853731832	FE	On-Demand	Anodyne	DRD4	20	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2C[C@H]2C)CC1	ZINC000853731832	FE	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2C[C@H]2C)CC1	ZINC000853731832	FE	On-Demand	Anodyne	MCHR1	27	40
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2C[C@@H]2C)CC1	ZINC000853731833	FE	On-Demand	Anodyne	DRD4	20	52
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2C[C@@H]2C)CC1	ZINC000853731833	FE	On-Demand	Anodyne	SIGMAR1	18	46
Cc1ccccc1CN1CCC(NC(=O)CONC(=N)[C@H]2C[C@@H]2C)CC1	ZINC000853731833	FE	On-Demand	Anodyne	MCHR1	27	40
CCCn1ncnc1COc1cccc(OC(=O)NCC)c1	ZINC000853731848	DE	On-Demand	Anodyne	FAAH	26	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C(F)(F)F)c(C)n2)CC1	ZINC000853731849	FE	On-Demand	Anodyne	P2RY12	59	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C(F)(F)F)c(C)n2)CC1	ZINC000853731850	FE	On-Demand	Anodyne	P2RY12	59	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc3cccc(OC)c3c2=O)CC1	ZINC000853731854	GD	On-Demand	Anodyne	P2RY12	50	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc3cccc(OC)c3c2=O)CC1	ZINC000853731855	GD	On-Demand	Anodyne	P2RY12	50	36
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	CHRM2	17	41
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	CHRM1	19	41
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	DRD2	32	46
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	DRD4	58	48
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	ACHE	44	45
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	DRD3	18	46
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	KCNH2	20	45
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	CHRM3	26	41
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	LTA4H	30	45
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	SIGMAR1	53	53
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	SSTR5	69	38
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	CCR3	66	48
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	SLC6A5	28	44
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	BACE1	20	40
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	PDK1	49	40
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	MCHR1	61	50
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	CACNA1G	39	42
C[C@@H](Oc1ccc(C=O)c(F)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853731858	GG	On-Demand	Anodyne	CCR8	16	44
COCCN(CCF)C(=O)NCCC(=O)Nc1ccccc1	ZINC000853731894	DD	On-Demand	Anodyne	LTA4H	31	41
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3cccs3)n2)CC1	ZINC000853731913	GH	On-Demand	Anodyne	GPR119	49	44
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cc(CCO)cc(OC)c2)CC1	ZINC000853731938	GD	On-Demand	Anodyne	P2RY12	37	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cc(CCO)cc(OC)c2)CC1	ZINC000853731940	GD	On-Demand	Anodyne	P2RY12	37	40
O=C(NCC1CCSCC1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853731948	FG	On-Demand	Anodyne	ADRB3	18	42
O=C(NCC1CCSCC1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853731949	FG	On-Demand	Anodyne	ADRB3	18	42
FC(F)OCCOc1cnc2c(C(F)(F)F)cccc2c1	ZINC000853731998	DH	On-Demand	Anodyne	NR1H3	66	39
FC(F)OCCOc1cnc2c(C(F)(F)F)cccc2c1	ZINC000853731998	DH	On-Demand	Anodyne	NR1H2	79	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(Cc3ccccc3)n2)CC1	ZINC000853732118	FD	On-Demand	Anodyne	P2RY12	159	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(Cc3ccccc3)n2)CC1	ZINC000853732120	FD	On-Demand	Anodyne	P2RY12	159	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C3CC3)cn2)CC1	ZINC000853732201	DD	On-Demand	Anodyne	P2RY12	56	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C3CC3)cn2)CC1	ZINC000853732202	DD	On-Demand	Anodyne	P2RY12	56	39
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)C1	ZINC000853732212	GE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)C1	ZINC000853732214	GE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)C1	ZINC000853732217	GE	On-Demand	Anodyne	GPR119	26	40
CC(C)(C)OC(=O)N1CCCC[C@H](NC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)C1	ZINC000853732219	GE	On-Demand	Anodyne	GPR119	26	40
C=C(Cl)COc1cccc(OC(=O)NCC)c1	ZINC000853732236	CF	On-Demand	Mild	FAAH	35	46
C=C(Cl)COc1cccc(OC(=O)NCC)c1	ZINC000853732236	CF	On-Demand	Mild	PDS	73	36
O=C(c1ncn(Cc2ccc(Cl)nc2)n1)C1CCCCC1	ZINC000853732265	DG	On-Demand	Anodyne	NACHRBETA2	48	36
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCCC2)cc1	ZINC000853732276	FG	On-Demand	Anodyne	KCNQ2	33	44
O=C(Cn1cnc(Cc2ccccc2)n1)Nc1ccc(N2CCCC2)cc1	ZINC000853732276	FG	On-Demand	Anodyne	STAT6	29	41
N#Cc1ccc(OCCCn2cnc(C(=O)C3CCCCC3)n2)cc1	ZINC000853732306	EG	On-Demand	Mild	HRH3	58	49
N#Cc1ccc(OCCCn2cnc(C(=O)C3CCCCC3)n2)cc1	ZINC000853732306	EG	On-Demand	Mild	MEN1	50	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(F)c3cccnc23)CC1	ZINC000853732310	GE	On-Demand	Anodyne	P2RY12	51	35
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(F)c3cccnc23)CC1	ZINC000853732311	GE	On-Demand	Anodyne	P2RY12	51	35
CC(C)(C)OC(=O)N1CCC(CCCn2cnc(C(=O)c3cccnc3)n2)CC1	ZINC000853732392	GG	On-Demand	Anodyne	GPR119	52	45
O=C(NCCc1ccc(F)cc1Cl)NCCc1nnc(S)n1C1CC1	ZINC000853732412	GF	On-Demand	Anodyne	P2RX7	62	42
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3cccnc3)n2)CC1	ZINC000853732430	GF	On-Demand	Anodyne	GRIN2B	19	42
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3cccnc3)n2)CC1	ZINC000853732430	GF	On-Demand	Anodyne	GPR119	53	47
CN(C)C(=O)C1(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)CCCC1	ZINC000853732463	FE	On-Demand	Reactive	NMBR	41	30
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCCC2)cc1	ZINC000853732491	GE	On-Demand	Anodyne	CHRNA7	21	40
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCCC2)cc1	ZINC000853732491	GE	On-Demand	Anodyne	PRNP	43	41
CO[C@H](CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(F)(F)F	ZINC000853732508	ED	On-Demand	Anodyne	NPY5R	20	43
CO[C@H](CNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(F)(F)F	ZINC000853732510	ED	On-Demand	Anodyne	NPY5R	20	43
CN(C)C(=O)C1(CNC(=O)NNc2nc3ccc(Cl)cc3s2)CCCC1	ZINC000853732516	GG	On-Demand	Reactive	CSNK1D	36	42
CCCCCCCCn1cnc(C(=O)c2cccnc2)n1	ZINC000853732549	CG	On-Demand	Mild	TBXAS1	29	45
CC[C@H](C#N)Oc1cc(CNC(=O)N(CC)[C@@H]2CCN(CC)C2)ccc1OC	ZINC000853732585	GG	On-Demand	Mild	CCR5	23	50
CC[C@H](C#N)Oc1cc(CNC(=O)N(CC)[C@H]2CCN(CC)C2)ccc1OC	ZINC000853732587	GG	On-Demand	Mild	CCR5	23	50
O=C(c1ncn(CCOc2cccc(F)c2)n1)C1CCCCC1	ZINC000853732600	DG	On-Demand	Anodyne	HRH2	27	40
O=C(c1ncn(CCOc2cccc(F)c2)n1)C1CCCCC1	ZINC000853732600	DG	On-Demand	Anodyne	FAAH	15	43
O=C(c1ncn(CCOc2cccc(F)c2)n1)C1CCCCC1	ZINC000853732600	DG	On-Demand	Anodyne	CHRNA10	42	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(=O)c3cccnc3)n2)CC1	ZINC000853732609	GC	On-Demand	Anodyne	P2RY12	50	36
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(=O)c3cccnc3)n2)CC1	ZINC000853732610	GC	On-Demand	Anodyne	P2RY12	50	36
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3cccnc3)n2)CC1	ZINC000853732611	FF	On-Demand	Anodyne	GRIN2B	17	41
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3cccnc3)n2)CC1	ZINC000853732611	FF	On-Demand	Anodyne	GPR119	54	46
N#CCOc1ccc(Cl)cc1Cn1cnc(C(=O)C2CCCCC2)n1	ZINC000853732635	FH	On-Demand	Mild	PTGER1	40	39
CO[C@H](CNC(=O)N(CCN1CCOCC1)CC1CC1)C(F)(F)F	ZINC000853732673	FD	On-Demand	Anodyne	CASR	46	36
C#CCCN(CCOC)C(=O)NCCc1ccc(F)cc1Cl	ZINC000853732679	EF	On-Demand	Mild	P2RX7	39	40
CO[C@H](CNC(=O)N1CCCC[C@H]1c1nc[nH]n1)C(F)(F)F	ZINC000853732781	DD	On-Demand	Anodyne	CPT1A	72	34
CO[C@H](CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C(F)(F)F	ZINC000853732783	DD	On-Demand	Anodyne	CPT1A	72	34
COC[C@@H](NC(=O)NC[C@@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732794	FE	On-Demand	Anodyne	ROCK1	15	41
COC[C@@H](NC(=O)NC[C@@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732794	FE	On-Demand	Anodyne	ROCK2	16	41
COC[C@@H](NC(=O)NC[C@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732795	FE	On-Demand	Anodyne	ROCK1	15	41
COC[C@@H](NC(=O)NC[C@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732795	FE	On-Demand	Anodyne	ROCK2	16	41
COC[C@H](NC(=O)NC[C@@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732796	FE	On-Demand	Anodyne	ROCK1	15	41
COC[C@H](NC(=O)NC[C@@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732796	FE	On-Demand	Anodyne	ROCK2	16	41
COC[C@H](NC(=O)NC[C@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732797	FE	On-Demand	Anodyne	ROCK1	15	41
COC[C@H](NC(=O)NC[C@H](OC)C(F)(F)F)c1cccc(OC)c1	ZINC000853732797	FE	On-Demand	Anodyne	ROCK2	16	41
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)ccc1OC	ZINC000853732835	GF	On-Demand	Mild	FKBP1A	40	37
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)ccc1OC	ZINC000853732837	GF	On-Demand	Mild	FKBP1A	40	37
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCc2ccc(F)cc2Cl)C1	ZINC000853732856	GG	On-Demand	Anodyne	P2RX7	64	42
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCc2ccc(F)cc2Cl)C1	ZINC000853732857	GG	On-Demand	Anodyne	P2RX7	64	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853732872	GD	On-Demand	Anodyne	P2RY12	169	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853732873	GD	On-Demand	Anodyne	P2RY12	169	43
CC[C@H](C#N)Oc1cc(CNC(=O)N[C@H](C)C(C)(C)CC)ccc1OC	ZINC000853732886	FI	On-Demand	Mild	MT-ND1	19	41
CC[C@H](C#N)Oc1cc(CNC(=O)N[C@@H](C)C(C)(C)CC)ccc1OC	ZINC000853732887	FI	On-Demand	Mild	MT-ND1	19	41
O=C(Cn1cnc(C(=O)C2CCCCC2)n1)Nc1ccc2ccccc2c1	ZINC000853732890	FH	On-Demand	Anodyne	IMDH_CRYPV	32	44
CC[C@H](C#N)Oc1cc(CNC(=O)N(CC)[C@H]2CCN(C)C2)ccc1OC	ZINC000853732917	FF	On-Demand	Mild	CCR5	15	49
CC[C@H](C#N)Oc1cc(CNC(=O)N(CC)[C@@H]2CCN(C)C2)ccc1OC	ZINC000853732918	FF	On-Demand	Mild	CCR5	15	49
O=C(NCCc1ccc(F)cc1Cl)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853732962	EG	On-Demand	Anodyne	P2RX7	58	44
O=C(NCCc1ccc(F)cc1Cl)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853732963	EG	On-Demand	Anodyne	P2RX7	58	44
O=C(NCCc1ccc(F)cc1Cl)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853732964	EG	On-Demand	Anodyne	P2RX7	58	44
O=C(NCCc1ccc(F)cc1Cl)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853732965	EG	On-Demand	Anodyne	P2RX7	58	44
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)ccc1OC	ZINC000853733016	FE	On-Demand	Mild	LGMN	63	34
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)ccc1OC	ZINC000853733017	FE	On-Demand	Mild	LGMN	63	34
CCCCCCn1cnc(C(=O)c2cccnc2)n1	ZINC000853733038	CE	On-Demand	Anodyne	TBXAS1	29	45
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(C(=O)c3cccnc3)n2)C1	ZINC000853733075	FF	On-Demand	Anodyne	GPR119	46	43
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(C(=O)c3cccnc3)n2)C1	ZINC000853733076	FF	On-Demand	Anodyne	GPR119	46	43
Cn1c(S)nnc1CCNC(=O)NCCc1ccc(F)cc1Cl	ZINC000853733083	FD	On-Demand	Anodyne	P2RX7	66	44
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCC[C@H](C)[C@H]2CCO)ccc1OC	ZINC000853733085	GG	On-Demand	Mild	LGMN	65	34
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCC[C@H](C)[C@@H]2CCO)ccc1OC	ZINC000853733086	GG	On-Demand	Mild	LGMN	65	34
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCC[C@@H](C)[C@H]2CCO)ccc1OC	ZINC000853733087	GG	On-Demand	Mild	LGMN	65	34
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCC[C@@H](C)[C@@H]2CCO)ccc1OC	ZINC000853733088	GG	On-Demand	Mild	LGMN	65	34
O=C(Cn1cnc(C(=O)C2CCCCC2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733096	GF	On-Demand	Anodyne	MTOR	53	35
O=C(Cn1cnc(C(=O)C2CCCCC2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733096	GF	On-Demand	Anodyne	STAT6	53	32
O=[N+]([O-])c1ccc(N[C@H]2C[C@@H](O)[C@@H]2n2cccn2)c2nonc12	ZINC000853733288	DD	On-Demand	Bother	GSTM2	107	38
O=[N+]([O-])c1ccc(N[C@H]2C[C@@H](O)[C@@H]2n2cccn2)c2nonc12	ZINC000853733288	DD	On-Demand	Bother	GSTP1	66	37
CON(C)CCNC(=O)NCCc1ccc(F)cc1Cl	ZINC000853733354	DD	On-Demand	Anodyne	P2RX7	55	41
CCCCCCCCCn1cnc(C(=O)c2cccnc2)n1	ZINC000853733382	DH	On-Demand	Mild	TBXAS1	29	45
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853733387	GF	On-Demand	Anodyne	CHRNA7	18	41
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853733387	GF	On-Demand	Anodyne	PRNP	42	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2cnc(C(=O)c3cccnc3)n2)C1	ZINC000853733401	FD	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2cnc(C(=O)c3cccnc3)n2)C1	ZINC000853733402	FD	On-Demand	Anodyne	GPR119	22	41
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCCC[C@@H]2[C@@H](C)CO)ccc1OC	ZINC000853733411	GG	On-Demand	Mild	LGMN	59	33
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCCC[C@H]2[C@@H](C)CO)ccc1OC	ZINC000853733412	GG	On-Demand	Mild	LGMN	59	33
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCCC[C@@H]2[C@H](C)CO)ccc1OC	ZINC000853733413	GG	On-Demand	Mild	LGMN	59	33
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCCC[C@H]2[C@H](C)CO)ccc1OC	ZINC000853733414	GG	On-Demand	Mild	LGMN	59	33
O=C(Cn1cnc(C(=O)c2cccnc2)n1)NC1CCCCCCC1	ZINC000853733415	EE	On-Demand	Anodyne	C3AR1	40	39
Cc1ccc(OCCn2cnc(C(=O)C3CCCCC3)n2)cc1	ZINC000853733435	DG	On-Demand	Anodyne	HRH3	51	44
Cc1ccc(OCCn2cnc(C(=O)C3CCCCC3)n2)cc1	ZINC000853733435	DG	On-Demand	Anodyne	PSMB1	42	38
C[C@H](CS(C)(=O)=O)NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853733453	ED	On-Demand	Anodyne	ANPEP	16	40
CC[C@H](C#N)Oc1cc(CNC(=O)N2CCc3ccc(C)cc3C2)ccc1OC	ZINC000853733462	GH	On-Demand	Mild	HCRTR2	15	40
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	PIK3CA	32	43
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	CHRNA7	15	43
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	PRNP	42	40
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	JAK2	15	44
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	MAPKAPK5	41	36
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	MTOR	53	43
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	PIK3CG	20	43
O=C(Cn1cnc(C(=O)c2cccnc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733507	GD	On-Demand	Anodyne	STAT6	73	38
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCOc2cccc(C)c2)cc1	ZINC000853733516	GF	On-Demand	Mild	MTNR1B	17	42
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCOc2cccc(C)c2)cc1	ZINC000853733519	GF	On-Demand	Mild	MTNR1B	17	42
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2cnc(C(=O)c3ccccn3)n2)C1	ZINC000853733558	FD	On-Demand	Anodyne	GPR119	22	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2cnc(C(=O)c3ccccn3)n2)C1	ZINC000853733559	FD	On-Demand	Anodyne	GPR119	22	41
O=C(Cn1cnc(C(=O)c2ccncc2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853733560	GF	On-Demand	Anodyne	PRNP	37	40
CON=Cc1ccc(C(=O)OCC(=O)N(C)[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1	ZINC000853733561	JI	On-Demand	Mild	KCNK3	98	40
CON=Cc1ccc(C(=O)OCC(=O)N(C)[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1	ZINC000853733561	JI	On-Demand	Mild	KCNK9	58	35
CON=Cc1ccc(C(=O)OCC(=O)N(C)[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1	ZINC000853733562	JI	On-Demand	Mild	KCNK3	98	40
CON=Cc1ccc(C(=O)OCC(=O)N(C)[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1	ZINC000853733562	JI	On-Demand	Mild	KCNK9	58	35
CC(C)(C)OC(=O)N1CCC(CCCn2cnc(C(=O)c3ccncc3)n2)CC1	ZINC000853733583	GG	On-Demand	Anodyne	GPR119	55	46
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCc2cccc(OC)c2)cc1	ZINC000853733586	FF	On-Demand	Mild	MTNR1A	27	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCc2cccc(OC)c2)cc1	ZINC000853733586	FF	On-Demand	Mild	MTNR1B	28	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCc2cccc(OC)c2)cc1	ZINC000853733587	FF	On-Demand	Mild	MTNR1A	27	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCc2cccc(OC)c2)cc1	ZINC000853733587	FF	On-Demand	Mild	MTNR1B	28	40
CON=Cc1ccc(C(=O)OCC(=O)NCC2(c3ccccc3)CC2)cc1	ZINC000853733588	FF	On-Demand	Mild	KCNA3	48	38
CON=Cc1ccc(C(=O)OCC(=O)NCC2(c3ccccc3)CC2)cc1	ZINC000853733588	FF	On-Demand	Mild	NPFFR1	16	41
CC(C)(C)OC(=O)N1CCO[C@H](Cn2cnc(C(=O)c3ccncc3)n2)C1	ZINC000853733602	FD	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCO[C@@H](Cn2cnc(C(=O)c3ccncc3)n2)C1	ZINC000853733603	FD	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853733616	FG	On-Demand	Anodyne	CCR8	18	43
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853733616	FG	On-Demand	Anodyne	GPR119	56	47
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853733616	FG	On-Demand	Anodyne	SFRP1	22	40
CCCCCCn1cnc(C(=O)c2ccccn2)n1	ZINC000853733642	CE	On-Demand	Anodyne	FAAH	29	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(=O)c3ccncc3)n2)CC1	ZINC000853733646	GC	On-Demand	Anodyne	P2RY12	48	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(=O)c3ccncc3)n2)CC1	ZINC000853733647	GC	On-Demand	Anodyne	P2RY12	48	39
CON=Cc1ccc(C(=O)OCC(=O)NCc2ccc(OC(F)(F)F)cc2)cc1	ZINC000853733664	HG	On-Demand	Mild	GRIN2B	17	42
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733669	HF	On-Demand	Mild	DRD4	40	51
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733669	HF	On-Demand	Mild	CHRM3	17	48
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733669	HF	On-Demand	Mild	SIGMAR1	32	44
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733669	HF	On-Demand	Mild	CCR3	25	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733669	HF	On-Demand	Mild	MCHR1	22	43
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733669	HF	On-Demand	Mild	BIRC2	49	46
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733670	HF	On-Demand	Mild	DRD4	40	51
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733670	HF	On-Demand	Mild	CHRM3	17	48
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733670	HF	On-Demand	Mild	SIGMAR1	32	44
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733670	HF	On-Demand	Mild	CCR3	25	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733670	HF	On-Demand	Mild	MCHR1	22	43
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733670	HF	On-Demand	Mild	BIRC2	49	46
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733671	HF	On-Demand	Mild	DRD4	40	51
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733671	HF	On-Demand	Mild	CHRM3	17	48
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733671	HF	On-Demand	Mild	SIGMAR1	32	44
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733671	HF	On-Demand	Mild	CCR3	25	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733671	HF	On-Demand	Mild	MCHR1	22	43
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733671	HF	On-Demand	Mild	BIRC2	49	46
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733672	HF	On-Demand	Mild	DRD4	40	51
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733672	HF	On-Demand	Mild	CHRM3	17	48
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733672	HF	On-Demand	Mild	SIGMAR1	32	44
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733672	HF	On-Demand	Mild	CCR3	25	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733672	HF	On-Demand	Mild	MCHR1	22	43
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000853733672	HF	On-Demand	Mild	BIRC2	49	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733683	GC	On-Demand	Anodyne	P2RY12	116	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733684	GC	On-Demand	Anodyne	P2RY12	116	40
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(C(=O)c3ccncc3)n2)C1	ZINC000853733689	FF	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(C(=O)c3ccncc3)n2)C1	ZINC000853733690	FF	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853733695	GH	On-Demand	Anodyne	CCR8	16	42
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853733695	GH	On-Demand	Anodyne	GPR119	56	48
O=C(Cn1cnc(C(=O)c2ccc(F)cc2)n1)NC1CCCCCCC1	ZINC000853733698	FF	On-Demand	Anodyne	EPHX2	17	43
O=C(Cn1cnc(C(=O)c2ccc(F)cc2)n1)NC1CCCCCCC1	ZINC000853733698	FF	On-Demand	Anodyne	SCARB1	30	42
CC(C)(C)OC(=O)N1CCC(CCCn2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733706	GG	On-Demand	Anodyne	GRIN2B	21	40
CC(C)(C)OC(=O)N1CCC(CCCn2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733706	GG	On-Demand	Anodyne	GPR119	52	50
CON(C)CCNC(=O)NC[C@@H](C)Oc1ccccc1	ZINC000853733723	CD	On-Demand	Anodyne	MTNR1A	22	47
CON(C)CCNC(=O)NC[C@@H](C)Oc1ccccc1	ZINC000853733723	CD	On-Demand	Anodyne	MTNR1B	18	47
CON(C)CCNC(=O)NC[C@H](C)Oc1ccccc1	ZINC000853733724	CD	On-Demand	Anodyne	MTNR1A	22	47
CON(C)CCNC(=O)NC[C@H](C)Oc1ccccc1	ZINC000853733724	CD	On-Demand	Anodyne	MTNR1B	18	47
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2cnc(C(=O)c3ccccc3)n2)CC1	ZINC000853733743	GH	On-Demand	Anodyne	ACACB	17	46
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	EDNRB	18	43
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	TACR1	19	46
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	CCKAR	34	44
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	BRS3	27	43
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	NMBR	26	46
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	MTNR1A	15	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	GRPR	55	33
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	MMP9	17	45
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733748	GG	On-Demand	Mild	KISS1R	51	32
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	EDNRB	18	43
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	TACR1	19	46
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	CCKAR	34	44
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	BRS3	27	43
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	NMBR	26	46
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	MTNR1A	15	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	GRPR	55	33
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	MMP9	17	45
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000853733749	GG	On-Demand	Mild	KISS1R	51	32
C#CCCN(CCOC)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733772	GH	On-Demand	Mild	LPL	26	44
O=C(c1ccc(F)cc1)c1ncn(CCC2CCOCC2)n1	ZINC000853733777	DE	On-Demand	Anodyne	TTK	19	40
O=C(Cn1cnc(C(=O)c2ccccc2)n1)NC1CCCCCCC1	ZINC000853733818	EF	On-Demand	Anodyne	CNR1	16	43
O=C(Cn1cnc(C(=O)c2ccccc2)n1)NC1CCCCCCC1	ZINC000853733818	EF	On-Demand	Anodyne	EPHX2	19	46
O=C(Cn1cnc(C(=O)c2ccccc2)n1)NC1CCCCCCC1	ZINC000853733818	EF	On-Demand	Anodyne	TNKS	55	32
O=C(Cn1cnc(C(=O)c2ccccc2)n1)NC1CCCCCCC1	ZINC000853733818	EF	On-Demand	Anodyne	SCARB1	32	40
O=C(Cn1cc(I)ccc1=O)NC1CCCCCCC1	ZINC000853733819	GF	On-Demand	Anodyne	EPHX2	22	40
COC(=O)N(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733828	GF	On-Demand	Anodyne	LPL	21	40
COC(=O)N(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733828	GF	On-Demand	Anodyne	ROCK2	33	45
COC(=O)N(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733828	GF	On-Demand	Anodyne	NAMPT	23	42
CCCCCCCCn1cnc(C(=O)c2ccccn2)n1	ZINC000853733854	CG	On-Demand	Mild	FAAH	29	43
CCCCCCn1cnc(C(=O)c2ccccc2)n1	ZINC000853733861	CG	On-Demand	Anodyne	CNR1	18	44
CCCCCCn1cnc(C(=O)c2ccccc2)n1	ZINC000853733861	CG	On-Demand	Anodyne	CNR2	25	44
CCCCCCn1cnc(C(=O)c2ccccc2)n1	ZINC000853733861	CG	On-Demand	Anodyne	PLA2G4B	76	35
CCCCCCn1cnc(C(=O)c2ccccc2)n1	ZINC000853733861	CG	On-Demand	Anodyne	SOAT1	38	43
O=C(Cn1cnc(C(=O)c2ccncc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733868	GD	On-Demand	Anodyne	PIK3CA	33	43
O=C(Cn1cnc(C(=O)c2ccncc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733868	GD	On-Demand	Anodyne	MAPKAPK5	41	36
O=C(Cn1cnc(C(=O)c2ccncc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733868	GD	On-Demand	Anodyne	MTOR	61	43
O=C(Cn1cnc(C(=O)c2ccncc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733868	GD	On-Demand	Anodyne	PIK3CG	28	43
O=C(Cn1cnc(C(=O)c2ccncc2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853733868	GD	On-Demand	Anodyne	STAT6	53	32
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(C(=O)c3ccccn3)n2)C1	ZINC000853733871	FF	On-Demand	Anodyne	GPR119	46	48
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(C(=O)c3ccccn3)n2)C1	ZINC000853733872	FF	On-Demand	Anodyne	GPR119	46	48
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733878	GF	On-Demand	Anodyne	GRIN2B	22	40
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733878	GF	On-Demand	Anodyne	GPR119	55	53
O=C(Nc1ccccc1)Nc1cccc(CNC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853733883	GH	On-Demand	Anodyne	EPHX2	28	41
O=C(Nc1ccccc1)Nc1cccc(CNC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853733884	GH	On-Demand	Anodyne	EPHX2	28	41
O=C(Cn1cnc(C(=O)c2ccccc2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853733889	GG	On-Demand	Anodyne	KCNQ2	19	43
O=C(Cn1cnc(C(=O)c2ccccc2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853733889	GG	On-Demand	Anodyne	PRNP	49	38
O=C(NCCN1C(=O)CCC1=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853733928	FD	On-Demand	Reactive	CSNK1D	40	42
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733942	FF	On-Demand	Anodyne	GRIN2B	21	41
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733942	FF	On-Demand	Anodyne	GPR119	54	52
CON(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733950	FF	On-Demand	Anodyne	LPL	27	41
CON(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733950	FF	On-Demand	Anodyne	CCR3	21	40
CON(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733950	FF	On-Demand	Anodyne	ROCK2	35	46
CON(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733950	FF	On-Demand	Anodyne	EPHX2	16	42
CON(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733950	FF	On-Demand	Anodyne	NAMPT	24	42
CON(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733950	FF	On-Demand	Anodyne	KCNK3	40	34
CON(C)CCNC(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853733950	FF	On-Demand	Anodyne	PDS	40	32
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2cnc(C(=O)c3ccccn3)n2)CC1	ZINC000853733966	GG	On-Demand	Anodyne	ACACB	15	43
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733982	ID	On-Demand	Mild	CA2	33	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733982	ID	On-Demand	Mild	CA1	19	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733983	ID	On-Demand	Mild	CA2	33	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733983	ID	On-Demand	Mild	CA1	19	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733984	ID	On-Demand	Mild	CA2	33	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733984	ID	On-Demand	Mild	CA1	19	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733985	ID	On-Demand	Mild	CA2	33	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc(S(N)(=O)=O)cc2)cc1	ZINC000853733985	ID	On-Demand	Mild	CA1	19	40
CON=Cc1ccc(C(=O)OCC(=O)NCC2(c3ccccc3)CCCC2)cc1	ZINC000853733991	GG	On-Demand	Mild	KCNA3	46	38
CON=Cc1ccc(C(=O)OCC(=O)NCC2(c3ccccc3)CCCC2)cc1	ZINC000853733991	GG	On-Demand	Mild	NPFFR1	22	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)cc1	ZINC000853734008	GF	On-Demand	Mild	KCNK3	48	33
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)cc1	ZINC000853734009	GF	On-Demand	Mild	KCNK3	48	33
C[C@H](CS(C)(=O)=O)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853734049	FE	On-Demand	Reactive	CSNK1D	41	42
CCS(=O)(=O)C[C@@H](C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853734065	GE	On-Demand	Reactive	CSNK1D	42	43
CCS(=O)(=O)C[C@H](C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853734066	GE	On-Demand	Reactive	CSNK1D	42	43
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(C(=O)c3ccccc3)n2)C1	ZINC000853734082	FG	On-Demand	Anodyne	GPR119	49	44
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(C(=O)c3ccccc3)n2)C1	ZINC000853734083	FG	On-Demand	Anodyne	GPR119	49	44
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	CHRM2	17	42
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	CHRM1	16	42
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	DRD2	18	47
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	DRD4	42	46
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	ACHE	34	44
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	HTR4	19	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	CHRM3	25	42
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	LTA4H	17	40
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	SIGMAR1	41	49
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	SSTR5	50	38
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	SLC6A5	19	41
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734112	HF	On-Demand	Mild	MCHR1	37	48
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	CHRM2	17	42
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	CHRM1	16	42
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	DRD2	18	47
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	DRD4	42	46
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	ACHE	34	44
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	HTR4	19	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	CHRM3	25	42
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	LTA4H	17	40
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	SIGMAR1	41	49
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	SSTR5	50	38
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	SLC6A5	19	41
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000853734113	HF	On-Demand	Mild	MCHR1	37	48
O=C(Cn1cnc(C(=O)c2ccncc2)n1)Nc1ccc(N2CCCC2)cc1	ZINC000853734119	GE	On-Demand	Anodyne	PRNP	37	41
COC(=O)N(C)CCNC(=O)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000853734122	GE	On-Demand	Anodyne	F7	23	41
COC(=O)N(C)CCNC(=O)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000853734123	GE	On-Demand	Anodyne	F7	23	41
CC(C)(C)OC(=O)N1CCC(Cn2cnc(C(=O)c3ccncc3)n2)CC1	ZINC000853734153	FF	On-Demand	Anodyne	GPR119	55	48
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCCC2)cc1	ZINC000853734156	GE	On-Demand	Anodyne	PRNP	48	39
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCCC2)cc1	ZINC000853734156	GE	On-Demand	Anodyne	GRM4	50	39
COCCN(CCF)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853734158	GG	On-Demand	Anodyne	LPL	27	44
COCCN(CCF)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853734158	GG	On-Demand	Anodyne	ROCK2	29	40
COCCN(CCF)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1	ZINC000853734158	GG	On-Demand	Anodyne	KCNK3	40	33
CCCCC[C@@H](C)NC(=O)Cn1cc(I)ccc1=O	ZINC000853734161	GF	On-Demand	Anodyne	NOD1	51	33
CC(C)(C)OC(=O)N1CCC(CCn2cnc(C(=O)c3ccncc3)n2)CC1	ZINC000853734171	GF	On-Demand	Anodyne	GPR119	56	49
CON(C)CCNC(=O)N[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000853734172	FE	On-Demand	Anodyne	F7	24	42
CON(C)CCNC(=O)N[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000853734173	FE	On-Demand	Anodyne	F7	24	42
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cnc(C(=O)c3ccc(F)cc3)n2)C1	ZINC000853734185	GG	On-Demand	Anodyne	GPR119	51	42
CC(C)(C)OC(=O)N1CC[C@H](CCn2cnc(C(=O)c3ccc(F)cc3)n2)C1	ZINC000853734186	GG	On-Demand	Anodyne	GPR119	51	42
CON=Cc1ccc(C(=O)OCC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc1	ZINC000853734209	IC	On-Demand	Mild	PDGFRB	44	40
CCS(=O)(=O)C[C@@H](C)NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853734251	FD	On-Demand	Anodyne	ANPEP	16	41
CCS(=O)(=O)C[C@H](C)NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853734252	FD	On-Demand	Anodyne	ANPEP	16	41
O=C(Cn1cnc(C(=O)c2ccccn2)n1)NC1CCCCCCC1	ZINC000853734260	EE	On-Demand	Anodyne	EPHX2	17	50
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853734262	GF	On-Demand	Anodyne	PRNP	47	38
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCCCC2)cc1	ZINC000853734262	GF	On-Demand	Anodyne	GRM4	48	38
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734276	GD	On-Demand	Anodyne	PIK3CA	35	40
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734276	GD	On-Demand	Anodyne	PRNP	46	38
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734276	GD	On-Demand	Anodyne	MAPKAPK5	40	33
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734276	GD	On-Demand	Anodyne	MTOR	66	40
O=C(Cn1cnc(C(=O)c2ccccn2)n1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734276	GD	On-Demand	Anodyne	STAT6	55	35
CON=Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1	ZINC000853734293	GG	On-Demand	Mild	VIPR1	28	44
CON=Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1	ZINC000853734294	GG	On-Demand	Mild	VIPR1	28	44
O=[N+]([O-])c1cccc(OCCON=CC2CC2)c1	ZINC000853734305	CE	On-Demand	Mild	ACR	17	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CCC2CC2)CC2CC2)c1	ZINC000853734319	FI	On-Demand	Mild	PDS	42	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CCC2CC2)CC2CC2)c1	ZINC000853734320	FI	On-Demand	Mild	PDS	42	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@]2(C)CC2(C)C)c1	ZINC000853734322	DG	On-Demand	Mild	PDS	51	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@]2(C)CC2(C)C)c1	ZINC000853734323	DG	On-Demand	Mild	PDS	51	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@]2(C)CC2(C)C)c1	ZINC000853734324	DG	On-Demand	Mild	PDS	51	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@]2(C)CC2(C)C)c1	ZINC000853734325	DG	On-Demand	Mild	PDS	51	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC2(O)CCC(F)(F)CC2)c1	ZINC000853734338	GG	On-Demand	Mild	PDS	53	37
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC2(O)CCC(F)(F)CC2)c1	ZINC000853734340	GG	On-Demand	Mild	PDS	53	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734357	GH	On-Demand	Mild	ROCK1	27	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734357	GH	On-Demand	Mild	ROCK2	28	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734357	GH	On-Demand	Mild	BACE1	15	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734357	GH	On-Demand	Mild	PDS	51	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734358	GH	On-Demand	Mild	ROCK1	27	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734358	GH	On-Demand	Mild	ROCK2	28	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734358	GH	On-Demand	Mild	BACE1	15	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734358	GH	On-Demand	Mild	PDS	51	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734359	GH	On-Demand	Mild	ROCK1	27	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734359	GH	On-Demand	Mild	ROCK2	28	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734359	GH	On-Demand	Mild	BACE1	15	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](COC)c2cccc(OC)c2)c1	ZINC000853734359	GH	On-Demand	Mild	PDS	51	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734360	GH	On-Demand	Mild	ROCK1	27	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734360	GH	On-Demand	Mild	ROCK2	28	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734360	GH	On-Demand	Mild	BACE1	15	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](COC)c2cccc(OC)c2)c1	ZINC000853734360	GH	On-Demand	Mild	PDS	51	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC(O)(CO)CC2)c1	ZINC000853734363	ED	On-Demand	Mild	S1PR2	27	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC(O)(CO)CC2)c1	ZINC000853734363	ED	On-Demand	Mild	PDS	45	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC(O)(CO)CC2)c1	ZINC000853734364	ED	On-Demand	Mild	S1PR2	27	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC(O)(CO)CC2)c1	ZINC000853734364	ED	On-Demand	Mild	PDS	45	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)[C@H](CO)Cc2ccccc2)c1	ZINC000853734366	GG	On-Demand	Mild	NPY5R	20	46
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)[C@H](CO)Cc2ccccc2)c1	ZINC000853734366	GG	On-Demand	Mild	PDS	72	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)[C@@H](CO)Cc2ccccc2)c1	ZINC000853734367	GG	On-Demand	Mild	NPY5R	20	46
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(C)[C@@H](CO)Cc2ccccc2)c1	ZINC000853734367	GG	On-Demand	Mild	PDS	72	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)[C@H](CO)Cc2ccccc2)c1	ZINC000853734368	GG	On-Demand	Mild	NPY5R	20	46
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)[C@H](CO)Cc2ccccc2)c1	ZINC000853734368	GG	On-Demand	Mild	PDS	72	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)[C@@H](CO)Cc2ccccc2)c1	ZINC000853734369	GG	On-Demand	Mild	NPY5R	20	46
CC[C@H](C#N)Oc1cccc(CNC(=O)N(C)[C@@H](CO)Cc2ccccc2)c1	ZINC000853734369	GG	On-Demand	Mild	PDS	72	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)NNc2cc(F)ccc2C)c1	ZINC000853734403	FH	On-Demand	Reactive	PDS	51	38
CC[C@H](C#N)Oc1cccc(CNC(=O)NNc2cc(F)ccc2C)c1	ZINC000853734404	FH	On-Demand	Reactive	PDS	51	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@@H](C)CO)c1	ZINC000853734405	FG	On-Demand	Mild	LGMN	49	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2[C@H](C)CO)c1	ZINC000853734406	FG	On-Demand	Mild	LGMN	49	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2[C@H](C)CO)c1	ZINC000853734407	FG	On-Demand	Mild	LGMN	49	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2[C@@H](C)CO)c1	ZINC000853734408	FG	On-Demand	Mild	LGMN	49	36
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	TSHR	59	36
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	MME	15	42
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	LTA4H	42	58
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	CTSK	18	41
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	ADAM17	31	48
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	TIMP3	85	41
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	MMP2	18	44
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	CAPN1	39	40
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	MMP9	19	41
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	CAPN2	46	37
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853734424	EI	On-Demand	Mild	ACE2	28	42
COc1ccc(NC(=O)[C@H](C)ON=CC2CC2)cc1OC	ZINC000853734427	CE	On-Demand	Mild	ENPP1	68	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H](C)[C@](C)(CO)C2)c1	ZINC000853734467	EF	On-Demand	Mild	PDS	40	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H](C)[C@@](C)(CO)C2)c1	ZINC000853734468	EF	On-Demand	Mild	PDS	40	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H](C)[C@](C)(CO)C2)c1	ZINC000853734469	EF	On-Demand	Mild	PDS	40	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H](C)[C@@](C)(CO)C2)c1	ZINC000853734471	EF	On-Demand	Mild	PDS	40	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC(C)(C2CC2)C2CC2)c1	ZINC000853734527	EH	On-Demand	Mild	PDS	52	37
CC[C@H](C#N)Oc1cccc(CNC(=O)NC(C)(C2CC2)C2CC2)c1	ZINC000853734530	EH	On-Demand	Mild	PDS	52	37
COc1cc2c(cc1OC)CN(C(=O)CON=CC1CC1)CC2	ZINC000853734542	DE	On-Demand	Mild	SLC18A2	40	34
COc1cc2c(cc1OC)CN(C(=O)CON=CC1CC1)CC2	ZINC000853734542	DE	On-Demand	Mild	ABCB1B	49	31
COc1cc2c(cc1OC)CN(C(=O)CON=CC1CC1)CC2	ZINC000853734542	DE	On-Demand	Mild	ABCB1	19	52
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC2(COC)CCCC2)c1	ZINC000853734543	EG	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NC2(COC)CCCC2)c1	ZINC000853734545	EG	On-Demand	Mild	PDS	43	36
O=C(CON=CC1CC1)NCc1ccc(F)cc1C(F)(F)F	ZINC000853734553	DF	On-Demand	Mild	P2RX7	39	50
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC[C@@H](C)N(C)C)c1	ZINC000853734581	EF	On-Demand	Mild	PDS	56	38
O=C(CON=CC1CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734583	DD	On-Demand	Mild	MTOR	64	35
O=C(CON=CC1CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734583	DD	On-Demand	Mild	EPHX2	15	44
O=C(CON=CC1CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853734583	DD	On-Demand	Mild	STAT6	52	33
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC[C@H](C)N(C)C)c1	ZINC000853734585	EF	On-Demand	Mild	PDS	56	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC[C@H](C)N(C)C)c1	ZINC000853734586	EF	On-Demand	Mild	PDS	56	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC[C@@H](C)N(C)C)c1	ZINC000853734587	EF	On-Demand	Mild	PDS	56	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H]2C[C@H](O)C2)c1	ZINC000853734588	DD	On-Demand	Mild	PDS	61	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H]2C[C@H](O)C2)c1	ZINC000853734589	DD	On-Demand	Mild	PDS	61	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](O)C(C)C)c1	ZINC000853734592	GH	On-Demand	Mild	NR3C2	15	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](O)C(C)C)c1	ZINC000853734592	GH	On-Demand	Mild	PDS	85	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@H](O)C(C)C)c1	ZINC000853734593	GH	On-Demand	Mild	NR3C2	15	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@H](O)C(C)C)c1	ZINC000853734593	GH	On-Demand	Mild	PDS	85	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](O)C(C)C)c1	ZINC000853734594	GH	On-Demand	Mild	NR3C2	15	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](O)C(C)C)c1	ZINC000853734594	GH	On-Demand	Mild	PDS	85	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](O)C(C)C)c1	ZINC000853734595	GH	On-Demand	Mild	NR3C2	15	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](O)C(C)C)c1	ZINC000853734595	GH	On-Demand	Mild	PDS	85	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)c1	ZINC000853734598	EE	On-Demand	Mild	PDS	43	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)c1	ZINC000853734599	EE	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@@H](C)C(O)[C@H](C)C2)c1	ZINC000853734601	EF	On-Demand	Mild	PDS	44	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c1	ZINC000853734602	EF	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c1	ZINC000853734603	EF	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2C[C@H](C)C(O)[C@@H](C)C2)c1	ZINC000853734604	EF	On-Demand	Mild	PDS	44	37
O=C(CON=CC1CC1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853734606	EI	On-Demand	Mild	KCNA5	17	40
O=C(CON=CC1CC1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853734606	EI	On-Demand	Mild	CPT1A	92	35
O=C(CON=CC1CC1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853734607	EI	On-Demand	Mild	KCNA5	17	40
O=C(CON=CC1CC1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853734607	EI	On-Demand	Mild	CPT1A	92	35
COc1cccc(OCCON=CC2CC2)c1	ZINC000853734614	BE	On-Demand	Mild	CHRNA10	26	43
C(=NOCCc1ccccc1)C1CC1	ZINC000853734617	AF	On-Demand	Mild	SLC18A2	42	38
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	ACE	67	37
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	MME	77	37
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	TIMP3	78	36
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	MMP2	20	48
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	MMP3	30	41
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	CAPN1	55	38
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	CAPN2	47	38
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	ACE2	40	34
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	MMP1	18	40
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	NPR	67	40
C[C@@H](ON=CC1CC1)C(=O)NCCc1ccccc1	ZINC000853734630	CE	On-Demand	Mild	AMP1_PLAFQ	52	46
COc1ccc(OC)c([C@H](C)NC(=O)CON=CC2CC2)c1	ZINC000853734636	DE	On-Demand	Mild	MTNR1A	41	37
COc1ccc(NC(=O)[C@H](C)ON=CC2CC2)c(OC)c1	ZINC000853734693	CE	On-Demand	Mild	CYP1B1	21	46
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc(Br)c1	ZINC000853734699	DG	On-Demand	Mild	TIMP3	61	32
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H]2CCN(CC)C2)c1	ZINC000853734714	FF	On-Demand	Mild	CCR5	66	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H]2CCN(CC)C2)c1	ZINC000853734716	FF	On-Demand	Mild	CCR5	66	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H]2CCN(CC)C2)c1	ZINC000853734717	FF	On-Demand	Mild	CCR5	66	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H]2CCN(CC)C2)c1	ZINC000853734718	FF	On-Demand	Mild	CCR5	66	39
O=C(CON=CC1CC1)NCCOc1ccc2c(c1)OCO2	ZINC000853734755	DD	On-Demand	Mild	NOS2	56	32
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)c1	ZINC000853734761	FG	On-Demand	Mild	NR3C2	19	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)c1	ZINC000853734761	FG	On-Demand	Mild	CAPN2	47	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@H](C)O)c1	ZINC000853734761	FG	On-Demand	Mild	PDS	74	42
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)c1	ZINC000853734762	FG	On-Demand	Mild	NR3C2	19	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)c1	ZINC000853734762	FG	On-Demand	Mild	CAPN2	47	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@H](C)O)c1	ZINC000853734762	FG	On-Demand	Mild	PDS	74	42
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)c1	ZINC000853734764	FG	On-Demand	Mild	NR3C2	19	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)c1	ZINC000853734764	FG	On-Demand	Mild	CAPN2	47	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2ccccc2)[C@@H](C)O)c1	ZINC000853734764	FG	On-Demand	Mild	PDS	74	42
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)c1	ZINC000853734766	FG	On-Demand	Mild	NR3C2	19	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)c1	ZINC000853734766	FG	On-Demand	Mild	CAPN2	47	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2ccccc2)[C@@H](C)O)c1	ZINC000853734766	FG	On-Demand	Mild	PDS	74	42
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(Cl)cc1	ZINC000853734776	CG	On-Demand	Mild	TIMP3	47	32
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2C[C@@H](C)OC[C@H]2C)c1	ZINC000853734779	FE	On-Demand	Mild	PDS	46	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2C[C@@H](C)OC[C@@H]2C)c1	ZINC000853734781	FE	On-Demand	Mild	PDS	46	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2C[C@H](C)OC[C@H]2C)c1	ZINC000853734783	FE	On-Demand	Mild	PDS	46	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN2C[C@H](C)OC[C@@H]2C)c1	ZINC000853734784	FE	On-Demand	Mild	PDS	46	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC2(c3cccc(OC)c3)CCC2)c1	ZINC000853734792	GI	On-Demand	Mild	ROCK2	24	40
CC[C@H](C#N)Oc1cccc(CNC(=O)NC2(c3cccc(OC)c3)CCC2)c1	ZINC000853734793	GI	On-Demand	Mild	ROCK2	24	40
O=C(CON=CC1CC1)NCCOc1cccc(C(F)(F)F)c1	ZINC000853734794	EF	On-Demand	Mild	GALR3	49	32
O=C(CON=CC1CC1)NCCOc1cccc(C(F)(F)F)c1	ZINC000853734794	EF	On-Demand	Mild	PDS	48	46
CCCOc1cccc(CNC(=O)CON=CC2CC2)c1	ZINC000853734805	CF	On-Demand	Mild	UPP1	15	41
CCCOc1cccc(CNC(=O)CON=CC2CC2)c1	ZINC000853734805	CF	On-Demand	Mild	MTNR1A	46	42
CCCOc1cccc(CNC(=O)CON=CC2CC2)c1	ZINC000853734805	CF	On-Demand	Mild	ROCK2	19	44
CCCOc1cccc(CNC(=O)CON=CC2CC2)c1	ZINC000853734805	CF	On-Demand	Mild	PDS	63	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000853734806	FF	On-Demand	Mild	CPT1A	104	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000853734807	FF	On-Demand	Mild	CPT1A	104	44
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000853734808	FF	On-Demand	Mild	CPT1A	104	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000853734809	FF	On-Demand	Mild	CPT1A	104	44
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734812	EE	On-Demand	Mild	F2	15	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734812	EE	On-Demand	Mild	DPP4	18	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734812	EE	On-Demand	Mild	LGMN	59	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734812	EE	On-Demand	Mild	TMPRSS11D	40	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734812	EE	On-Demand	Mild	PDS	40	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734813	EE	On-Demand	Mild	F2	15	43
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734813	EE	On-Demand	Mild	DPP4	18	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734813	EE	On-Demand	Mild	LGMN	59	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734813	EE	On-Demand	Mild	TMPRSS11D	40	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734813	EE	On-Demand	Mild	PDS	40	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734814	EE	On-Demand	Mild	F2	15	43
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734814	EE	On-Demand	Mild	DPP4	18	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734814	EE	On-Demand	Mild	LGMN	59	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734814	EE	On-Demand	Mild	TMPRSS11D	40	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)c1	ZINC000853734814	EE	On-Demand	Mild	PDS	40	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734815	EE	On-Demand	Mild	F2	15	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734815	EE	On-Demand	Mild	DPP4	18	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734815	EE	On-Demand	Mild	LGMN	59	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734815	EE	On-Demand	Mild	TMPRSS11D	40	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)c1	ZINC000853734815	EE	On-Demand	Mild	PDS	40	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@](C)(CC)C2CC2)c1	ZINC000853734816	EH	On-Demand	Mild	PDS	43	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@](C)(CC)C2CC2)c1	ZINC000853734817	EH	On-Demand	Mild	PDS	43	36
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@](C)(CC)C2CC2)c1	ZINC000853734818	EH	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@](C)(CC)C2CC2)c1	ZINC000853734819	EH	On-Demand	Mild	PDS	43	36
N#Cc1cccc(OCCCON=CC2CC2)c1	ZINC000853734820	BF	On-Demand	Mild	CHRNA10	32	47
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2nccn2C)C(C)(C)CO)c1	ZINC000853734846	GF	On-Demand	Mild	PDS	42	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2nccn2C)C(C)(C)CO)c1	ZINC000853734848	GF	On-Demand	Mild	PDS	42	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](c2nccn2C)C(C)(C)CO)c1	ZINC000853734849	GF	On-Demand	Mild	PDS	42	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](c2nccn2C)C(C)(C)CO)c1	ZINC000853734850	GF	On-Demand	Mild	PDS	42	35
C[C@@H](ON=CC1CC1)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000853734854	CG	On-Demand	Mild	ACE	24	42
C[C@@H](ON=CC1CC1)c1nc(-c2cccs2)no1	ZINC000853734857	CG	On-Demand	Mild	ETHR	31	42
C[C@H]1CCc2ccccc2N1C(=O)[C@@H](C)ON=CC1CC1	ZINC000853734858	CG	On-Demand	Mild	ACE	24	42
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC3CC2(C)C3)c1	ZINC000853734881	DG	On-Demand	Mild	PDS	44	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC3CC2(C)C3)c1	ZINC000853734884	DG	On-Demand	Mild	PDS	44	36
O=C(CON=CC1CC1)NCC1(c2ccccc2)CCOCC1	ZINC000853734888	DE	On-Demand	Mild	KCNA3	48	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734890	FG	On-Demand	Mild	HRH2	21	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734890	FG	On-Demand	Mild	PDS	69	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734893	FG	On-Demand	Mild	HRH2	21	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734893	FG	On-Demand	Mild	PDS	69	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734895	FG	On-Demand	Mild	HRH2	21	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734895	FG	On-Demand	Mild	PDS	69	43
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734898	FG	On-Demand	Mild	HRH2	21	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](C(C)C)C2(CO)CCC2)c1	ZINC000853734898	FG	On-Demand	Mild	PDS	69	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)c1	ZINC000853734915	EF	On-Demand	Mild	PDS	43	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)c1	ZINC000853734917	EF	On-Demand	Mild	PDS	43	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC(S(C)(=O)=O)C2)c1	ZINC000853734933	FD	On-Demand	Mild	PDS	57	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC(S(C)(=O)=O)C2)c1	ZINC000853734936	FD	On-Demand	Mild	PDS	57	39
O=C(CON=CC1CC1)N[C@@H]1CCOc2ccccc21	ZINC000853734943	CE	On-Demand	Mild	BDKRB1	21	40
O=C(CON=CC1CC1)N[C@@H]1CCOc2ccccc21	ZINC000853734943	CE	On-Demand	Mild	LUXR	66	37
O=C(CON=CC1CC1)N[C@@H]1CCOc2ccccc21	ZINC000853734943	CE	On-Demand	Mild	TRAR	83	38
O=C(CON=CC1CC1)N[C@@H]1CCOc2ccccc21	ZINC000853734943	CE	On-Demand	Mild	LASR	52	37
O=C(CON=CC1CC1)N[C@H]1CCOc2ccccc21	ZINC000853734945	CE	On-Demand	Mild	BDKRB1	21	40
O=C(CON=CC1CC1)N[C@H]1CCOc2ccccc21	ZINC000853734945	CE	On-Demand	Mild	LUXR	66	37
O=C(CON=CC1CC1)N[C@H]1CCOc2ccccc21	ZINC000853734945	CE	On-Demand	Mild	TRAR	83	38
O=C(CON=CC1CC1)N[C@H]1CCOc2ccccc21	ZINC000853734945	CE	On-Demand	Mild	LASR	52	37
COc1ccc(NC(=O)[C@H](C)ON=CC2CC2)cc1	ZINC000853734951	CE	On-Demand	Mild	TIMP3	52	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCCc2nc[nH]n2)c1	ZINC000853734954	ED	On-Demand	Mild	HRH2	27	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCCc2nc[nH]n2)c1	ZINC000853734954	ED	On-Demand	Mild	PDS	49	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCCc2nc[nH]n2)c1	ZINC000853734957	ED	On-Demand	Mild	HRH2	27	40
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCCc2nc[nH]n2)c1	ZINC000853734957	ED	On-Demand	Mild	PDS	49	36
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(I)cc1	ZINC000853734969	FG	On-Demand	Mild	TIMP3	47	32
C=CCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@@H](C)COC	ZINC000853734983	EG	On-Demand	Mild	PDS	52	38
C=CCN(C(=O)NCc1cccc(O[C@@H](C#N)CC)c1)[C@H](C)COC	ZINC000853734985	EG	On-Demand	Mild	PDS	52	38
C=CCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@@H](C)COC	ZINC000853734986	EG	On-Demand	Mild	PDS	52	38
C=CCN(C(=O)NCc1cccc(O[C@H](C#N)CC)c1)[C@H](C)COC	ZINC000853734987	EG	On-Demand	Mild	PDS	52	38
C(=NOCCOC(c1ccccc1)c1ccccc1)C1CC1	ZINC000853735015	CI	On-Demand	Mild	SLC6A4	18	41
C(=NOCCOC(c1ccccc1)c1ccccc1)C1CC1	ZINC000853735015	CI	On-Demand	Mild	SLC6A3	51	45
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2C[C@@H](C(=O)OC)C2)c1	ZINC000853735016	EE	On-Demand	Mild	PDS	50	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2C[C@@H](C(=O)OC)C2)c1	ZINC000853735017	EE	On-Demand	Mild	PDS	50	37
O=C(CON=CC1CC1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853735018	DD	On-Demand	Mild	ST14	16	40
NC(=O)c1cccc(CON=CC2CC2)c1	ZINC000853735036	BD	On-Demand	Mild	KCNH2	40	39
O=C(c1cccc(CON=CC2CC2)c1)N1CCCCC1	ZINC000853735037	CG	On-Demand	Mild	PREP	35	41
O=C(c1cccc(CON=CC2CC2)c1)N1CCCCC1	ZINC000853735037	CG	On-Demand	Mild	PARP1	15	43
O=C(c1cccc(CON=CC2CC2)c1)N1CCCCC1	ZINC000853735037	CG	On-Demand	Mild	L3MBTL3	69	44
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC2(O)CCC(C)(C)CC2)c1	ZINC000853735041	FG	On-Demand	Mild	PDS	50	37
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC2(O)CCC(C)(C)CC2)c1	ZINC000853735044	FG	On-Demand	Mild	PDS	50	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCn3c(O)nnc3C2)c1	ZINC000853735058	FD	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCn3c(O)nnc3C2)c1	ZINC000853735060	FD	On-Demand	Mild	PDS	49	38
CCOc1ccccc1NC(=O)[C@@H](C)ON=CC1CC1	ZINC000853735071	CF	On-Demand	Mild	TIMP3	65	33
CCOc1ccccc1NC(=O)[C@H](C)ON=CC1CC1	ZINC000853735072	CF	On-Demand	Mild	TIMP3	65	33
Cc1ccccc1CNC(=O)CON=CC1CC1	ZINC000853735073	BE	On-Demand	Mild	P2RX7	19	45
Cc1ccccc1CNC(=O)CON=CC1CC1	ZINC000853735073	BE	On-Demand	Mild	AMP1_PLAFQ	17	43
CNC(=O)[C@@H](NC(=O)CON=CC1CC1)c1ccccc1	ZINC000853735076	CD	On-Demand	Mild	MMP1	16	46
C(=NOCc1cncn1Cc1ccccc1)C1CC1	ZINC000853735082	CF	On-Demand	Mild	CYP11B1	15	46
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCN(S(=O)(=O)NC)CC2)c1	ZINC000853735088	GC	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCN(S(=O)(=O)NC)CC2)c1	ZINC000853735091	GC	On-Demand	Mild	PDS	44	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC2(CC(C)C)CC2)c1	ZINC000853735093	EH	On-Demand	Mild	PDS	47	37
CC[C@H](C#N)Oc1cccc(CNC(=O)NC2(CC(C)C)CC2)c1	ZINC000853735094	EH	On-Demand	Mild	PDS	47	37
COc1ccc([C@@H]2CCCCCN2C(=O)CON=CC2CC2)cc1	ZINC000853735096	EH	On-Demand	Mild	CPT1A	116	44
C(=NOCCCCc1ccccc1)C1CC1	ZINC000853735097	BG	On-Demand	Mild	SLC18A2	31	40
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853735113	DG	On-Demand	Mild	EPHX2	28	43
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853735113	DG	On-Demand	Mild	TRPM8	40	35
COc1ccccc1CNC(=O)[C@@H](C)ON=CC1CC1	ZINC000853735133	CE	On-Demand	Mild	TACR1	18	41
COc1ccccc1CNC(=O)[C@@H](C)ON=CC1CC1	ZINC000853735133	CE	On-Demand	Mild	KCNA3	40	34
COc1ccccc1CNC(=O)[C@@H](C)ON=CC1CC1	ZINC000853735133	CE	On-Demand	Mild	MBTPS1	45	33
COc1ccccc1CNC(=O)[C@H](C)ON=CC1CC1	ZINC000853735134	CE	On-Demand	Mild	TACR1	18	41
COc1ccccc1CNC(=O)[C@H](C)ON=CC1CC1	ZINC000853735134	CE	On-Demand	Mild	KCNA3	40	34
COc1ccccc1CNC(=O)[C@H](C)ON=CC1CC1	ZINC000853735134	CE	On-Demand	Mild	MBTPS1	45	33
O=S(=O)(c1ccc(OCCON=CC2CC2)cc1)N1CCOCC1	ZINC000853735136	FD	On-Demand	Mild	MMP13	20	40
O=S(=O)(c1ccc(OCCON=CC2CC2)cc1)N1CCOCC1	ZINC000853735136	FD	On-Demand	Mild	MMP7	15	40
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc(F)c1	ZINC000853735144	CF	On-Demand	Mild	TIMP3	40	32
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC(O)(C2CC2)C2CC2)c1	ZINC000853735149	FF	On-Demand	Mild	PDS	49	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC(O)(C2CC2)C2CC2)c1	ZINC000853735156	FF	On-Demand	Mild	PDS	49	36
C[C@@H](ON=CC1CC1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853735160	DG	On-Demand	Mild	RBP4	81	38
O=C(CON=CC1CC1)Nc1ccccc1N1CCCC1=O	ZINC000853735168	DE	On-Demand	Mild	KCNQ2	67	38
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000853735170	CH	On-Demand	Mild	TRPV1	19	43
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(C(C)(C)C)cc1	ZINC000853735170	CH	On-Demand	Mild	TIMP3	40	31
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CCN(C)C)CC(=O)N(C)C)c1	ZINC000853735174	GD	On-Demand	Mild	PDS	40	35
COc1ccccc1N1CC[C@H](ON=CC2CC2)C1=O	ZINC000853735176	CE	On-Demand	Mild	HTR1A	40	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CCN(C)C)CC(=O)N(C)C)c1	ZINC000853735177	GD	On-Demand	Mild	PDS	40	35
COc1ccccc1N1CC[C@@H](ON=CC2CC2)C1=O	ZINC000853735178	CE	On-Demand	Mild	HTR1A	40	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC(S(=O)(=O)CC)C2)c1	ZINC000853735180	FD	On-Demand	Mild	PDS	51	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC(S(=O)(=O)CC)C2)c1	ZINC000853735182	FD	On-Demand	Mild	PDS	51	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)c2cccc(C#N)c2)c1	ZINC000853735196	GH	On-Demand	Mild	PDS	64	47
CC[C@H](C#N)Oc1cccc(CNC(=O)NC(C)(C)c2cccc(C#N)c2)c1	ZINC000853735197	GH	On-Demand	Mild	PDS	64	47
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC/C=C\CO)c1	ZINC000853735199	DD	On-Demand	Mild	PDS	56	38
CC[C@H](C#N)Oc1cccc(CNC(=O)NC/C=C/CO)c1	ZINC000853735200	DD	On-Demand	Mild	PDS	56	38
CC[C@H](C#N)Oc1cccc(CNC(=O)NC/C=C\CO)c1	ZINC000853735201	DD	On-Demand	Mild	PDS	56	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC/C=C/CO)c1	ZINC000853735202	DD	On-Demand	Mild	PDS	56	38
N#Cc1cccc(OCCON=CC2CC2)c1	ZINC000853735203	BE	On-Demand	Mild	CHRNA10	39	48
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC(Cc3ccc(C)cc3)C2)c1	ZINC000853735211	GI	On-Demand	Mild	PDS	40	35
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC(Cc3ccc(C)cc3)C2)c1	ZINC000853735212	GI	On-Demand	Mild	PDS	40	35
O=[N+]([O-])c1cccc(CON=CC2CC2)c1	ZINC000853735239	BF	On-Demand	Mild	CACNA1C	40	37
O=[N+]([O-])c1cccc(CON=CC2CC2)c1	ZINC000853735239	BF	On-Demand	Mild	CACNA1D	70	37
COc1ccc(-n2c(C)nnc2SCC(=O)O[C@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1	ZINC000853735245	JH	On-Demand	Mild	VIPR1	27	49
COc1ccc(-n2c(C)nnc2SCC(=O)O[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)cc1	ZINC000853735248	JH	On-Demand	Mild	VIPR1	27	49
CSc1ccc(NC(=O)[C@H](C)ON=CC2CC2)cc1	ZINC000853735278	CG	On-Demand	Mild	TIMP3	40	31
CSc1ccc(NC(=O)[C@@H](C)ON=CC2CC2)cc1	ZINC000853735279	CG	On-Demand	Mild	TIMP3	40	31
C[C@H](NC(=O)c1ccccc1NC(=O)CON=CC1CC1)c1ccccc1	ZINC000853735288	FH	On-Demand	Mild	MTTP	65	35
C[C@@H](NC(=O)c1ccccc1NC(=O)CON=CC1CC1)c1ccccc1	ZINC000853735290	FH	On-Demand	Mild	MTTP	65	35
COc1ccc([C@@H]2CCCN2C(=O)CON=CC2CC2)c(OC)c1	ZINC000853735311	EF	On-Demand	Mild	CPT1A	67	36
O=C(CON=CC1CC1)NCc1cccc(OCC(F)(F)F)c1	ZINC000853735325	EF	On-Demand	Mild	PDS	61	39
CCCCC[C@@H](C)NC(=O)CON=CC1CC1	ZINC000853735358	BE	On-Demand	Mild	NOD1	56	34
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CON=CC1CC1	ZINC000853735385	DG	On-Demand	Mild	OPRK1	22	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)c1	ZINC000853735415	FE	On-Demand	Mild	PDS	46	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@H](O)C(F)(F)C2)c1	ZINC000853735416	FE	On-Demand	Mild	PDS	46	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)c1	ZINC000853735417	FE	On-Demand	Mild	PDS	46	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@H](O)C(F)(F)C2)c1	ZINC000853735418	FE	On-Demand	Mild	PDS	46	37
C[C@H](NC(=O)[C@@H](C)ON=CC1CC1)c1ccccc1	ZINC000853735422	CF	On-Demand	Mild	TIMP3	56	33
C[C@H](NC(=O)[C@@H](C)ON=CC1CC1)c1ccccc1	ZINC000853735422	CF	On-Demand	Mild	BIRC8	44	31
C[C@@H](ON=CC1CC1)C(=O)N[C@H](C)c1ccccc1	ZINC000853735424	CF	On-Demand	Mild	TIMP3	56	33
C[C@@H](ON=CC1CC1)C(=O)N[C@H](C)c1ccccc1	ZINC000853735424	CF	On-Demand	Mild	BIRC8	44	31
O=C(CON=CC1CC1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853735469	DD	On-Demand	Mild	KCNK3	64	33
COc1ccc(CNC(=O)[C@H](C)ON=CC2CC2)cc1OC	ZINC000853735497	DE	On-Demand	Mild	TRPV1	19	41
COc1ccc(CNC(=O)[C@H](C)ON=CC2CC2)cc1OC	ZINC000853735497	DE	On-Demand	Mild	MT-ND1	19	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](C)CC)c1	ZINC000853735516	DH	On-Demand	Mild	AMP1_PLAFQ	15	40
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](C)CC)c1	ZINC000853735516	DH	On-Demand	Mild	PDS	64	39
CC[C@H](C)N(CC)C(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000853735518	DH	On-Demand	Mild	AMP1_PLAFQ	15	40
CC[C@H](C)N(CC)C(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000853735518	DH	On-Demand	Mild	PDS	64	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H](C)CC)c1	ZINC000853735520	DH	On-Demand	Mild	AMP1_PLAFQ	15	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H](C)CC)c1	ZINC000853735520	DH	On-Demand	Mild	PDS	64	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](C)CC)c1	ZINC000853735522	DH	On-Demand	Mild	AMP1_PLAFQ	15	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H](C)CC)c1	ZINC000853735522	DH	On-Demand	Mild	PDS	64	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853735524	FG	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853735525	FG	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853735527	FG	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853735528	FG	On-Demand	Mild	PDS	44	37
CC(=O)c1cccc(NC(=O)CON=CC2CC2)c1	ZINC000853735531	CE	On-Demand	Mild	KCNK3	61	33
CC(=O)c1cccc(NC(=O)CON=CC2CC2)c1	ZINC000853735531	CE	On-Demand	Mild	KCNK9	42	33
CC[C@@H](C#N)Oc1cccc(CNC(=O)NNc2ccc(C)c(F)c2)c1	ZINC000853735534	FH	On-Demand	Reactive	PDS	51	35
CC[C@H](C#N)Oc1cccc(CNC(=O)NNc2ccc(C)c(F)c2)c1	ZINC000853735536	FH	On-Demand	Reactive	PDS	51	35
COc1ccc(OC)c([C@H]2CCCN2C(=O)CON=CC2CC2)c1	ZINC000853735539	EF	On-Demand	Mild	CPT1A	58	38
C=CCCC(C)(C)NC(=O)NCc1cccc(O[C@H](C#N)CC)c1	ZINC000853735545	EH	On-Demand	Mild	PDS	43	35
O=C(CON=CC1CC1)N1CCN(c2ccccc2F)CC1	ZINC000853735546	DD	On-Demand	Mild	SSTR1	25	40
C=CCCC(C)(C)NC(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000853735547	EH	On-Demand	Mild	PDS	43	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@H](O)CC)c1	ZINC000853735554	DD	On-Demand	Mild	PDS	70	39
CC[C@@H](O)CNC(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC000853735555	DD	On-Demand	Mild	PDS	70	39
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC2CCC(O)CC2)c1	ZINC000853735557	EF	On-Demand	Mild	PDS	44	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC2CCC(O)CC2)c1	ZINC000853735559	EF	On-Demand	Mild	PDS	44	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCCN(C)OC)c1	ZINC000853735561	DD	On-Demand	Mild	PDS	55	37
CC[C@H](C#N)Oc1cccc(CNC(=O)NCCN(C)OC)c1	ZINC000853735562	DD	On-Demand	Mild	PDS	55	37
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC(=O)N(C)CC2)c1	ZINC000853735564	ED	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC(=O)N(C)CC2)c1	ZINC000853735566	ED	On-Demand	Mild	PDS	43	36
C(=NOCCCc1ccccc1)C1CC1	ZINC000853735586	BG	On-Demand	Mild	SLC18A2	34	41
C(=NOCCCc1ccccc1)C1CC1	ZINC000853735586	BG	On-Demand	Mild	SIGMAR1	20	42
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC2CC(CO)C2)c1	ZINC000853735589	DD	On-Demand	Mild	PDS	43	36
CC[C@H](C#N)Oc1cccc(CNC(=O)NC2CC(CO)C2)c1	ZINC000853735590	DD	On-Demand	Mild	PDS	43	36
O=C(CON=CC1CC1)NCC1(c2ccccc2)CCCCC1	ZINC000853735601	DG	On-Demand	Mild	KCNA3	50	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C2CC2)C(C)(C)CO)c1	ZINC000853735611	FF	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](C2CC2)C(C)(C)CO)c1	ZINC000853735612	FF	On-Demand	Mild	PDS	49	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C2CC2)C(C)(C)CO)c1	ZINC000853735613	FF	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C2CC2)C(C)(C)CO)c1	ZINC000853735614	FF	On-Demand	Mild	PDS	49	38
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CCC(CO)(CO)C2)c1	ZINC000853735616	ED	On-Demand	Mild	PDS	44	39
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC(CO)(CO)C2)c1	ZINC000853735617	ED	On-Demand	Mild	PDS	44	39
C[C@H]1CCc2ccccc2N1C(=O)CON=CC1CC1	ZINC000853735630	CF	On-Demand	Mild	ACE	21	40
COc1ccc(N2CCN(C(=O)CON=CC3CC3)CC2)cc1	ZINC000853735635	DD	On-Demand	Mild	SSTR1	45	36
C[C@@H](ON=CC1CC1)C(=O)NCc1ccccc1Cl	ZINC000853735647	CF	On-Demand	Mild	P2RX7	38	43
Fc1cccc(OCCON=CC2CC2)c1	ZINC000853735653	BF	On-Demand	Mild	CHRNA10	36	46
Cc1ccccc1CNC(=O)[C@@H](C)ON=CC1CC1	ZINC000853735654	CE	On-Demand	Mild	AMP1_PLAFQ	24	46
Cc1ccccc1CNC(=O)[C@H](C)ON=CC1CC1	ZINC000853735657	CE	On-Demand	Mild	AMP1_PLAFQ	24	46
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H]2CCN(C)C2)c1	ZINC000853735664	EF	On-Demand	Mild	CCR5	21	51
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H]2CCN(C)C2)c1	ZINC000853735664	EF	On-Demand	Mild	PDS	42	34
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H]2CCN(C)C2)c1	ZINC000853735666	EF	On-Demand	Mild	CCR5	21	51
CC[C@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H]2CCN(C)C2)c1	ZINC000853735666	EF	On-Demand	Mild	PDS	42	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H]2CCN(C)C2)c1	ZINC000853735668	EF	On-Demand	Mild	CCR5	21	51
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@H]2CCN(C)C2)c1	ZINC000853735668	EF	On-Demand	Mild	PDS	42	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H]2CCN(C)C2)c1	ZINC000853735669	EF	On-Demand	Mild	CCR5	21	51
CC[C@@H](C#N)Oc1cccc(CNC(=O)N(CC)[C@@H]2CCN(C)C2)c1	ZINC000853735669	EF	On-Demand	Mild	PDS	42	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@H](C(C)C)C2(CO)CC=CC2)c1	ZINC000853735677	GH	On-Demand	Mild	PDS	69	43
C[C@@H](ON=CC1CC1)C(=O)NCCc1cccs1	ZINC000853735678	CE	On-Demand	Mild	CTSC	33	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)C2(CO)CC=CC2)c1	ZINC000853735680	GH	On-Demand	Mild	PDS	69	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@@H](C(C)C)C2(CO)CC=CC2)c1	ZINC000853735682	GH	On-Demand	Mild	PDS	69	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N[C@H](C(C)C)C2(CO)CC=CC2)c1	ZINC000853735684	GH	On-Demand	Mild	PDS	69	43
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@H](C)c2ccccn2)c1	ZINC000853735689	FG	On-Demand	Mild	PDS	69	39
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000853735706	CD	On-Demand	Mild	TIMP3	54	31
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000853735706	CD	On-Demand	Mild	PPO2	17	40
CC[C@H](C#N)Oc1cccc(CNC(=O)NC[C@@H](C)c2ccccn2)c1	ZINC000853735733	FG	On-Demand	Mild	PDS	69	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@H](C)c2ccccn2)c1	ZINC000853735734	FG	On-Demand	Mild	PDS	69	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)NC[C@@H](C)c2ccccn2)c1	ZINC000853735735	FG	On-Demand	Mild	PDS	69	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)NCC2(O)CCC(C)CC2)c1	ZINC000853735742	FG	On-Demand	Mild	PDS	44	37
CC[C@H](C#N)Oc1cccc(CNC(=O)NCC2(O)CCC(C)CC2)c1	ZINC000853735743	FG	On-Demand	Mild	PDS	44	37
CCOc1ccc([C@@H]2CCCN2C(=O)CON=CC2CC2)cc1	ZINC000853735748	DG	On-Demand	Mild	CPT1A	111	38
Cc1oc(-c2ccccc2)nc1CON=CC1CC1	ZINC000853735757	CH	On-Demand	Mild	PPARG	81	45
Cc1oc(-c2ccccc2)nc1CON=CC1CC1	ZINC000853735757	CH	On-Demand	Mild	PPARA	88	45
Cc1oc(-c2ccccc2)nc1CON=CC1CC1	ZINC000853735757	CH	On-Demand	Mild	PDE8B	61	38
CN(CCOc1ccc(Cl)cc1)C(=O)CON=CC1CC1	ZINC000853735760	DF	On-Demand	Mild	FDPS	15	43
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H](C)[C@H]2CCO)c1	ZINC000853735767	FG	On-Demand	Mild	LGMN	61	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H](C)[C@@H]2CCO)c1	ZINC000853735768	FG	On-Demand	Mild	LGMN	61	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@@H](C)[C@H]2CCO)c1	ZINC000853735769	FG	On-Demand	Mild	LGMN	61	36
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CCC[C@H](C)[C@@H]2CCO)c1	ZINC000853735770	FG	On-Demand	Mild	LGMN	61	36
CN(CCOc1ccc(Br)cc1)C(=O)CON=CC1CC1	ZINC000853735774	FF	On-Demand	Mild	SHC	46	39
CN(CCOc1ccc(Br)cc1)C(=O)CON=CC1CC1	ZINC000853735774	FF	On-Demand	Mild	LSS	36	44
O=C(CON=CC1CC1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853735781	ED	On-Demand	Mild	L3MBTL3	77	39
CC(C)(C)OC(=O)N1CCC(CCON=CC2CC2)CC1	ZINC000853735782	CG	On-Demand	Mild	GPR119	32	43
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853735788	GH	On-Demand	Mild	P2RY12	23	41
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853735788	GH	On-Demand	Mild	EPHX2	22	47
CC[C@@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853735788	GH	On-Demand	Mild	PDS	66	38
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853735789	GH	On-Demand	Mild	P2RY12	23	41
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853735789	GH	On-Demand	Mild	EPHX2	22	47
CC[C@H](C#N)Oc1cccc(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853735789	GH	On-Demand	Mild	PDS	66	38
O=C(c1ccccc1)N1CC[C@H](CON=CC2CC2)C1	ZINC000853735800	CF	On-Demand	Mild	SLC18A3	18	43
O=C(c1ccccc1)N1CC[C@H](CON=CC2CC2)C1	ZINC000853735800	CF	On-Demand	Mild	L3MBTL3	48	35
O=C(c1ccccc1)N1CC[C@@H](CON=CC2CC2)C1	ZINC000853735801	CF	On-Demand	Mild	SLC18A3	18	43
O=C(c1ccccc1)N1CC[C@@H](CON=CC2CC2)C1	ZINC000853735801	CF	On-Demand	Mild	L3MBTL3	48	35
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	CHRM2	22	45
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	CHRM1	20	45
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	ACE	41	35
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	DRD2	27	51
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	DRD4	57	51
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	ACHE	45	45
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	DRD3	16	51
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	KCNH2	15	43
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	HTR4	20	45
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	CHRM3	34	45
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	LTA4H	23	42
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	SIGMAR1	59	59
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	SSTR5	55	37
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	CCR3	35	43
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	TIMP3	52	36
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	BACE1	16	43
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	MCHR1	48	50
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	CACNA1G	34	42
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	CCR8	15	43
C[C@@H](ON=CC1CC1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853735910	EF	On-Demand	Mild	BIRC2	29	40
C(=NOC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000853735943	CF	On-Demand	Mild	DRD4	25	49
C(=NOC[C@@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000853735943	CF	On-Demand	Mild	SIGMAR1	29	43
C(=NOC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000853735944	CF	On-Demand	Mild	DRD4	25	49
C(=NOC[C@H]1CN(Cc2ccccc2)CCCO1)C1CC1	ZINC000853735944	CF	On-Demand	Mild	SIGMAR1	29	43
C(=NOCc1ccc(CN2CCCCC2)cc1)C1CC1	ZINC000853735969	CH	On-Demand	Mild	HRH3	26	47
COc1ccc(-n2c(C)nnc2SCC(=O)OCC(=O)Nc2cccc(C(=O)N(C)C)c2)cc1	ZINC000853736058	JF	On-Demand	Anodyne	ENPP1	49	30
COC(=O)c1ccc([N+](=O)[O-])c(CON=CC2CC2)c1	ZINC000853736074	CE	On-Demand	Mild	CACNA1D	42	34
Cc1ccccc1CN1CCC(NC(=O)CON=CC2CC2)CC1	ZINC000853736124	EE	On-Demand	Mild	DRD4	20	53
Cc1ccccc1CN1CCC(NC(=O)CON=CC2CC2)CC1	ZINC000853736124	EE	On-Demand	Mild	SIGMAR1	20	47
Cc1ccccc1CN1CCC(NC(=O)CON=CC2CC2)CC1	ZINC000853736124	EE	On-Demand	Mild	MCHR1	28	41
Cc1ccccc1CN1CCC(NC(=O)CON=CC2CC2)CC1	ZINC000853736124	EE	On-Demand	Mild	CCR8	18	40
CON(C)CCNC(=O)NCCOc1cccc(C(C)(C)C)c1	ZINC000853736164	DE	On-Demand	Anodyne	HRH2	26	40
CON(C)CCNC(=O)NCCOc1cccc(C(C)(C)C)c1	ZINC000853736164	DE	On-Demand	Anodyne	MTNR1A	32	48
CON(C)CCNC(=O)NCCOc1cccc(C(C)(C)C)c1	ZINC000853736164	DE	On-Demand	Anodyne	MTNR1B	23	48
CON(C)CCNC(=O)NCCOc1cccc(C(C)(C)C)c1	ZINC000853736164	DE	On-Demand	Anodyne	PDS	43	38
C(=NOCc1cccc(CN2CCCCC2)c1)C1CC1	ZINC000853736172	CH	On-Demand	Mild	HRH3	16	40
CN(CCON=CC1CC1)Cc1ccccc1	ZINC000853736200	BF	On-Demand	Mild	G6PC	54	35
COc1ccc(-n2c(C)nnc2SCC(=O)OCC(=O)Nc2ccc(N3CCCCC3)nc2)cc1	ZINC000853736332	JG	On-Demand	Anodyne	GALR2	40	31
CCSC1(CNC(=O)NCc2cc(OC)ccc2O)CC1	ZINC000853736409	DE	On-Demand	Clean	MTNR1A	57	44
CCSC1(CNC(=O)NCc2cc(OC)ccc2O)CC1	ZINC000853736409	DE	On-Demand	Clean	MTNR1B	47	44
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccccc2Cl)c1	ZINC000853736413	EG	On-Demand	Clean	MTNR1A	35	47
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccccc2Cl)c1	ZINC000853736413	EG	On-Demand	Clean	MTNR1B	30	47
CCC(C)(C)[C@@H](C)NC(=O)NCc1cc(OC)ccc1O	ZINC000853736418	CG	On-Demand	Clean	MTNR1A	53	44
CCC(C)(C)[C@@H](C)NC(=O)NCc1cc(OC)ccc1O	ZINC000853736418	CG	On-Demand	Clean	MTNR1B	46	44
COc1ccc(O)c(CNC(=O)NCC[C@@]2(C)CC2(F)F)c1	ZINC000853736421	DF	On-Demand	Clean	MTNR1A	55	46
COc1ccc(O)c(CNC(=O)NCC[C@@]2(C)CC2(F)F)c1	ZINC000853736421	DF	On-Demand	Clean	MTNR1B	41	46
COc1ccc(O)c(CNC(=O)NCC[C@]2(C)CC2(F)F)c1	ZINC000853736422	DF	On-Demand	Clean	MTNR1A	55	46
COc1ccc(O)c(CNC(=O)NCC[C@]2(C)CC2(F)F)c1	ZINC000853736422	DF	On-Demand	Clean	MTNR1B	41	46
COc1ccc(O)c(CNC(=O)NCc2ccc(CNC(C)=O)cc2)c1	ZINC000853736426	FE	On-Demand	Clean	NQO2	32	40
COc1ccc(O)c(CNC(=O)NCc2ccc(CNC(C)=O)cc2)c1	ZINC000853736426	FE	On-Demand	Clean	TRPV1	17	43
COc1ccc(O)c(CNC(=O)NCc2ccc(CNC(C)=O)cc2)c1	ZINC000853736426	FE	On-Demand	Clean	MTNR1A	101	59
COc1ccc(O)c(CNC(=O)NCc2ccc(CNC(C)=O)cc2)c1	ZINC000853736426	FE	On-Demand	Clean	MTNR1B	85	59
COc1ccc(O)c(CNC(=O)NCc2ccc(CNC(C)=O)cc2)c1	ZINC000853736426	FE	On-Demand	Clean	CA9	21	45
COc1ccc(O)c(CNC(=O)NCc2ccc(CNC(C)=O)cc2)c1	ZINC000853736426	FE	On-Demand	Clean	NCE103	15	40
C#CCNC(=O)COc1ccc(CC(=O)OC(C)(C)C)cc1	ZINC000853736430	DD	On-Demand	Mild	PLA2G4B	45	37
COc1ccc(O)c(CNC(=O)N[C@@H]2C=CCC2)c1	ZINC000853736431	CD	On-Demand	Clean	MTNR1A	46	44
COc1ccc(O)c(CNC(=O)N[C@@H]2C=CCC2)c1	ZINC000853736431	CD	On-Demand	Clean	MTNR1B	33	44
COc1ccc(O)c(CNC(=O)N[C@H]2C=CCC2)c1	ZINC000853736432	CD	On-Demand	Clean	MTNR1A	46	44
COc1ccc(O)c(CNC(=O)N[C@H]2C=CCC2)c1	ZINC000853736432	CD	On-Demand	Clean	MTNR1B	33	44
O=C(COc1cccc2c1OCCCO2)Nc1ccc(N2CCOCC2)cc1	ZINC000853736438	GF	On-Demand	Anodyne	STAT6	63	38
CC[C@@H](C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736450	CF	On-Demand	Clean	MTNR1A	65	48
CC[C@@H](C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736450	CF	On-Demand	Clean	MTNR1B	51	48
C[C@@H](ON=CC1CC1)C(=O)Nc1ccccc1	ZINC000853736457	BE	On-Demand	Mild	TIMP3	84	40
COc1ccc(O)c(CNC(=O)NCc2nccc(OC)c2F)c1	ZINC000853736459	ED	On-Demand	Clean	MTNR1A	31	43
COc1ccc(O)c(CNC(=O)NCc2nccc(OC)c2F)c1	ZINC000853736459	ED	On-Demand	Clean	MTNR1B	25	43
COc1ccc(O)c(CNC(=O)NCc2nccc(OC)c2F)c1	ZINC000853736459	ED	On-Demand	Clean	PDGFRA	46	36
CCOc1ccccc1NC(=O)CON=CC1CC1	ZINC000853736460	CE	On-Demand	Mild	HCN1	46	31
CCOc1ccccc1NC(=O)CON=CC1CC1	ZINC000853736460	CE	On-Demand	Mild	HCN4	40	31
COc1ccc(O)c(CNC(=O)NC[C@@H](C)c2ccccn2)c1	ZINC000853736461	DE	On-Demand	Clean	MTNR1A	32	41
COc1ccc(O)c(CNC(=O)NC[C@@H](C)c2ccccn2)c1	ZINC000853736461	DE	On-Demand	Clean	MTNR1B	29	40
COc1ccc(O)c(CNC(=O)NC[C@H](C)c2ccccn2)c1	ZINC000853736462	DE	On-Demand	Clean	MTNR1A	32	41
COc1ccc(O)c(CNC(=O)NC[C@H](C)c2ccccn2)c1	ZINC000853736462	DE	On-Demand	Clean	MTNR1B	29	40
COc1ccc(O)c(CNC(=O)N[C@H]2CCc3ccc(O)cc32)c1	ZINC000853736465	EF	On-Demand	Clean	NQO2	30	44
COc1ccc(O)c(CNC(=O)N[C@H]2CCc3ccc(O)cc32)c1	ZINC000853736465	EF	On-Demand	Clean	MTNR1A	41	46
COc1ccc(O)c(CNC(=O)N[C@H]2CCc3ccc(O)cc32)c1	ZINC000853736465	EF	On-Demand	Clean	MTNR1B	33	43
COc1ccc(O)c(CNC(=O)N[C@@H]2CCc3ccc(O)cc32)c1	ZINC000853736466	EF	On-Demand	Clean	NQO2	30	44
COc1ccc(O)c(CNC(=O)N[C@@H]2CCc3ccc(O)cc32)c1	ZINC000853736466	EF	On-Demand	Clean	MTNR1A	41	46
COc1ccc(O)c(CNC(=O)N[C@@H]2CCc3ccc(O)cc32)c1	ZINC000853736466	EF	On-Demand	Clean	MTNR1B	33	43
COc1ccc(O)c(CNC(=O)NCCCOC(C)(C)C)c1	ZINC000853736472	DE	On-Demand	Clean	MTNR1A	55	53
COc1ccc(O)c(CNC(=O)NCCCOC(C)(C)C)c1	ZINC000853736472	DE	On-Demand	Clean	MTNR1B	43	53
COc1ccc(O)c(CNC(=O)NCC2CCN(C3CCOCC3)CC2)c1	ZINC000853736473	GE	On-Demand	Clean	CACNA1I	46	33
COc1ccc(O)c(CNC(=O)NCc2sc(C)cc2Br)c1	ZINC000853736475	GH	On-Demand	Clean	MTNR1A	32	44
COc1ccc(O)c(CNC(=O)NCc2sc(C)cc2Br)c1	ZINC000853736475	GH	On-Demand	Clean	MTNR1B	23	44
O=C(CON=CC1CC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853736479	DF	On-Demand	Mild	P2RY1	53	37
O=C(CON=CC1CC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853736479	DF	On-Demand	Mild	EPHX2	57	47
O=C(CON=CC1CC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853736479	DF	On-Demand	Mild	MCHR1	18	40
O=C(CON=CC1CC1)NCc1ccc2c(c1)OCO2	ZINC000853736486	CD	On-Demand	Mild	BMP1	45	36
O=C(CON=CC1CC1)NCc1ccc2c(c1)OCO2	ZINC000853736486	CD	On-Demand	Mild	NOS2	109	42
O=C(CON=CC1CC1)NCc1ccc2c(c1)OCO2	ZINC000853736486	CD	On-Demand	Mild	MCHR1	20	41
FC(F)(F)c1cccc(CON=CC2CC2)c1	ZINC000853736488	BH	On-Demand	Mild	TACR1	17	42
COc1ccc(O)c(CNC(=O)NCCc2ccoc2)c1	ZINC000853736490	CE	On-Demand	Clean	NQO2	33	40
COc1ccc(O)c(CNC(=O)NCCc2ccoc2)c1	ZINC000853736490	CE	On-Demand	Clean	MTNR1A	84	48
COc1ccc(O)c(CNC(=O)NCCc2ccoc2)c1	ZINC000853736490	CE	On-Demand	Clean	MTNR1B	66	48
C#CCCN(CCOC)C(=O)NCc1ccc(OC)c(OCC)c1	ZINC000853736496	EE	On-Demand	Mild	MT-ND1	23	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)CN(C)CCCN(C)C)c1	ZINC000853736499	FD	On-Demand	Clean	MTNR1A	25	42
COc1ccc(O)c(CNC(=O)N[C@@H](C)CN(C)CCCN(C)C)c1	ZINC000853736499	FD	On-Demand	Clean	MTNR1B	22	42
C#CCCOc1ccc(CC(=O)OC(C)(C)C)cc1	ZINC000853736505	CF	On-Demand	Mild	PLA2G4B	71	40
CC(=O)c1ccc(NC(=O)[C@@H](C)ON=CC2CC2)cc1	ZINC000853736506	CF	On-Demand	Mild	TIMP3	40	31
CC(=O)c1ccc(NC(=O)[C@H](C)ON=CC2CC2)cc1	ZINC000853736507	CF	On-Demand	Mild	TIMP3	40	31
COc1ccc(O)c(CNC(=O)N[C@@H](c2ccccc2F)C(C)C)c1	ZINC000853736509	EH	On-Demand	Clean	MTNR1A	35	41
COc1ccc(O)c(CNC(=O)N[C@@H](c2ccccc2F)C(C)C)c1	ZINC000853736509	EH	On-Demand	Clean	MTNR1B	31	41
COc1ccc(O)c(CNC(=O)N[C@H](c2ccccc2F)C(C)C)c1	ZINC000853736510	EH	On-Demand	Clean	MTNR1A	35	41
COc1ccc(O)c(CNC(=O)N[C@H](c2ccccc2F)C(C)C)c1	ZINC000853736510	EH	On-Demand	Clean	MTNR1B	31	41
COc1ccc(O)c(CNC(=O)NCCc2cnccc2C)c1	ZINC000853736511	DE	On-Demand	Clean	NQO2	28	40
COc1ccc(O)c(CNC(=O)NCCc2cnccc2C)c1	ZINC000853736511	DE	On-Demand	Clean	MTNR1A	68	46
COc1ccc(O)c(CNC(=O)NCCc2cnccc2C)c1	ZINC000853736511	DE	On-Demand	Clean	MTNR1B	54	46
O=C(CON=CC1CC1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853736513	DH	On-Demand	Mild	TSHR	50	35
O=C(CON=CC1CC1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853736513	DH	On-Demand	Mild	LTA4H	53	57
O=C(CON=CC1CC1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853736513	DH	On-Demand	Mild	ADAM17	25	51
O=C(CON=CC1CC1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853736513	DH	On-Demand	Mild	TIMP3	41	32
O=C(CON=CC1CC1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853736513	DH	On-Demand	Mild	HDAC8	15	40
O=C(CON=CC1CC1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853736513	DH	On-Demand	Mild	FFAR1	27	40
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	FKBP1A	22	40
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	SIGMAR1	15	40
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	NPFFR2	43	33
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	AMP1_PLAFQ	28	45
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	POLG_WNV	46	32
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	CRTM	37	42
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	NPFFR1	57	33
O=C(CON=CC1CC1)NCCCc1ccccc1	ZINC000853736515	CE	On-Demand	Mild	CES1D	55	32
C=CCCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736517	CD	On-Demand	Mild	MTNR1A	70	50
C=CCCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736517	CD	On-Demand	Mild	MTNR1B	55	50
CCO[C@@H]1C[C@@H](NC(=O)NCc2cc(OC)ccc2O)C1	ZINC000853736519	CD	On-Demand	Clean	MTNR1A	58	45
CCO[C@@H]1C[C@@H](NC(=O)NCc2cc(OC)ccc2O)C1	ZINC000853736519	CD	On-Demand	Clean	MTNR1B	44	45
COc1ccc(O)c(CNC(=O)NC[C@@]2(C)CC2(F)F)c1	ZINC000853736522	DE	On-Demand	Clean	MTNR1A	59	46
COc1ccc(O)c(CNC(=O)NC[C@@]2(C)CC2(F)F)c1	ZINC000853736522	DE	On-Demand	Clean	MTNR1B	46	46
COc1ccc(O)c(CNC(=O)NC[C@]2(C)CC2(F)F)c1	ZINC000853736523	DE	On-Demand	Clean	MTNR1A	59	46
COc1ccc(O)c(CNC(=O)NC[C@]2(C)CC2(F)F)c1	ZINC000853736523	DE	On-Demand	Clean	MTNR1B	46	46
COc1ccc(O)c(CNC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853736531	DD	On-Demand	Clean	MTNR1A	41	44
COc1ccc(O)c(CNC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853736531	DD	On-Demand	Clean	MTNR1B	29	44
COc1ccc(O)c(CNC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853736532	DD	On-Demand	Clean	MTNR1A	41	44
COc1ccc(O)c(CNC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853736532	DD	On-Demand	Clean	MTNR1B	29	44
COc1ccc(O)c(CNC(=O)NCCc2ccc(C)c(C)c2)c1	ZINC000853736538	EG	On-Demand	Clean	THRA	24	42
COc1ccc(O)c(CNC(=O)NCCc2ccc(C)c(C)c2)c1	ZINC000853736538	EG	On-Demand	Clean	THRB	30	42
COc1ccc(O)c(CNC(=O)NCCc2ccc(C)c(C)c2)c1	ZINC000853736538	EG	On-Demand	Clean	TRPV1	19	51
COc1ccc(O)c(CNC(=O)NCCc2ccc(C)c(C)c2)c1	ZINC000853736538	EG	On-Demand	Clean	MTNR1A	85	53
COc1ccc(O)c(CNC(=O)NCCc2ccc(C)c(C)c2)c1	ZINC000853736538	EG	On-Demand	Clean	MTNR1B	69	53
COc1ccc(O)c(CNC(=O)NCCc2ccc(C)c(C)c2)c1	ZINC000853736538	EG	On-Demand	Clean	CA9	18	42
COc1ccc(O)c(CNC(=O)NCCc2ccc(C)c(C)c2)c1	ZINC000853736538	EG	On-Demand	Clean	NCE103	17	48
COc1ccc(O)c(CNC(=O)NCc2cc(C)cc(C)c2)c1	ZINC000853736544	DG	On-Demand	Clean	MTNR1A	63	49
COc1ccc(O)c(CNC(=O)NCc2cc(C)cc(C)c2)c1	ZINC000853736544	DG	On-Demand	Clean	MTNR1B	51	49
COc1ccc(O)c(CNC(=O)NCc2cc(C)cc(C)c2)c1	ZINC000853736544	DG	On-Demand	Clean	CA9	15	40
C[C@@H]1Cc2ccccc2N1C(=O)CON=CC1CC1	ZINC000853736550	CE	On-Demand	Mild	ACE	15	41
C[C@@H]1Cc2ccccc2N1C(=O)CON=CC1CC1	ZINC000853736550	CE	On-Demand	Mild	DRD4	26	46
C[C@@H]1Cc2ccccc2N1C(=O)CON=CC1CC1	ZINC000853736550	CE	On-Demand	Mild	TPP2	55	33
C[C@@H](ON=CC1CC1)C(=O)Nc1ccc(Br)cc1	ZINC000853736555	DG	On-Demand	Mild	TIMP3	47	32
O=C(CON=CC1CC1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853736560	DH	On-Demand	Mild	RAF1	29	41
O=C(CON=CC1CC1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853736560	DH	On-Demand	Mild	IMDH_CRYPV	16	45
COc1ccc(O)c(CNC(=O)NCC2SCCS2)c1	ZINC000853736582	DE	On-Demand	Clean	MTNR1A	50	45
COc1ccc(O)c(CNC(=O)NCC2SCCS2)c1	ZINC000853736582	DE	On-Demand	Clean	MTNR1B	36	45
COc1ccc(O)c(CNC(=O)NCC2(S(C)(=O)=O)CCCCC2)c1	ZINC000853736584	FD	On-Demand	Clean	MTNR1A	46	44
COc1ccc(O)c(CNC(=O)NCC2(S(C)(=O)=O)CCCCC2)c1	ZINC000853736584	FD	On-Demand	Clean	MTNR1B	31	44
COc1ccc(O)c(CNC(=O)NCCc2cncc(C)n2)c1	ZINC000853736585	DD	On-Demand	Clean	MTNR1A	57	46
COc1ccc(O)c(CNC(=O)NCCc2cncc(C)n2)c1	ZINC000853736585	DD	On-Demand	Clean	MTNR1B	44	46
CC(C)(C)OC(=O)Cc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853736588	EI	On-Demand	Anodyne	PPARA	40	32
CC(C)(C)OC(=O)Cc1ccc(OCc2csc(Cl)n2)cc1	ZINC000853736588	EI	On-Demand	Anodyne	CYSLTR1	18	41
COc1ccc(O)c(CNC(=O)N[C@H]2CCNC2=O)c1	ZINC000853736592	CC	On-Demand	Clean	MTNR1A	38	42
COc1ccc(O)c(CNC(=O)N[C@H]2CCNC2=O)c1	ZINC000853736592	CC	On-Demand	Clean	MTNR1B	29	42
COc1ccc(O)c(CNC(=O)N[C@@H]2CCNC2=O)c1	ZINC000853736593	CC	On-Demand	Clean	MTNR1A	38	42
COc1ccc(O)c(CNC(=O)N[C@@H]2CCNC2=O)c1	ZINC000853736593	CC	On-Demand	Clean	MTNR1B	29	42
COc1ccc(O)c(CNC(=O)N[C@@H](C)C2CCC(F)CC2)c1	ZINC000853736595	DG	On-Demand	Clean	MTNR1A	41	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)C2CCC(F)CC2)c1	ZINC000853736595	DG	On-Demand	Clean	MTNR1B	34	41
COc1ccc(O)c(CNC(=O)N[C@H](C)C2CCC(F)CC2)c1	ZINC000853736596	DG	On-Demand	Clean	MTNR1A	41	41
COc1ccc(O)c(CNC(=O)N[C@H](C)C2CCC(F)CC2)c1	ZINC000853736596	DG	On-Demand	Clean	MTNR1B	34	41
COc1ccc(O)c(CNC(=O)NCCCC2CCC2)c1	ZINC000853736615	CF	On-Demand	Clean	NQO2	35	43
COc1ccc(O)c(CNC(=O)NCCCC2CCC2)c1	ZINC000853736615	CF	On-Demand	Clean	MTNR1A	68	52
COc1ccc(O)c(CNC(=O)NCCCC2CCC2)c1	ZINC000853736615	CF	On-Demand	Clean	MTNR1B	56	52
COc1ccc(O)c(CNC(=O)NC[C@H](OC)C2CCCC2)c1	ZINC000853736618	DE	On-Demand	Clean	MTNR1A	49	43
COc1ccc(O)c(CNC(=O)NC[C@H](OC)C2CCCC2)c1	ZINC000853736618	DE	On-Demand	Clean	MTNR1B	35	43
COc1ccc(O)c(CNC(=O)NC[C@@H](OC)C2CCCC2)c1	ZINC000853736619	DE	On-Demand	Clean	MTNR1A	49	43
COc1ccc(O)c(CNC(=O)NC[C@@H](OC)C2CCCC2)c1	ZINC000853736619	DE	On-Demand	Clean	MTNR1B	35	43
COC[C@H](NC(=O)NCc1cc(OC)ccc1O)c1cccc(OC)c1	ZINC000853736625	FF	On-Demand	Clean	MTNR1A	55	43
COC[C@H](NC(=O)NCc1cc(OC)ccc1O)c1cccc(OC)c1	ZINC000853736625	FF	On-Demand	Clean	MTNR1B	54	43
COC[C@@H](NC(=O)NCc1cc(OC)ccc1O)c1cccc(OC)c1	ZINC000853736626	FF	On-Demand	Clean	MTNR1A	55	43
COC[C@@H](NC(=O)NCc1cc(OC)ccc1O)c1cccc(OC)c1	ZINC000853736626	FF	On-Demand	Clean	MTNR1B	54	43
COC[C@@H](CCNC(=O)NCc1cc(OC)ccc1O)OC	ZINC000853736634	DD	On-Demand	Clean	MTNR1A	47	46
COC[C@@H](CCNC(=O)NCc1cc(OC)ccc1O)OC	ZINC000853736634	DD	On-Demand	Clean	MTNR1B	35	46
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853736636	FD	On-Demand	Mild	LPL	26	41
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853736636	FD	On-Demand	Mild	EPHX2	16	50
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853736636	FD	On-Demand	Mild	TGM2	43	43
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853736636	FD	On-Demand	Mild	ST14	43	36
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853736636	FD	On-Demand	Mild	F13A1	64	43
COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@H](C)S(=O)(=O)C2)c1	ZINC000853736637	ED	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@H](C)S(=O)(=O)C2)c1	ZINC000853736637	ED	On-Demand	Clean	MTNR1B	21	41
COc1ccc(O)c(CNC(=O)N[C@H]2CC[C@H](C)S(=O)(=O)C2)c1	ZINC000853736638	ED	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@H]2CC[C@H](C)S(=O)(=O)C2)c1	ZINC000853736638	ED	On-Demand	Clean	MTNR1B	21	41
COc1ccc(O)c(CNC(=O)N[C@H]2CC[C@@H](C)S(=O)(=O)C2)c1	ZINC000853736639	ED	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@H]2CC[C@@H](C)S(=O)(=O)C2)c1	ZINC000853736639	ED	On-Demand	Clean	MTNR1B	21	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@@H](C)S(=O)(=O)C2)c1	ZINC000853736640	ED	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@@H](C)S(=O)(=O)C2)c1	ZINC000853736640	ED	On-Demand	Clean	MTNR1B	21	41
COCc1csc(CNC(=O)NCc2cc(OC)ccc2O)c1	ZINC000853736646	EF	On-Demand	Clean	MTNR1A	29	43
COCc1csc(CNC(=O)NCc2cc(OC)ccc2O)c1	ZINC000853736646	EF	On-Demand	Clean	MTNR1B	18	43
COc1ccc(O)c(CNC(=O)NCc2cnc(C(F)(F)F)nc2)c1	ZINC000853736648	FE	On-Demand	Clean	MTNR1A	40	45
COc1ccc(O)c(CNC(=O)NCc2cnc(C(F)(F)F)nc2)c1	ZINC000853736648	FE	On-Demand	Clean	MTNR1B	32	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccccc2OC)c1	ZINC000853736649	EF	On-Demand	Clean	MTNR1A	45	52
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@H]2c2ccccc2OC)c1	ZINC000853736649	EF	On-Demand	Clean	MTNR1B	41	52
O=C(CON=CC1CC1)NCCC(c1ccccc1)c1ccccc1	ZINC000853736650	EH	On-Demand	Mild	C3AR1	40	37
COc1ccc(O)c(CNC(=O)NC2CCN([C@H]3CCOC3)CC2)c1	ZINC000853736659	ED	On-Demand	Clean	PDK1	40	34
COc1ccc(O)c(CNC(=O)NC2CCN([C@@H]3CCOC3)CC2)c1	ZINC000853736660	ED	On-Demand	Clean	PDK1	40	34
C=CCOCCCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736664	CD	On-Demand	Mild	MTNR1A	51	51
C=CCOCCCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736664	CD	On-Demand	Mild	MTNR1B	39	51
COc1ccc(N2CCN(C(=O)COc3cccc4c3OCCCO4)CC2)cc1	ZINC000853736675	GF	On-Demand	Clean	HTR1B	16	51
COc1ccc(O)c(CNC(=O)NC[C@H]2CCC[C@@H](C)O2)c1	ZINC000853736676	DE	On-Demand	Clean	MTNR1A	39	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCC[C@@H](C)O2)c1	ZINC000853736676	DE	On-Demand	Clean	MTNR1B	29	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@H](C)O2)c1	ZINC000853736677	DE	On-Demand	Clean	MTNR1A	39	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@H](C)O2)c1	ZINC000853736677	DE	On-Demand	Clean	MTNR1B	29	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@@H](C)O2)c1	ZINC000853736678	DE	On-Demand	Clean	MTNR1A	39	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@@H](C)O2)c1	ZINC000853736678	DE	On-Demand	Clean	MTNR1B	29	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCC[C@H](C)O2)c1	ZINC000853736679	DE	On-Demand	Clean	MTNR1A	39	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCC[C@H](C)O2)c1	ZINC000853736679	DE	On-Demand	Clean	MTNR1B	29	41
C#CCOCCOc1ccc(CC(=O)OC(C)(C)C)cc1	ZINC000853736680	CF	On-Demand	Mild	PLA2G4B	69	40
CC(=O)c1cccc(NC(=O)[C@@H](C)ON=CC2CC2)c1	ZINC000853736683	CF	On-Demand	Mild	TIMP3	61	32
CC(=O)c1cccc(NC(=O)[C@@H](C)ON=CC2CC2)c1	ZINC000853736683	CF	On-Demand	Mild	KCNK3	76	35
CC(=O)c1cccc(NC(=O)[C@@H](C)ON=CC2CC2)c1	ZINC000853736683	CF	On-Demand	Mild	KCNK9	56	35
CC(=O)c1cccc(NC(=O)[C@H](C)ON=CC2CC2)c1	ZINC000853736684	CF	On-Demand	Mild	TIMP3	61	32
CC(=O)c1cccc(NC(=O)[C@H](C)ON=CC2CC2)c1	ZINC000853736684	CF	On-Demand	Mild	KCNK3	76	35
CC(=O)c1cccc(NC(=O)[C@H](C)ON=CC2CC2)c1	ZINC000853736684	CF	On-Demand	Mild	KCNK9	56	35
COc1ccc(O)c(CNC(=O)N[C@@H](C(C)C)C2CC2)c1	ZINC000853736686	CF	On-Demand	Clean	MTNR1A	58	44
COc1ccc(O)c(CNC(=O)N[C@@H](C(C)C)C2CC2)c1	ZINC000853736686	CF	On-Demand	Clean	MTNR1B	47	44
COc1ccc(O)c(CNC(=O)N[C@H](C(C)C)C2CC2)c1	ZINC000853736687	CF	On-Demand	Clean	MTNR1A	58	44
COc1ccc(O)c(CNC(=O)N[C@H](C(C)C)C2CC2)c1	ZINC000853736687	CF	On-Demand	Clean	MTNR1B	47	44
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853736688	DG	On-Demand	Mild	HDAC10	18	41
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853736688	DG	On-Demand	Mild	HDAC11	16	41
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853736688	DG	On-Demand	Mild	KCNK3	30	41
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853736703	FD	On-Demand	Mild	LPL	45	37
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853736703	FD	On-Demand	Mild	TGM2	54	45
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853736703	FD	On-Demand	Mild	ST14	48	37
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853736703	FD	On-Demand	Mild	F13A1	81	45
O=C(CON=CC1CC1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853736703	FD	On-Demand	Mild	AKR1C3	28	41
C[C@@H](ON=CC1CC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853736707	CF	On-Demand	Mild	ACE	19	42
C[C@@H](ON=CC1CC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853736707	CF	On-Demand	Mild	DRD4	23	41
C[C@@H](ON=CC1CC1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853736707	CF	On-Demand	Mild	TPP2	58	35
CC[C@@H](C)c1ccc(NC(=O)CON=CC2CC2)cc1	ZINC000853736710	CH	On-Demand	Mild	SCN2A	18	46
CC(C)c1cccc(C(C)C)c1NC(=O)CON=CC1CC1	ZINC000853736714	DI	On-Demand	Mild	SOAT1	59	45
CC(C)(C)OC(=O)Cc1ccc(OCCC2OCCCO2)cc1	ZINC000853736716	DG	On-Demand	Anodyne	PLA2G4B	50	36
COc1ccc(O)c(CNC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853736717	EF	On-Demand	Clean	SLC6A5	18	40
COc1ccc(O)c(CNC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853736717	EF	On-Demand	Clean	EPHX2	17	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853736718	EF	On-Demand	Clean	SLC6A5	18	40
COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853736718	EF	On-Demand	Clean	EPHX2	17	41
COc1ccc(O)c(CNC(=O)NCCO[C@@H]2CC2(F)F)c1	ZINC000853736719	DD	On-Demand	Clean	MTNR1A	51	45
COc1ccc(O)c(CNC(=O)NCCO[C@@H]2CC2(F)F)c1	ZINC000853736719	DD	On-Demand	Clean	MTNR1B	39	45
COc1ccc(O)c(CNC(=O)NCCO[C@H]2CC2(F)F)c1	ZINC000853736720	DD	On-Demand	Clean	MTNR1A	51	45
COc1ccc(O)c(CNC(=O)NCCO[C@H]2CC2(F)F)c1	ZINC000853736720	DD	On-Demand	Clean	MTNR1B	39	45
COc1ccc(O)c(CNC(=O)NC[C@@H](C)OC)c1	ZINC000853736723	CD	On-Demand	Clean	MTNR1A	62	48
COc1ccc(O)c(CNC(=O)NC[C@@H](C)OC)c1	ZINC000853736723	CD	On-Demand	Clean	MTNR1B	49	48
COc1ccc(O)c(CNC(=O)NC[C@H](C)OC)c1	ZINC000853736724	CD	On-Demand	Clean	MTNR1A	62	48
COc1ccc(O)c(CNC(=O)NC[C@H](C)OC)c1	ZINC000853736724	CD	On-Demand	Clean	MTNR1B	49	48
O=C(CON=CC1CC1)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1	ZINC000853736726	FI	On-Demand	Mild	GRIN2D	80	35
O=C(CON=CC1CC1)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1	ZINC000853736727	FI	On-Demand	Mild	GRIN2D	80	35
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	DRD4	21	45
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	ACHE	32	43
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	AVPR1B	41	33
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	SIGMAR1	31	47
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	SSTR5	42	32
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	CCR3	43	42
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	PDK1	45	45
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	MCHR1	35	44
COc1ccc(O)c(CNC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853736728	GF	On-Demand	Clean	CACNA1I	62	41
COc1ccc(O)c(CNC(=O)NCCc2cn(C)c3ccccc23)c1	ZINC000853736735	FF	On-Demand	Clean	NQO2	35	58
COc1ccc(O)c(CNC(=O)NCCc2cn(C)c3ccccc23)c1	ZINC000853736735	FF	On-Demand	Clean	MTNR1A	116	58
COc1ccc(O)c(CNC(=O)NCCc2cn(C)c3ccccc23)c1	ZINC000853736735	FF	On-Demand	Clean	MTNR1B	91	58
COc1ccc(O)c(CNC(=O)NC[C@@H]2C(C)(C)C2(F)F)c1	ZINC000853736743	DE	On-Demand	Clean	MTNR1A	50	45
COc1ccc(O)c(CNC(=O)NC[C@@H]2C(C)(C)C2(F)F)c1	ZINC000853736743	DE	On-Demand	Clean	MTNR1B	38	45
COc1ccc(O)c(CNC(=O)NC[C@H]2C(C)(C)C2(F)F)c1	ZINC000853736744	DE	On-Demand	Clean	MTNR1A	50	45
COc1ccc(O)c(CNC(=O)NC[C@H]2C(C)(C)C2(F)F)c1	ZINC000853736744	DE	On-Demand	Clean	MTNR1B	38	45
CCOc1cc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853736753	FG	On-Demand	Anodyne	SSTR5	50	38
CCOc1cc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853736754	FG	On-Demand	Anodyne	SSTR5	50	38
CCOc1cc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853736755	FG	On-Demand	Anodyne	SSTR5	50	38
CCOc1cc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853736756	FG	On-Demand	Anodyne	SSTR5	50	38
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853736757	GG	On-Demand	Clean	DRD4	36	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853736757	GG	On-Demand	Clean	DRD3	22	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853736757	GG	On-Demand	Clean	CACNA1I	51	33
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853736758	GG	On-Demand	Clean	DRD4	36	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853736758	GG	On-Demand	Clean	DRD3	22	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853736758	GG	On-Demand	Clean	CACNA1I	51	33
COc1ccc(O)c(CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853736763	GG	On-Demand	Clean	MTNR1A	24	41
COc1ccc(O)c(CNC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853736763	GG	On-Demand	Clean	MTNR1B	16	41
COc1ccc(O)c(CNC(=O)N[C@@H]2Cc3ccccc3[C@@H]2C)c1	ZINC000853736766	EF	On-Demand	Clean	MTNR1A	57	42
COc1ccc(O)c(CNC(=O)N[C@@H]2Cc3ccccc3[C@@H]2C)c1	ZINC000853736766	EF	On-Demand	Clean	MTNR1B	47	42
Cc1cccc(NC(=O)[C@@H](C)ON=CC2CC2)c1	ZINC000853736769	BF	On-Demand	Mild	TIMP3	47	31
Cc1cccc(NC(=O)[C@@H](C)ON=CC2CC2)c1	ZINC000853736769	BF	On-Demand	Mild	HDAC10	18	40
Cc1cccc(NC(=O)[C@@H](C)ON=CC2CC2)c1	ZINC000853736769	BF	On-Demand	Mild	KCNK3	72	39
Cc1cccc(NC(=O)[C@@H](C)ON=CC2CC2)c1	ZINC000853736769	BF	On-Demand	Mild	KCNK9	61	39
Cc1cccc(NC(=O)[C@H](C)ON=CC2CC2)c1	ZINC000853736770	BF	On-Demand	Mild	TIMP3	47	31
Cc1cccc(NC(=O)[C@H](C)ON=CC2CC2)c1	ZINC000853736770	BF	On-Demand	Mild	HDAC10	18	40
Cc1cccc(NC(=O)[C@H](C)ON=CC2CC2)c1	ZINC000853736770	BF	On-Demand	Mild	KCNK3	72	39
Cc1cccc(NC(=O)[C@H](C)ON=CC2CC2)c1	ZINC000853736770	BF	On-Demand	Mild	KCNK9	61	39
COc1ccc(O)c(CNC(=O)NC2CCC3(CC2)CC3(F)F)c1	ZINC000853736771	EG	On-Demand	Clean	MTNR1A	38	41
COc1ccc(O)c(CNC(=O)NC2CCC3(CC2)CC3(F)F)c1	ZINC000853736771	EG	On-Demand	Clean	MTNR1B	28	41
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc(Cl)c1	ZINC000853736775	CG	On-Demand	Mild	TIMP3	61	32
CCOc1cc(CNC(=O)NCCc2nnc(S)n2C2CC2)ccc1OC	ZINC000853736779	GE	On-Demand	Anodyne	SSTR5	58	37
COc1ccc(O)c(CNC(=O)NCc2cccnc2N2CCCC2)c1	ZINC000853736782	FE	On-Demand	Clean	DRD4	41	32
COc1ccc(O)c(CNC(=O)NCc2cccnc2N2CCCC2)c1	ZINC000853736782	FE	On-Demand	Clean	SCN2A	19	46
COc1ccc(O)c(CNC(=O)NCc2cccnc2N2CCCC2)c1	ZINC000853736782	FE	On-Demand	Clean	MTNR1A	48	41
COc1ccc(O)c(CNC(=O)NCc2cccnc2N2CCCC2)c1	ZINC000853736782	FE	On-Demand	Clean	MTNR1B	41	41
COc1ccc(O)c(CNC(=O)NCc2cccnc2N2CCCC2)c1	ZINC000853736782	FE	On-Demand	Clean	SCN10A	25	46
COc1ccc(O)c(CNC(=O)NCC2(C#N)CCCCC2)c1	ZINC000853736784	DF	On-Demand	Mild	MTNR1A	36	44
COc1ccc(O)c(CNC(=O)NCC2(C#N)CCCCC2)c1	ZINC000853736784	DF	On-Demand	Mild	MTNR1B	25	44
N#Cc1ccc(NC(=O)CON=CC2CC2)cc1	ZINC000853736785	BD	On-Demand	Mild	DHODH	16	45
CCOc1cc(CNC(=O)NCCN(C)OC)ccc1OC	ZINC000853736792	DD	On-Demand	Anodyne	PDE6A	41	32
CCOc1cc(CNC(=O)NCCN(C)OC)ccc1OC	ZINC000853736792	DD	On-Demand	Anodyne	MT-ND1	20	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@@H]2C#N)c1	ZINC000853736793	DE	On-Demand	Mild	MTNR1A	34	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@@H]2C#N)c1	ZINC000853736793	DE	On-Demand	Mild	MTNR1B	24	41
COc1ccc(O)c(CNC(=O)N[C@H]2CCCC[C@H]2C#N)c1	ZINC000853736794	DE	On-Demand	Mild	MTNR1A	34	41
COc1ccc(O)c(CNC(=O)N[C@H]2CCCC[C@H]2C#N)c1	ZINC000853736794	DE	On-Demand	Mild	MTNR1B	24	41
COc1ccc(O)c(CNC(=O)N[C@H]2CCCC[C@@H]2C#N)c1	ZINC000853736795	DE	On-Demand	Mild	MTNR1A	34	41
COc1ccc(O)c(CNC(=O)N[C@H]2CCCC[C@@H]2C#N)c1	ZINC000853736795	DE	On-Demand	Mild	MTNR1B	24	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2C#N)c1	ZINC000853736796	DE	On-Demand	Mild	MTNR1A	34	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2C#N)c1	ZINC000853736796	DE	On-Demand	Mild	MTNR1B	24	41
COc1ccc(O)c(CNC(=O)NCCCc2nc[nH]n2)c1	ZINC000853736801	DC	On-Demand	Clean	MTNR1A	61	58
COc1ccc(O)c(CNC(=O)NCCCc2nc[nH]n2)c1	ZINC000853736801	DC	On-Demand	Clean	MTNR1B	47	58
O=C(CON=CC1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000853736803	DF	On-Demand	Mild	GRIN2B	92	52
O=C(CON=CC1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000853736803	DF	On-Demand	Mild	SIGMAR1	20	47
O=C(CON=CC1CC1)N1CCC(Cc2ccccc2)CC1	ZINC000853736803	DF	On-Demand	Mild	CCR3	28	41
COc1ccc(O)c(CNC(=O)NC[C@H](OC2CCCC2)C(F)(F)F)c1	ZINC000853736804	GG	On-Demand	Clean	MTNR1A	33	40
COc1ccc(O)c(CNC(=O)NC[C@H](OC2CCCC2)C(F)(F)F)c1	ZINC000853736804	GG	On-Demand	Clean	MTNR1B	23	40
COc1ccc(O)c(CNC(=O)NC[C@@H](OC2CCCC2)C(F)(F)F)c1	ZINC000853736805	GG	On-Demand	Clean	MTNR1A	33	40
COc1ccc(O)c(CNC(=O)NC[C@@H](OC2CCCC2)C(F)(F)F)c1	ZINC000853736805	GG	On-Demand	Clean	MTNR1B	23	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc3c2OCCCO3)CC1	ZINC000853736806	GD	On-Demand	Anodyne	P2RY12	41	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc3c2OCCCO3)CC1	ZINC000853736807	GD	On-Demand	Anodyne	P2RY12	41	35
COc1ccc(O)c(CNC(=O)N[C@H](C)Cc2ccc(F)cc2C)c1	ZINC000853736809	EG	On-Demand	Clean	P2RX7	29	40
COc1ccc(O)c(CNC(=O)N[C@H](C)Cc2ccc(F)cc2C)c1	ZINC000853736809	EG	On-Demand	Clean	MTNR1A	18	41
COc1ccc(O)c(CNC(=O)N[C@H](C)Cc2ccc(F)cc2C)c1	ZINC000853736809	EG	On-Demand	Clean	MTNR1B	17	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)Cc2ccc(F)cc2C)c1	ZINC000853736810	EG	On-Demand	Clean	P2RX7	29	40
COc1ccc(O)c(CNC(=O)N[C@@H](C)Cc2ccc(F)cc2C)c1	ZINC000853736810	EG	On-Demand	Clean	MTNR1A	18	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)Cc2ccc(F)cc2C)c1	ZINC000853736810	EG	On-Demand	Clean	MTNR1B	17	41
COc1ccc(O)c(CNC(=O)NCCC2(CSC)CC2)c1	ZINC000853736812	DF	On-Demand	Clean	MTNR1A	44	45
COc1ccc(O)c(CNC(=O)NCCC2(CSC)CC2)c1	ZINC000853736812	DF	On-Demand	Clean	MTNR1B	30	45
COc1ccc(O)c(CNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853736829	FD	On-Demand	Clean	MTNR1A	41	43
O=C(CON=CC1CC1)Nc1ccccc1Cl	ZINC000853736834	CF	On-Demand	Mild	EPHB3	44	33
COc1ccc(O)c(CNC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853736835	EE	On-Demand	Clean	MTNR1A	38	42
COc1ccc(O)c(CNC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853736835	EE	On-Demand	Clean	MTNR1B	27	42
COc1ccc(O)c(CNC(=O)NCCC2CC(OC)C2)c1	ZINC000853736837	DE	On-Demand	Clean	MTNR1A	62	46
COc1ccc(O)c(CNC(=O)NCCC2CC(OC)C2)c1	ZINC000853736837	DE	On-Demand	Clean	MTNR1B	48	46
O=C(CON=CC1CC1)N[C@H]1CCCc2ccccc21	ZINC000853736844	CF	On-Demand	Mild	HTR7	15	48
O=C(CON=CC1CC1)N[C@H]1CCCc2ccccc21	ZINC000853736844	CF	On-Demand	Mild	BDKRB1	45	39
O=C(CON=CC1CC1)N[C@H]1CCCc2ccccc21	ZINC000853736844	CF	On-Demand	Mild	PLM1_PLAFA	42	39
O=C(CON=CC1CC1)N[C@H]1CCCc2ccccc21	ZINC000853736844	CF	On-Demand	Mild	BIRC2	41	38
O=C(CON=CC1CC1)N[C@@H]1CCCc2ccccc21	ZINC000853736845	CF	On-Demand	Mild	HTR7	15	48
O=C(CON=CC1CC1)N[C@@H]1CCCc2ccccc21	ZINC000853736845	CF	On-Demand	Mild	BDKRB1	45	39
O=C(CON=CC1CC1)N[C@@H]1CCCc2ccccc21	ZINC000853736845	CF	On-Demand	Mild	PLM1_PLAFA	42	39
O=C(CON=CC1CC1)N[C@@H]1CCCc2ccccc21	ZINC000853736845	CF	On-Demand	Mild	BIRC2	41	38
Cc1cccc(C(C)C)c1NC(=O)CON=CC1CC1	ZINC000853736847	CG	On-Demand	Mild	SOAT1	43	40
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000853736848	GD	On-Demand	Mild	LPL	44	40
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000853736848	GD	On-Demand	Mild	CNR2	17	59
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000853736848	GD	On-Demand	Mild	NR1H4	21	49
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000853736848	GD	On-Demand	Mild	EPHX2	21	42
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCOCC1	ZINC000853736848	GD	On-Demand	Mild	LIPG	18	40
COc1ccc(O)c(CNC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2OC)c1	ZINC000853736851	EC	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2OC)c1	ZINC000853736851	EC	On-Demand	Clean	MTNR1B	20	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2OC)c1	ZINC000853736852	EC	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2OC)c1	ZINC000853736852	EC	On-Demand	Clean	MTNR1B	20	41
COc1ccc(O)c(CNC(=O)N[C@H]2CS(=O)(=O)C[C@H]2OC)c1	ZINC000853736853	EC	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@H]2CS(=O)(=O)C[C@H]2OC)c1	ZINC000853736853	EC	On-Demand	Clean	MTNR1B	20	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2OC)c1	ZINC000853736854	EC	On-Demand	Clean	MTNR1A	29	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2OC)c1	ZINC000853736854	EC	On-Demand	Clean	MTNR1B	20	41
COc1ccc(O)c(CNC(=O)NCC2=CCCC2)c1	ZINC000853736855	CE	On-Demand	Clean	MTNR1A	59	46
COc1ccc(O)c(CNC(=O)NCC2=CCCC2)c1	ZINC000853736855	CE	On-Demand	Clean	MTNR1B	44	46
COC(=O)N(C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736859	DC	On-Demand	Clean	MTNR1A	66	49
COC(=O)N(C)CCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736859	DC	On-Demand	Clean	MTNR1B	51	49
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc(C#N)c1	ZINC000853736868	CE	On-Demand	Mild	CCR3	15	40
COc1ccc(O)c(CNC(=O)NCC(F)(F)c2ccccc2C)c1	ZINC000853736871	FG	On-Demand	Clean	MTNR1A	36	42
COc1ccc(O)c(CNC(=O)NCC(F)(F)c2ccccc2C)c1	ZINC000853736871	FG	On-Demand	Clean	MTNR1B	30	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1ccc(OC)c(OCC)c1	ZINC000853736872	GF	On-Demand	Mild	MT-ND1	24	41
C=CC[C@H]1CCCC[C@@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736874	DG	On-Demand	Mild	MTNR1A	33	40
C=CC[C@H]1CCCC[C@@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736874	DG	On-Demand	Mild	MTNR1B	22	40
C=CC[C@@H]1CCCC[C@@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736875	DG	On-Demand	Mild	MTNR1A	33	40
C=CC[C@@H]1CCCC[C@@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736875	DG	On-Demand	Mild	MTNR1B	22	40
C=CC[C@@H]1CCCC[C@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736876	DG	On-Demand	Mild	MTNR1A	33	40
C=CC[C@@H]1CCCC[C@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736876	DG	On-Demand	Mild	MTNR1B	22	40
C=CC[C@H]1CCCC[C@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736877	DG	On-Demand	Mild	MTNR1A	33	40
C=CC[C@H]1CCCC[C@H]1NC(=O)NCc1cc(OC)ccc1O	ZINC000853736877	DG	On-Demand	Mild	MTNR1B	22	40
COc1ccc(O)c(CNC(=O)N[C@H](C)COc2c(F)cccc2F)c1	ZINC000853736886	FF	On-Demand	Clean	MTNR1A	55	46
COc1ccc(O)c(CNC(=O)N[C@H](C)COc2c(F)cccc2F)c1	ZINC000853736886	FF	On-Demand	Clean	MTNR1B	48	46
COc1ccc(O)c(CNC(=O)N[C@@H](C)COc2c(F)cccc2F)c1	ZINC000853736887	FF	On-Demand	Clean	MTNR1A	55	46
COc1ccc(O)c(CNC(=O)N[C@@H](C)COc2c(F)cccc2F)c1	ZINC000853736887	FF	On-Demand	Clean	MTNR1B	48	46
COc1ccc(O)c(CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853736890	EC	On-Demand	Clean	MTNR1A	56	45
COc1ccc(O)c(CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853736890	EC	On-Demand	Clean	MTNR1B	42	45
COc1ccc(O)c(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736892	FD	On-Demand	Clean	CCKAR	16	40
COc1ccc(O)c(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736892	FD	On-Demand	Clean	PYGL	33	46
COc1ccc(O)c(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736892	FD	On-Demand	Clean	PYGM	29	46
COc1ccc(O)c(CNC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736892	FD	On-Demand	Clean	CCKBR	17	40
COc1ccc(O)c(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736893	FD	On-Demand	Clean	CCKAR	16	40
COc1ccc(O)c(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736893	FD	On-Demand	Clean	PYGL	33	46
COc1ccc(O)c(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736893	FD	On-Demand	Clean	PYGM	29	46
COc1ccc(O)c(CNC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)c1	ZINC000853736893	FD	On-Demand	Clean	CCKBR	17	40
CNC(=O)CC1(CNC(=O)NCc2cc(OC)ccc2O)CCCCC1	ZINC000853736894	FE	On-Demand	Clean	MTNR1A	57	45
CNC(=O)CC1(CNC(=O)NCc2cc(OC)ccc2O)CCCCC1	ZINC000853736894	FE	On-Demand	Clean	MTNR1B	43	45
C=CCCSCCNC(=O)NCc1cc(OC)ccc1O	ZINC000853736896	DF	On-Demand	Mild	MTNR1A	36	45
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C(C)(C)C)c1	ZINC000853736908	DE	On-Demand	Clean	MTNR1A	40	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2C(C)(C)C)c1	ZINC000853736908	DE	On-Demand	Clean	MTNR1B	34	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C(C)(C)C)c1	ZINC000853736909	DE	On-Demand	Clean	MTNR1A	40	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2C(C)(C)C)c1	ZINC000853736909	DE	On-Demand	Clean	MTNR1B	34	41
COc1ccc(O)c(CNC(=O)NCCC(C)(C)F)c1	ZINC000853736916	CE	On-Demand	Clean	MTNR1A	65	49
COc1ccc(O)c(CNC(=O)NCCC(C)(C)F)c1	ZINC000853736916	CE	On-Demand	Clean	MTNR1B	50	49
COc1ccc(O)c(CNC(=O)N[C@H]2COC(C)(C)C2)c1	ZINC000853736918	CD	On-Demand	Clean	MTNR1A	44	45
COc1ccc(O)c(CNC(=O)N[C@H]2COC(C)(C)C2)c1	ZINC000853736918	CD	On-Demand	Clean	MTNR1B	32	45
COc1ccc(O)c(CNC(=O)N[C@@H]2COC(C)(C)C2)c1	ZINC000853736919	CD	On-Demand	Clean	MTNR1A	44	45
COc1ccc(O)c(CNC(=O)N[C@@H]2COC(C)(C)C2)c1	ZINC000853736919	CD	On-Demand	Clean	MTNR1B	32	45
COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853736926	DE	On-Demand	Clean	MTNR1A	47	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853736926	DE	On-Demand	Clean	MTNR1B	39	41
COc1ccc(O)c(CNC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853736927	DE	On-Demand	Clean	MTNR1A	47	41
COc1ccc(O)c(CNC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853736927	DE	On-Demand	Clean	MTNR1B	39	41
Brc1cccc(OCCON=CC2CC2)c1	ZINC000853736928	CG	On-Demand	Mild	HMOX2	19	40
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC(=O)N(C)C2)c1	ZINC000853736932	DC	On-Demand	Clean	MTNR1A	32	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CC(=O)N(C)C2)c1	ZINC000853736932	DC	On-Demand	Clean	MTNR1B	23	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CC(=O)N(C)C2)c1	ZINC000853736933	DC	On-Demand	Clean	MTNR1A	32	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CC(=O)N(C)C2)c1	ZINC000853736933	DC	On-Demand	Clean	MTNR1B	23	41
COc1ccc(O)c(CNC(=O)NC[C@@](C)(COCc2ccccc2)OC)c1	ZINC000853736935	GF	On-Demand	Clean	MTNR1A	26	41
COc1ccc(O)c(CNC(=O)NC[C@@](C)(COCc2ccccc2)OC)c1	ZINC000853736935	GF	On-Demand	Clean	MTNR1B	25	40
COc1ccc(O)c(CNC(=O)NC[C@](C)(COCc2ccccc2)OC)c1	ZINC000853736936	GF	On-Demand	Clean	MTNR1A	26	41
COc1ccc(O)c(CNC(=O)NC[C@](C)(COCc2ccccc2)OC)c1	ZINC000853736936	GF	On-Demand	Clean	MTNR1B	25	40
N#Cc1cccc(NC(=O)CON=CC2CC2)c1	ZINC000853736942	BD	On-Demand	Mild	CCR3	16	41
COCc1n[nH]c(CNC(=O)NCc2cc(OC)ccc2O)n1	ZINC000853736943	DC	On-Demand	Clean	MTNR1A	24	41
COCc1n[nH]c(CNC(=O)NCc2cc(OC)ccc2O)n1	ZINC000853736943	DC	On-Demand	Clean	MTNR1B	17	41
COc1ccc(O)c(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853736949	FD	On-Demand	Clean	MTNR1A	56	45
COc1ccc(O)c(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853736949	FD	On-Demand	Clean	MTNR1B	42	45
O=C(CON=CC1CC1)NCc1ccccc1	ZINC000853736951	BD	On-Demand	Mild	MME	37	41
O=C(CON=CC1CC1)NCc1ccccc1	ZINC000853736951	BD	On-Demand	Mild	AMP1_PLAFQ	51	40
O=C(CON=CC1CC1)NCc1ccccc1	ZINC000853736951	BD	On-Demand	Mild	PDS	51	35
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCC1	ZINC000853736958	GF	On-Demand	Mild	LPL	49	39
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCC1	ZINC000853736958	GF	On-Demand	Mild	CNR2	16	48
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCC1	ZINC000853736958	GF	On-Demand	Mild	NR1H4	17	40
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCC1	ZINC000853736958	GF	On-Demand	Mild	EPHX2	30	41
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCC1	ZINC000853736958	GF	On-Demand	Mild	F13A1	47	38
COc1ccc(O)c(CNC(=O)NCc2c(C3CC3)cnn2C)c1	ZINC000853736959	EE	On-Demand	Clean	MTNR1A	37	40
COc1ccc(O)c(CNC(=O)NCc2c(C3CC3)cnn2C)c1	ZINC000853736959	EE	On-Demand	Clean	MTNR1B	31	40
COc1ccc(O)c(CNC(=O)NCc2c(OC)cccc2OC)c1	ZINC000853736962	EE	On-Demand	Clean	MTNR1A	95	51
COc1ccc(O)c(CNC(=O)NCc2c(OC)cccc2OC)c1	ZINC000853736962	EE	On-Demand	Clean	MTNR1B	88	51
COc1ccc(O)c(CNC(=O)N[C@@H](C)CN2CCC(C)CC2)c1	ZINC000853736963	EE	On-Demand	Clean	PLD1	46	32
COc1ccc(O)c(CNC(=O)N[C@@H](C)CN2CCC(C)CC2)c1	ZINC000853736963	EE	On-Demand	Clean	MTNR1A	42	39
COc1ccc(O)c(CNC(=O)N[C@@H](C)CN2CCC(C)CC2)c1	ZINC000853736963	EE	On-Demand	Clean	EBP	45	40
COc1ccc(O)c(CNC(=O)N[C@H](C)CN2CCC(C)CC2)c1	ZINC000853736964	EE	On-Demand	Clean	PLD1	46	32
COc1ccc(O)c(CNC(=O)N[C@H](C)CN2CCC(C)CC2)c1	ZINC000853736964	EE	On-Demand	Clean	MTNR1A	42	39
COc1ccc(O)c(CNC(=O)N[C@H](C)CN2CCC(C)CC2)c1	ZINC000853736964	EE	On-Demand	Clean	EBP	45	40
COc1ccc(O)c(CNC(=O)N[C@H](C)c2cscn2)c1	ZINC000853736965	DE	On-Demand	Clean	MTNR1A	27	41
COc1ccc(O)c(CNC(=O)N[C@H](C)c2cscn2)c1	ZINC000853736965	DE	On-Demand	Clean	MTNR1B	23	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2cscn2)c1	ZINC000853736966	DE	On-Demand	Clean	MTNR1A	27	41
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2cscn2)c1	ZINC000853736966	DE	On-Demand	Clean	MTNR1B	23	41
COc1ccc(O)c(CNC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853736975	FD	On-Demand	Clean	MTNR1A	34	45
COc1ccc(O)c(CNC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853736975	FD	On-Demand	Clean	MTNR1B	24	45
COc1ccc(O)c(CNC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853736976	FD	On-Demand	Clean	MTNR1A	34	45
COc1ccc(O)c(CNC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853736976	FD	On-Demand	Clean	MTNR1B	24	45
CC(C)(C)OC(=O)Cc1ccc(OCCC2OCCO2)cc1	ZINC000853736978	DF	On-Demand	Anodyne	PLA2G4B	40	37
COc1ccc(O)c(CNC(=O)NCCN2C[C@@H]3CCCCN3C2=O)c1	ZINC000853736987	FD	On-Demand	Clean	DRD4	40	31
COc1ccc(O)c(CNC(=O)NCCN2C[C@H]3CCCCN3C2=O)c1	ZINC000853736988	FD	On-Demand	Clean	DRD4	40	31
C[C@H](C#N)OCCOc1ccc(CC(=O)OC(C)(C)C)cc1	ZINC000853736994	DF	On-Demand	Mild	PLA2G4B	45	36
C[C@@H](C#N)OCCOc1ccc(CC(=O)OC(C)(C)C)cc1	ZINC000853736995	DF	On-Demand	Mild	PLA2G4B	45	36
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(OC)ccc3O)C2)cc1	ZINC000853737000	FE	On-Demand	Clean	MTNR1A	45	50
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(OC)ccc3O)C2)cc1	ZINC000853737000	FE	On-Demand	Clean	MTNR1B	37	50
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(OC)ccc3O)C2)cc1	ZINC000853737000	FE	On-Demand	Clean	EPHX2	15	41
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(OC)ccc3O)C2)cc1	ZINC000853737000	FE	On-Demand	Clean	MCHR1	16	46
CCOc1cc(CNC(=O)NNc2ccc(C)c(F)c2)ccc1OC	ZINC000853737005	EG	On-Demand	Reactive	DRTS_TRYCR	51	38
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCCC1	ZINC000853737011	GF	On-Demand	Mild	LPL	49	39
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCCC1	ZINC000853737011	GF	On-Demand	Mild	CNR2	16	48
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCCC1	ZINC000853737011	GF	On-Demand	Mild	NR1H4	17	40
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCCC1	ZINC000853737011	GF	On-Demand	Mild	EPHX2	30	41
Cc1ccc(NC(=O)CON=CC2CC2)cc1S(=O)(=O)N1CCCCCC1	ZINC000853737011	GF	On-Demand	Mild	F13A1	47	38
O=C(COc1cccc2c1OCCCO2)Nc1ccc(N2CCCCC2)cc1	ZINC000853737013	GH	On-Demand	Anodyne	STAT6	41	35
COc1ccc(O)c(CNC(=O)NCCC2(CS(C)(=O)=O)CC2)c1	ZINC000853737014	FD	On-Demand	Clean	MTNR1A	48	45
COc1ccc(O)c(CNC(=O)NCCC2(CS(C)(=O)=O)CC2)c1	ZINC000853737014	FD	On-Demand	Clean	MTNR1B	32	45
O=C(CON=CC1CC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853737019	FD	On-Demand	Mild	EPHX2	17	48
O=C(CON=CC1CC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853737019	FD	On-Demand	Mild	TGM2	83	43
O=C(CON=CC1CC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853737019	FD	On-Demand	Mild	F13A1	99	43
O=C(CON=CC1CC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853737019	FD	On-Demand	Mild	MERTK	33	43
O=C(CON=CC1CC1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853737019	FD	On-Demand	Mild	NAMPT	34	44
CC(C)(C)OC(=O)Cc1ccc(OCCC2SCCS2)cc1	ZINC000853737020	EI	On-Demand	Anodyne	PLA2G4B	40	37
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@H]3C[C@@H]32)c1	ZINC000853737022	DF	On-Demand	Clean	MTNR1A	36	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@H]3C[C@@H]32)c1	ZINC000853737022	DF	On-Demand	Clean	MTNR1B	27	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@H]3C[C@H]32)c1	ZINC000853737023	DF	On-Demand	Clean	MTNR1A	36	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@H]3C[C@H]32)c1	ZINC000853737023	DF	On-Demand	Clean	MTNR1B	27	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@@H]3C[C@@H]23)c1	ZINC000853737024	DF	On-Demand	Clean	MTNR1A	36	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@@H]3C[C@@H]23)c1	ZINC000853737024	DF	On-Demand	Clean	MTNR1B	27	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@@H]3C[C@H]23)c1	ZINC000853737025	DF	On-Demand	Clean	MTNR1A	36	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCC[C@@H]3C[C@H]23)c1	ZINC000853737025	DF	On-Demand	Clean	MTNR1B	27	41
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CON=CC2CC2)cc1	ZINC000853737031	GH	On-Demand	Mild	MAOA	15	61
COc1ccc([C@@H]2CC(c3ccccc3)=NN2C(=O)CON=CC2CC2)cc1	ZINC000853737031	GH	On-Demand	Mild	GRIN2D	88	36
C#CCCCOc1ccc(CC(=O)OC(C)(C)C)cc1	ZINC000853737033	CG	On-Demand	Mild	PLA2G4B	86	42
C#CCCCOc1ccc(CC(=O)OC(C)(C)C)cc1	ZINC000853737033	CG	On-Demand	Mild	PPO2	19	40
COc1ccc(O)c(CNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853737038	FD	On-Demand	Clean	MTNR1A	50	41
COc1ccc(O)c(CNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853737038	FD	On-Demand	Clean	MTNR1B	35	41
O=C(COc1cccc2c1OCCCO2)Nc1ccc(N2CCCC2)cc1	ZINC000853737040	FG	On-Demand	Anodyne	STAT6	43	34
O=C(CON=CC1CC1)NC12CC3CC(CC(C3)C1)C2	ZINC000853737041	CE	On-Demand	Mild	EPHX2	70	45
O=C(CON=CC1CC1)Nc1ccc(C(F)(F)F)cc1	ZINC000853737042	CG	On-Demand	Mild	MTTP	40	41
O=C(CON=CC1CC1)Nc1ccc(C(F)(F)F)cc1	ZINC000853737042	CG	On-Demand	Mild	EPHX2	29	44
O=C(CON=CC1CC1)Nc1ccccc1	ZINC000853737048	BE	On-Demand	Mild	TIMP3	48	32
O=C(CON=CC1CC1)Nc1ccccc1	ZINC000853737048	BE	On-Demand	Mild	HDAC8	20	41
O=C(CON=CC1CC1)Nc1ccccc1	ZINC000853737048	BE	On-Demand	Mild	HDAC10	30	43
O=C(CON=CC1CC1)Nc1ccccc1	ZINC000853737048	BE	On-Demand	Mild	HDAC2	20	43
O=C(CON=CC1CC1)Nc1ccccc1	ZINC000853737048	BE	On-Demand	Mild	HDAC3	18	41
O=C(CON=CC1CC1)Nc1ccccc1	ZINC000853737048	BE	On-Demand	Mild	HDAC6	21	41
O=C(CON=CC1CC1)Nc1ccccc1	ZINC000853737048	BE	On-Demand	Mild	HDAC11	33	43
CC[C@@H](NC(=O)NCc1cc(OC)ccc1O)C1CC1	ZINC000853737050	CE	On-Demand	Clean	MTNR1A	59	44
CC[C@@H](NC(=O)NCc1cc(OC)ccc1O)C1CC1	ZINC000853737050	CE	On-Demand	Clean	MTNR1B	46	44
CC(=O)Nc1cccc(NC(=O)CON=CC2CC2)c1	ZINC000853737053	CD	On-Demand	Mild	KCNK3	54	32
CC(=O)Nc1cccc(NC(=O)CON=CC2CC2)c1	ZINC000853737053	CD	On-Demand	Mild	KCNK9	55	32
COc1ccc(O)c(CNC(=O)NCc2cccc(OC3CC3)c2F)c1	ZINC000853737060	FG	On-Demand	Clean	NQO2	25	40
COc1ccc(O)c(CNC(=O)NCc2cccc(OC3CC3)c2F)c1	ZINC000853737060	FG	On-Demand	Clean	MTNR1A	57	40
COc1ccc(O)c(CNC(=O)NCc2cccc(OC3CC3)c2F)c1	ZINC000853737060	FG	On-Demand	Clean	MTNR1B	48	40
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853737061	CE	On-Demand	Mild	CACNA1C	41	34
C[C@@H](ON=CC1CC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853737061	CE	On-Demand	Mild	CACNA1D	65	34
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)c1	ZINC000853737064	EF	On-Demand	Clean	MTNR1A	76	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)c1	ZINC000853737064	EF	On-Demand	Clean	MTNR1B	66	45
COc1ccc(O)c(CNC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)c1	ZINC000853737064	EF	On-Demand	Clean	EPHX2	35	42
O=C(NCCOc1cccnc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853737073	EC	On-Demand	Anodyne	CHRNA7	52	37
O=C(NCCOc1cccnc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853737074	EC	On-Demand	Anodyne	CHRNA7	52	37
CS(=O)(=O)C1CN(C(=O)NCCOc2cccnc2)C1	ZINC000853737079	CB	On-Demand	Anodyne	CHRNA7	22	40
CS(=O)(=O)C1CN(C(=O)NCCOc2cccnc2)C1	ZINC000853737079	CB	On-Demand	Anodyne	NAMPT	50	37
O=C(NCCOc1cccnc1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853737089	CC	On-Demand	Anodyne	CHRNA7	20	41
COC(=O)c1ccoc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737091	DF	On-Demand	Anodyne	PANC	57	40
CC(C)n1ncc2cc(Cn3cc(NC(=O)OC(C)(C)C)cn3)cnc21	ZINC000853737092	FH	On-Demand	Anodyne	PANC	54	37
CCCn1ncnc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737094	DE	On-Demand	Anodyne	PANC	52	35
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	DRD4	28	56
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	SIGMAR1	22	50
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	SSTR5	42	42
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	CCR3	30	43
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	UTS2R	23	47
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	MLNR	39	43
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	CCR2	38	51
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	SLC6A5	41	50
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	EPHX2	24	40
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	MCHR1	69	45
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	CACNA1G	42	39
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737105	FE	On-Demand	Anodyne	BIRC2	24	41
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	DRD4	28	56
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	SIGMAR1	22	50
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	SSTR5	42	42
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	CCR3	30	43
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	UTS2R	23	47
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	MLNR	39	43
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	CCR2	38	51
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	SLC6A5	41	50
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	EPHX2	24	40
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	MCHR1	69	45
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	CACNA1G	42	39
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853737106	FE	On-Demand	Anodyne	BIRC2	24	41
Cc1cncc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737112	CF	On-Demand	Anodyne	PANC	59	40
O=C(COc1c(CO)cc(Br)cc1CO)Nc1ccc(N2CCOCC2)cc1	ZINC000853737116	JE	On-Demand	Anodyne	STAT6	56	34
CC(C)(C)OC(=O)N1CCC(CCCn2cc(C3CC3)nn2)CC1	ZINC000853737125	EH	On-Demand	Anodyne	GPR119	49	47
COc1cccc(SCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737126	EI	On-Demand	Anodyne	MTNR1A	27	47
COc1cccc(SCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737126	EI	On-Demand	Anodyne	MTNR1B	31	47
COc1cccc(SCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737126	EI	On-Demand	Anodyne	PANC	45	32
O=C(NCCOc1cccnc1)NC1CC(CO)C1	ZINC000853737142	CC	On-Demand	Anodyne	HRH2	15	40
CN(C)S(=O)(=O)c1ccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)s1	ZINC000853737145	GF	On-Demand	Anodyne	PANC	54	36
Cc1ccc(CC2CN(C(=O)NCCOc3cccnc3)C2)cc1	ZINC000853737150	EF	On-Demand	Anodyne	CHRNA7	28	44
C=C(Cl)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737153	CF	On-Demand	Mild	PANC	56	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCOc1cccnc1	ZINC000853737165	GE	On-Demand	Anodyne	GPR119	41	43
COc1ccc(O)c(CNC(=O)NCCC2SCCS2)c1	ZINC000853737167	EE	On-Demand	Clean	MTNR1A	51	46
COc1ccc(O)c(CNC(=O)NCCC2SCCS2)c1	ZINC000853737167	EE	On-Demand	Clean	MTNR1B	38	46
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	HRH2	34	49
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	LTA4H	24	40
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	SIGMAR1	16	47
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	SSTR5	43	35
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	CHRNA7	38	40
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	FAAH	16	42
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	CXCR3	17	42
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853737172	FD	On-Demand	Anodyne	NAMPT	61	41
CC(C)(C#N)CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737173	CG	On-Demand	Mild	PANC	46	33
CC(C)(C)OC(=O)NCc1nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)no1	ZINC000853737194	GF	On-Demand	Anodyne	PANC	63	42
COCCCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737195	CG	On-Demand	Anodyne	PANC	54	36
CCc1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)o1	ZINC000853737203	CE	On-Demand	Anodyne	PANC	56	38
CN(C)S(=O)(=O)c1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737206	GF	On-Demand	Anodyne	ITK	15	43
CN(C)S(=O)(=O)c1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737206	GF	On-Demand	Anodyne	PANC	57	39
C[C@@H]1CCCC[C@@H]1N(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737223	FG	On-Demand	Anodyne	PANC	53	35
C[C@@H]1CCCC[C@H]1N(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737224	FG	On-Demand	Anodyne	PANC	53	35
COc1ccccc1-c1nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cs1	ZINC000853737229	GI	On-Demand	Anodyne	PANC	61	40
O=C(NCCc1nnc(S)n1C1CC1)NCc1coc2ccccc12	ZINC000853737232	FF	On-Demand	Anodyne	INHA	49	32
C[C@H]1CC[C@@H](n2cc(NC(=O)OC(C)(C)C)cn2)C1	ZINC000853737233	CH	On-Demand	Anodyne	PANC	40	32
C[C@H]1CC[C@H](n2cc(NC(=O)OC(C)(C)C)cn2)C1	ZINC000853737234	CH	On-Demand	Anodyne	PANC	40	32
C[C@@H]1CC[C@H](n2cc(NC(=O)OC(C)(C)C)cn2)C1	ZINC000853737235	CH	On-Demand	Anodyne	PANC	40	32
CC(C)(C)CCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737238	DF	On-Demand	Anodyne	PANC	50	34
CSCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737239	CF	On-Demand	Anodyne	PANC	52	35
COC1(Cn2cc(NC(=O)OC(C)(C)C)cn2)CCC1	ZINC000853737246	CF	On-Demand	Anodyne	PANC	52	35
Cc1cc(C#N)ccc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737261	DG	On-Demand	Mild	PANC	55	41
C=CCOCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737269	CE	On-Demand	Mild	PANC	45	33
Cc1ncc(Cn2cc(NC(=O)OC(C)(C)C)cn2)s1	ZINC000853737272	CG	On-Demand	Anodyne	PANC	57	38
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	HRH2	34	49
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	LTA4H	24	40
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	SIGMAR1	16	47
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	SSTR5	43	35
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	CHRNA7	38	40
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	FAAH	16	42
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	CXCR3	17	42
O=C(NCCOc1cccnc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853737357	FD	On-Demand	Anodyne	NAMPT	61	41
CCN1CC[C@H](N(CC)C(=O)NCCOc2cccnc2)C1	ZINC000853737361	DD	On-Demand	Anodyne	CCR5	18	41
CCN1CC[C@@H](N(CC)C(=O)NCCOc2cccnc2)C1	ZINC000853737362	DD	On-Demand	Anodyne	CCR5	18	41
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	DRD4	40	31
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	OPRD1	15	40
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	HTR4	35	43
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	SIGMAR1	20	50
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	CCR3	33	40
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	MTNR1A	46	41
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	MTNR1B	39	41
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	PDK1	40	41
COc1ccc(O)c(CNC(=O)NCC2CCN(CC3CC3)CC2)c1	ZINC000853737365	EE	On-Demand	Clean	CACNA1I	71	38
O=C(NCCOc1cccnc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853737366	FE	On-Demand	Anodyne	CCR5	15	43
O=C(NCCOc1cccnc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853737366	FE	On-Demand	Anodyne	CHRNA7	23	40
O=C(NCCOc1cccnc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853737366	FE	On-Demand	Anodyne	EPHX2	24	48
COc1ccc(O)c(CNC(=O)NCCOCCF)c1	ZINC000853737384	CD	On-Demand	Clean	MTNR1A	55	48
COc1ccc(O)c(CNC(=O)NCCOCCF)c1	ZINC000853737384	CD	On-Demand	Clean	MTNR1B	43	48
COc1cccc(C2(NC(=O)NCCOc3cccnc3)CCC2)c1	ZINC000853737385	EF	On-Demand	Anodyne	MTNR1A	32	46
COc1cccc(C2(NC(=O)NCCOc3cccnc3)CCC2)c1	ZINC000853737385	EF	On-Demand	Anodyne	MTNR1B	30	46
COC[C@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737386	EE	On-Demand	Anodyne	PTAFR	17	45
COC[C@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737386	EE	On-Demand	Anodyne	ROCK1	17	41
COC[C@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737386	EE	On-Demand	Anodyne	MTNR1A	37	48
COC[C@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737386	EE	On-Demand	Anodyne	MTNR1B	35	48
COC[C@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737386	EE	On-Demand	Anodyne	ROCK2	19	41
COC[C@@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737387	EE	On-Demand	Anodyne	PTAFR	17	45
COC[C@@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737387	EE	On-Demand	Anodyne	ROCK1	17	41
COC[C@@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737387	EE	On-Demand	Anodyne	MTNR1A	37	48
COC[C@@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737387	EE	On-Demand	Anodyne	MTNR1B	35	48
COC[C@@H](NC(=O)NCCOc1cccnc1)c1cccc(OC)c1	ZINC000853737387	EE	On-Demand	Anodyne	ROCK2	19	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CCOC2(C)C)c1	ZINC000853737390	DE	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)NC[C@H]2CCOC2(C)C)c1	ZINC000853737390	DE	On-Demand	Clean	MTNR1B	34	44
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCOC2(C)C)c1	ZINC000853737391	DE	On-Demand	Clean	MTNR1A	45	44
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCOC2(C)C)c1	ZINC000853737391	DE	On-Demand	Clean	MTNR1B	34	44
COc1ccc(O)c(CNC(=O)NCC(F)(F)C(C)(C)C)c1	ZINC000853737397	DF	On-Demand	Clean	MTNR1A	47	46
COc1ccc(O)c(CNC(=O)NCC(F)(F)C(C)(C)C)c1	ZINC000853737397	DF	On-Demand	Clean	MTNR1B	34	46
CO[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)C1CC1	ZINC000853737400	CF	On-Demand	Anodyne	PANC	59	39
CC(C)(C)OC(=O)N1CCc2ccc(Cn3cc(C4CC4)nn3)cc2C1	ZINC000853737403	FG	On-Demand	Anodyne	KDM1A	17	43
O=C(NCCOc1cccnc1)N[C@H]1C[C@H](O)C1	ZINC000853737412	CC	On-Demand	Anodyne	HRH2	18	41
O=C(NCCOc1cccnc1)N[C@H]1C[C@H](O)C1	ZINC000853737412	CC	On-Demand	Anodyne	CHRNA7	26	40
CC#CCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737437	BF	On-Demand	Mild	PANC	50	34
CCn1c(C)nnc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737450	DE	On-Demand	Anodyne	PANC	52	35
O=C(NCCOc1cccnc1)NCC1CCC(O)CC1	ZINC000853737453	CD	On-Demand	Anodyne	GRIN2B	19	42
Cn1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853737454	CC	On-Demand	Anodyne	PANC	54	36
CO[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)C1CCCCC1	ZINC000853737457	DH	On-Demand	Anodyne	PANC	57	38
C=CCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737458	BF	On-Demand	Mild	PANC	51	34
Cc1nn(C)cc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737470	CE	On-Demand	Anodyne	PANC	56	38
CN(C(=O)NCCOc1cccnc1)[C@H](CO)Cc1ccccc1	ZINC000853737474	ED	On-Demand	Anodyne	PTAFR	18	41
CN(C(=O)NCCOc1cccnc1)[C@H](CO)Cc1ccccc1	ZINC000853737474	ED	On-Demand	Anodyne	NPY5R	17	45
CN(C(=O)NCCOc1cccnc1)[C@@H](CO)Cc1ccccc1	ZINC000853737475	ED	On-Demand	Anodyne	PTAFR	18	41
CN(C(=O)NCCOc1cccnc1)[C@@H](CO)Cc1ccccc1	ZINC000853737475	ED	On-Demand	Anodyne	NPY5R	17	45
COc1ccc(O)c(CNC(=O)NCC(C)(C)CC(F)(F)F)c1	ZINC000853737479	EG	On-Demand	Clean	MTNR1A	37	44
COc1ccc(O)c(CNC(=O)NCC(C)(C)CC(F)(F)F)c1	ZINC000853737479	EG	On-Demand	Clean	MTNR1B	29	44
Cc1ncsc1CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737508	DG	On-Demand	Anodyne	PANC	50	35
C[C@@H]1CCCC[C@H]1OCCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737515	GF	On-Demand	Anodyne	PANC	52	35
C[C@@H]1CCCC[C@@H]1OCCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737518	GF	On-Demand	Anodyne	PANC	52	35
COC(=O)C1(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)CCCCC1	ZINC000853737520	GE	On-Demand	Anodyne	PANC	48	32
Cn1nc(C(F)(F)F)c(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1Cl	ZINC000853737521	GH	On-Demand	Anodyne	PANC	52	35
CC(C)c1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)s1	ZINC000853737525	DG	On-Demand	Anodyne	PANC	52	35
CN(CC1CC1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737526	DE	On-Demand	Anodyne	PANC	57	38
CO[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccc(Cl)cc1	ZINC000853737528	FI	On-Demand	Anodyne	PANC	52	39
Cc1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1C1CC1	ZINC000853737530	DF	On-Demand	Anodyne	PANC	59	39
CCC(CC)n1ccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853737537	EH	On-Demand	Anodyne	PANC	54	36
Cc1nc(C(C)C)ccc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737545	EI	On-Demand	Anodyne	PANC	55	38
CN(c1nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cs1)C1CC1	ZINC000853737546	EG	On-Demand	Anodyne	PANC	60	40
Cc1nc(CCn2cc(NC(=O)OC(C)(C)C)cn2)cs1	ZINC000853737549	DG	On-Demand	Anodyne	PANC	44	32
CN(C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)C1CC1	ZINC000853737552	CD	On-Demand	Anodyne	PANC	56	37
COc1ccc(O)c(CNC(=O)NC2CC(C)(C)C2)c1	ZINC000853737573	CE	On-Demand	Clean	MTNR1A	57	46
COc1ccc(O)c(CNC(=O)NC2CC(C)(C)C2)c1	ZINC000853737573	CE	On-Demand	Clean	MTNR1B	42	46
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	DRD2	39	47
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	ACHE	15	40
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	DRD3	15	48
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	OPRK1	15	42
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	SIGMAR1	43	48
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	MTNR1A	50	38
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	MTNR1B	45	38
COc1ccc(O)c(CNC(=O)NC[C@@H]2CCN2Cc2ccccc2)c1	ZINC000853737586	FE	On-Demand	Clean	MCHR1	17	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	DRD2	39	47
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	ACHE	15	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	DRD3	15	48
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	OPRK1	15	42
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	SIGMAR1	43	48
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	MTNR1A	50	38
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	MTNR1B	45	38
COc1ccc(O)c(CNC(=O)NC[C@H]2CCN2Cc2ccccc2)c1	ZINC000853737587	FE	On-Demand	Clean	MCHR1	17	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2cc(OC)ccc2O)C1	ZINC000853737589	DD	On-Demand	Clean	MTNR1A	69	48
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2cc(OC)ccc2O)C1	ZINC000853737589	DD	On-Demand	Clean	MTNR1B	59	48
Cc1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)o1	ZINC000853737590	CD	On-Demand	Anodyne	PANC	57	38
COc1ccc(O)c(CNC(=O)NCC2(CC(N)=O)CCCCC2)c1	ZINC000853737594	EE	On-Demand	Clean	MTNR1A	39	44
COc1ccc(O)c(CNC(=O)NCC2(CC(N)=O)CCCCC2)c1	ZINC000853737594	EE	On-Demand	Clean	MTNR1B	28	44
O=C(NCCOc1cccnc1)N(CCN1CCOCC1)CC1CC1	ZINC000853737601	ED	On-Demand	Anodyne	CASR	53	48
O=C(NCCOc1cccnc1)N(CCN1CCOCC1)CC1CC1	ZINC000853737601	ED	On-Demand	Anodyne	CHRNA7	29	42
O=C(NCCOc1cccnc1)N(CCN1CCOCC1)CC1CC1	ZINC000853737601	ED	On-Demand	Anodyne	EPHX2	21	42
CC(C)n1ncnc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737603	DE	On-Demand	Anodyne	PANC	54	35
CC(C)(C)OC(=O)NCc1nc(Cn2cc(C3CC3)nn2)no1	ZINC000853737604	DD	On-Demand	Anodyne	PANC	52	34
CON(C)CCNC(=O)N[C@@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000853737607	GD	On-Demand	Anodyne	MTNR1A	15	50
CON(C)CCNC(=O)N[C@H]1CCN(c2cccc(OC(F)(F)F)c2)C1	ZINC000853737608	GD	On-Demand	Anodyne	MTNR1A	15	50
Fc1cccc(OCCn2cc(C3CC3)nn2)c1	ZINC000853737609	BE	On-Demand	Anodyne	CHRNA10	44	44
COC[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)OC	ZINC000853737623	CD	On-Demand	Anodyne	PANC	46	33
COC[C@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)OC	ZINC000853737624	CD	On-Demand	Anodyne	PANC	46	33
CCOc1ccc(-c2nc(Cn3cc(NC(=O)OC(C)(C)C)cn3)co2)cc1	ZINC000853737636	GI	On-Demand	Anodyne	PANC	52	34
COC(=O)Cn1cc(Cn2cc(NC(=O)OC(C)(C)C)cn2)nn1	ZINC000853737638	ED	On-Demand	Anodyne	PANC	52	35
CCCCC[C@@H](C)NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737650	EG	On-Demand	Anodyne	CTSK	19	42
CCCN(CCC)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737656	DF	On-Demand	Anodyne	PANC	45	33
Cn1cc(-c2cc(Cn3cc(NC(=O)OC(C)(C)C)cn3)on2)cn1	ZINC000853737660	EF	On-Demand	Anodyne	PANC	60	41
COc1cccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737666	EG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737666	EG	On-Demand	Anodyne	HRH2	36	42
COc1cccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737666	EG	On-Demand	Anodyne	PDGFRB	31	41
COc1cccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737666	EG	On-Demand	Anodyne	MTNR1A	44	45
COc1cccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737666	EG	On-Demand	Anodyne	MTNR1B	46	45
COc1cccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737666	EG	On-Demand	Anodyne	FLT4	27	41
COc1cccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737666	EG	On-Demand	Anodyne	PANC	50	33
Cc1cc(F)ccc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737668	DH	On-Demand	Anodyne	PANC	62	49
CO[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)[C@H]1CCOC1	ZINC000853737669	DE	On-Demand	Anodyne	PANC	57	38
CO[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)[C@@H]1CCOC1	ZINC000853737674	DE	On-Demand	Anodyne	PANC	57	38
CC[C@H]1c2ccsc2CCN1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737676	GH	On-Demand	Anodyne	PANC	53	35
CC[C@@H]1c2ccsc2CCN1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737677	GH	On-Demand	Anodyne	PANC	53	35
CCc1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)s1	ZINC000853737682	DF	On-Demand	Anodyne	PANC	54	36
Cc1cc(-c2noc(Cn3cc(NC(=O)OC(C)(C)C)cn3)n2)ccc1F	ZINC000853737684	FH	On-Demand	Anodyne	PANC	61	42
Cn1cncc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737703	CE	On-Demand	Anodyne	PANC	54	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2coc3ccccc23)C1	ZINC000853737704	FF	On-Demand	Anodyne	INHA	42	32
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2coc3ccccc23)C1	ZINC000853737706	FF	On-Demand	Anodyne	INHA	42	32
CN(C)S(=O)(=O)c1ccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853737710	GF	On-Demand	Anodyne	PANC	61	43
CCCOc1cccc(CNC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737719	GG	On-Demand	Anodyne	HRH2	39	46
CCCOc1cccc(CNC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737719	GG	On-Demand	Anodyne	PDGFRB	27	40
CCCOc1cccc(CNC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737719	GG	On-Demand	Anodyne	FLT4	24	40
CCCOc1cccc(CNC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737719	GG	On-Demand	Anodyne	PANC	51	35
CCCOc1cccc(CNC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737719	GG	On-Demand	Anodyne	PDS	57	35
COC(=O)c1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1C#N	ZINC000853737725	FF	On-Demand	Mild	PANC	55	39
Cn1nncc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737727	CD	On-Demand	Anodyne	PANC	54	36
CN(C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccccc1	ZINC000853737731	EF	On-Demand	Anodyne	PANC	57	40
Cc1ccccc1CCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737733	FF	On-Demand	Anodyne	NQO2	17	40
Cc1ccccc1CCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737733	FF	On-Demand	Anodyne	PANC	53	43
C#CCN1CCN(C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)CC1	ZINC000853737735	ED	On-Demand	Mild	PANC	45	33
Cn1cc(CCn2cc(NC(=O)OC(C)(C)C)cn2)cn1	ZINC000853737736	CE	On-Demand	Anodyne	PANC	57	39
Cc1ncc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cn1	ZINC000853737738	CE	On-Demand	Anodyne	PANC	60	41
CCN(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737743	CD	On-Demand	Anodyne	PANC	52	35
CC/C=C\CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737745	CH	On-Demand	Anodyne	PANC	46	33
CC/C=C/CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737746	CH	On-Demand	Anodyne	PANC	46	33
CCCCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737749	CH	On-Demand	Anodyne	ASAH1	55	31
CCCCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737749	CH	On-Demand	Anodyne	PANC	52	35
CNC(=O)[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccccc1	ZINC000853737751	GD	On-Demand	Anodyne	AMP1_PLAFQ	21	40
CNC(=O)[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccccc1	ZINC000853737751	GD	On-Demand	Anodyne	Q82323_9DELA	59	31
CNC(=O)[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccccc1	ZINC000853737751	GD	On-Demand	Anodyne	PANC	51	35
CC(C)(C#N)CCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737760	CH	On-Demand	Mild	PANC	45	33
COc1nc(C)cc(C)c1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737775	EG	On-Demand	Anodyne	PANC	52	35
C=C(C)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737783	BF	On-Demand	Mild	PANC	52	35
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2)C1=O	ZINC000853737793	ED	On-Demand	Anodyne	ACKR3	51	33
Cc1nonc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737795	CD	On-Demand	Anodyne	PANC	59	39
C=CCCCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737796	CH	On-Demand	Mild	PANC	46	33
C=C(CC)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737798	CG	On-Demand	Mild	PANC	51	34
CCOCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737803	CF	On-Demand	Anodyne	PANC	53	36
CCO[C@@H](C)c1noc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853737805	EF	On-Demand	Anodyne	PANC	56	37
CC(C)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737819	FH	On-Demand	Anodyne	PDGFRB	27	43
CC(C)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737819	FH	On-Demand	Anodyne	HDAC10	15	40
CC(C)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737819	FH	On-Demand	Anodyne	FLT4	25	43
CC(C)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737819	FH	On-Demand	Anodyne	CSF1R	15	40
CC(C)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737819	FH	On-Demand	Anodyne	PANC	50	33
CC(C)c1noc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853737823	DF	On-Demand	Anodyne	PANC	59	39
CSc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853737826	FH	On-Demand	Anodyne	PDGFRB	24	40
CSc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853737826	FH	On-Demand	Anodyne	FLT4	22	40
CSc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853737826	FH	On-Demand	Anodyne	PANC	51	34
CN(Cc1ccc(Cl)s1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737833	GH	On-Demand	Anodyne	PANC	52	35
C[C@@H]1Cc2ccccc2N1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737836	FG	On-Demand	Anodyne	DRD4	27	46
C[C@@H]1Cc2ccccc2N1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737836	FG	On-Demand	Anodyne	TPP2	56	33
C[C@@H]1Cc2ccccc2N1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737836	FG	On-Demand	Anodyne	PANC	54	36
C[C@@H]1CCCCN1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737850	DF	On-Demand	Anodyne	PANC	57	38
C[C@H]1CCCCN1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737851	DF	On-Demand	Anodyne	PANC	57	38
COc1ccc(-c2nnc(Cn3cc(NC(=O)OC(C)(C)C)cn3)o2)cc1	ZINC000853737852	FG	On-Demand	Anodyne	PANC	54	35
Cc1cc(C)cc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737853	EG	On-Demand	Anodyne	PANC	47	33
O=C(NCCOc1cccnc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853737856	ED	On-Demand	Anodyne	HRH3	24	41
O=C(NCCOc1cccnc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853737856	ED	On-Demand	Anodyne	L3MBTL3	55	37
O=C(NCCOc1cccnc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853737857	ED	On-Demand	Anodyne	HRH3	24	41
O=C(NCCOc1cccnc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853737857	ED	On-Demand	Anodyne	L3MBTL3	55	37
O=C(NCCOc1cccnc1)N1CCn2c(O)nnc2C1	ZINC000853737860	DB	On-Demand	Anodyne	P2RX7	26	40
O=C(NCCOc1cccnc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853737861	CE	On-Demand	Anodyne	FKBP1A	18	41
O=C(NCCOc1cccnc1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853737861	CE	On-Demand	Anodyne	CHRNA7	45	38
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCOc2cccnc2)C1	ZINC000853737866	CC	On-Demand	Anodyne	HRH2	25	44
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCOc2cccnc2)C1	ZINC000853737866	CC	On-Demand	Anodyne	CHRNA7	25	40
C[C@@H]1CCN(C(=O)NCCOc2cccnc2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853737878	GF	On-Demand	Anodyne	CHRNA7	17	40
O=C(NCCOc1cccnc1)N1CCC(O)(CO)CC1	ZINC000853737886	CB	On-Demand	Anodyne	CHRNA7	15	40
O=C(NCCOc1cccnc1)N1CCC(O)(CO)CC1	ZINC000853737886	CB	On-Demand	Anodyne	S1PR2	16	42
COC(=O)c1ccc([N+](=O)[O-])c(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737891	GF	On-Demand	Bother	PANC	57	40
Cc1ccncc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737897	CF	On-Demand	Anodyne	PANC	58	43
CO[C@@H](CC(C)C)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737900	CG	On-Demand	Anodyne	FPR1	40	33
CO[C@@H](CC(C)C)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737900	CG	On-Demand	Anodyne	PANC	45	33
COc1ccc(O)c(CNC(=O)NCc2cnccc2C(F)(F)F)c1	ZINC000853737913	FF	On-Demand	Clean	MTNR1A	27	42
COc1ccc(O)c(CNC(=O)NCc2cnccc2C(F)(F)F)c1	ZINC000853737913	FF	On-Demand	Clean	MTNR1B	25	42
Cc1nocc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737938	CF	On-Demand	Anodyne	PANC	60	41
O=C(NCCOc1cccnc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853737947	GE	On-Demand	Anodyne	HTR1A	20	47
O=C(NCCOc1cccnc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853737947	GE	On-Demand	Anodyne	DRD3	18	47
N#Cc1ccc(OCCCn2cc(C3CC3)nn2)cc1	ZINC000853737949	CE	On-Demand	Mild	HRH3	26	45
N#Cc1ccc(OCCCn2cc(C3CC3)nn2)cc1	ZINC000853737949	CE	On-Demand	Mild	MEN1	47	43
COc1ccc(O)c(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853737952	GE	On-Demand	Clean	MTNR1A	39	41
COc1ccc(O)c(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853737952	GE	On-Demand	Clean	MTNR1B	33	41
CCn1ncnc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737957	CD	On-Demand	Anodyne	PANC	53	35
CC(C)(C)NC(=O)CNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737965	FD	On-Demand	Anodyne	PANC	50	34
COC(=O)c1cccc(Cl)c1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737970	FH	On-Demand	Anodyne	PANC	57	39
COCCSCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737973	DF	On-Demand	Anodyne	PANC	51	34
COCCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737974	CF	On-Demand	Anodyne	PANC	55	36
Cc1ccc(F)c(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737976	DH	On-Demand	Anodyne	PANC	58	43
CO[C@@H](C)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737980	CE	On-Demand	Anodyne	PANC	51	34
COCCS(=O)(=O)CCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853737981	ED	On-Demand	Anodyne	PANC	52	35
CCOC(=O)c1c(Cn2cc(NC(=O)OC(C)(C)C)cn2)noc1C	ZINC000853737988	FF	On-Demand	Anodyne	PANC	58	40
Cc1cccc(S(=O)(=O)CCCn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853737997	GG	On-Demand	Anodyne	PANC	51	33
Cc1ccc(-c2cnc(Cn3cc(NC(=O)OC(C)(C)C)cn3)o2)cc1	ZINC000853738004	FI	On-Demand	Anodyne	PANC	55	37
CC(=O)N[C@@H]1CCCN(C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)C1	ZINC000853738010	FD	On-Demand	Anodyne	PANC	50	33
CC(=O)N[C@H]1CCCN(C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)C1	ZINC000853738011	FD	On-Demand	Anodyne	PANC	50	33
C[C@@H](CCn1cc(NC(=O)OC(C)(C)C)cn1)OCc1ccccc1	ZINC000853738016	EI	On-Demand	Anodyne	CTSK	16	41
C[C@@H](CCn1cc(NC(=O)OC(C)(C)C)cn1)OCc1ccccc1	ZINC000853738016	EI	On-Demand	Anodyne	FPR1	41	35
C[C@@H](CCn1cc(NC(=O)OC(C)(C)C)cn1)OCc1ccccc1	ZINC000853738016	EI	On-Demand	Anodyne	NPR	49	32
C[C@@H](CCn1cc(NC(=O)OC(C)(C)C)cn1)OCc1ccccc1	ZINC000853738016	EI	On-Demand	Anodyne	PANC	53	38
Cn1ncc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738019	CD	On-Demand	Anodyne	PANC	55	37
CC(C)c1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)o1	ZINC000853738022	DF	On-Demand	Anodyne	PANC	55	36
Cc1ncsc1-c1nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)no1	ZINC000853738024	FG	On-Demand	Anodyne	PANC	57	37
COC(=O)c1cccc(NNC(=O)NCc2cc(C(C)C)no2)c1C	ZINC000853738026	EF	On-Demand	Reactive	SLC5A7	24	42
Cn1nccc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738037	CE	On-Demand	Anodyne	PANC	60	40
COc1ccccc1[C@H](C)N(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738039	GG	On-Demand	Anodyne	PANC	51	34
C#CCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738048	BF	On-Demand	Mild	PANC	51	34
CCOC(Cn1cc(NC(=O)OC(C)(C)C)cn1)OCC	ZINC000853738049	CF	On-Demand	Anodyne	PANC	50	34
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)C(=O)N1CCCCC1	ZINC000853738052	GD	On-Demand	Anodyne	PANC	48	32
O=C(COc1c(CO)cc(Br)cc1CO)Nc1ccc2ccccc2c1	ZINC000853738054	HH	On-Demand	Anodyne	IMDH_CRYPV	53	46
COc1ccc(-c2noc(Cn3cc(NC(=O)OC(C)(C)C)cn3)n2)nn1	ZINC000853738055	FE	On-Demand	Anodyne	PANC	60	39
C[C@H]1CCc2ccccc2N1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738056	FH	On-Demand	Anodyne	PANC	58	38
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccccc1Cl	ZINC000853738061	GH	On-Demand	Anodyne	PANC	51	35
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c(Cl)c1	ZINC000853738071	FH	On-Demand	Anodyne	PANC	50	34
C[C@H]1C[C@@H](C)CN(C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)C1	ZINC000853738073	EF	On-Demand	Anodyne	PANC	52	35
C[C@@H]1C[C@@H](C)CN(C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)C1	ZINC000853738074	EF	On-Demand	Anodyne	PANC	52	35
CCOCCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738076	DD	On-Demand	Anodyne	PANC	49	33
CCO[C@@H](C)c1nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cs1	ZINC000853738078	FH	On-Demand	Anodyne	PANC	46	33
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccc2ccccc2c1	ZINC000853738082	GI	On-Demand	Anodyne	F7	18	45
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccc2ccccc2c1	ZINC000853738082	GI	On-Demand	Anodyne	PANC	50	39
COC(=O)CCCc1nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)no1	ZINC000853738085	FE	On-Demand	Anodyne	PANC	56	37
Cc1ccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738086	DH	On-Demand	Anodyne	PANC	51	34
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c(F)c1	ZINC000853738088	EG	On-Demand	Anodyne	PANC	46	35
CCOc1ccccc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738089	FG	On-Demand	Anodyne	PANC	53	35
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1C	ZINC000853738098	EG	On-Demand	Anodyne	PANC	51	37
C[C@@H]1CCCC[C@@H]1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738107	EF	On-Demand	Anodyne	PANC	55	37
C[C@@H]1CCCC[C@H]1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738108	EF	On-Demand	Anodyne	PANC	55	37
COc1ccc(CN(C)C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738110	FF	On-Demand	Anodyne	PANC	53	36
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccc(F)cc1	ZINC000853738112	FG	On-Demand	Anodyne	PANC	52	38
C=CCN(CC=C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738115	DE	On-Demand	Mild	PANC	41	32
Cc1ccccc1CN(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738118	FG	On-Demand	Anodyne	PANC	54	44
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)c(OC)c3)C2)cc1	ZINC000853738128	GF	On-Demand	Clean	SSTR5	42	33
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)c(OC)c3)C2)cc1	ZINC000853738128	GF	On-Demand	Clean	MTNR1A	38	45
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)c(OC)c3)C2)cc1	ZINC000853738128	GF	On-Demand	Clean	MTNR1B	29	45
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)c(OC)c3)C2)cc1	ZINC000853738128	GF	On-Demand	Clean	PDK1	40	35
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccc(O)c(OC)c3)C2)cc1	ZINC000853738128	GF	On-Demand	Clean	MCHR1	21	49
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccc(Cl)cc1	ZINC000853738135	GH	On-Demand	Anodyne	PANC	50	38
CN(Cc1cnn(C)c1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738137	ED	On-Demand	Anodyne	PANC	53	37
COc1ccc(-c2noc(Cn3cc(NC(=O)OC(C)(C)C)cn3)n2)cc1	ZINC000853738148	FG	On-Demand	Anodyne	PANC	62	40
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1cccs1	ZINC000853738153	FG	On-Demand	Anodyne	PANC	49	32
CSc1ccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738155	DI	On-Demand	Anodyne	ITK	15	40
CSc1ccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738155	DI	On-Demand	Anodyne	PANC	66	46
Cn1cncc1CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738191	CE	On-Demand	Anodyne	PANC	49	33
CO[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)C1CCC1	ZINC000853738199	CG	On-Demand	Anodyne	PANC	57	38
C#CCOCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738211	CD	On-Demand	Mild	PANC	45	33
Cc1nnc(Cn2cc(NC(=O)OC(C)(C)C)cn2)s1	ZINC000853738215	CE	On-Demand	Anodyne	PANC	57	38
CC[C@@H](O)CNC(=O)NCCOc1cccnc1	ZINC000853738216	CC	On-Demand	Anodyne	ADRB1	40	32
CC[C@@H](O)CNC(=O)NCCOc1cccnc1	ZINC000853738216	CC	On-Demand	Anodyne	ADRB3	17	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCOc2cccnc2)C1	ZINC000853738217	FE	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCOc2cccnc2)C1	ZINC000853738218	FE	On-Demand	Anodyne	GPR119	22	40
COc1ccc(O)c(CNC(=O)NC[C@H]2CN(C)CCN2Cc2ccccc2)c1	ZINC000853738221	GE	On-Demand	Clean	DRD2	27	41
COc1ccc(O)c(CNC(=O)NC[C@H]2CN(C)CCN2Cc2ccccc2)c1	ZINC000853738221	GE	On-Demand	Clean	SIGMAR1	28	43
COc1ccc(O)c(CNC(=O)NC[C@@H]2CN(C)CCN2Cc2ccccc2)c1	ZINC000853738222	GE	On-Demand	Clean	DRD2	27	41
COc1ccc(O)c(CNC(=O)NC[C@@H]2CN(C)CCN2Cc2ccccc2)c1	ZINC000853738222	GE	On-Demand	Clean	SIGMAR1	28	43
COc1ncccc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738224	DF	On-Demand	Anodyne	PANC	58	40
CCCCCCCCn1cc(C2CC2)nn1	ZINC000853738228	BH	On-Demand	Mild	GBA	17	47
CCCCCCCCn1cc(C2CC2)nn1	ZINC000853738228	BH	On-Demand	Mild	LASR	43	32
C=CCCn1cc(Cn2cc(NC(=O)OC(C)(C)C)cn2)nn1	ZINC000853738232	DE	On-Demand	Mild	PANC	50	33
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000853738233	GF	On-Demand	Clean	DRD4	40	32
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000853738233	GF	On-Demand	Clean	NQO2	24	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000853738233	GF	On-Demand	Clean	ADAM17	23	40
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000853738233	GF	On-Demand	Clean	MTNR1A	49	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000853738233	GF	On-Demand	Clean	MTNR1B	41	41
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000853738233	GF	On-Demand	Clean	SSTR3	35	49
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000853738233	GF	On-Demand	Clean	PRKACA	51	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C3CC3)nn2)CC1	ZINC000853738239	DD	On-Demand	Anodyne	P2RY12	79	42
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C3CC3)nn2)CC1	ZINC000853738240	DD	On-Demand	Anodyne	P2RY12	79	42
O=C(NCCOc1cccnc1)NCCc1nnc(S)n1C1CC1	ZINC000853738248	ED	On-Demand	Anodyne	VCP	53	34
C[C@H](O)CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738251	CE	On-Demand	Anodyne	PANC	51	35
C=CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738257	BE	On-Demand	Mild	PANC	52	35
COc1cc(C)nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738266	DF	On-Demand	Anodyne	PANC	52	35
CCn1nnc(C)c1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738269	DE	On-Demand	Anodyne	PANC	52	35
CCOc1cc(Cn2cc(NC(=O)OC(C)(C)C)cn2)ccc1[N+](=O)[O-]	ZINC000853738276	FH	On-Demand	Bother	PANC	55	38
CC(=O)c1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738277	FG	On-Demand	Anodyne	PDGFRB	23	40
CC(=O)c1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738277	FG	On-Demand	Anodyne	FLT4	22	40
CC(=O)c1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738277	FG	On-Demand	Anodyne	PANC	55	38
CC(=O)c1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738278	DG	On-Demand	Anodyne	ITK	16	42
CC(=O)c1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738278	DG	On-Demand	Anodyne	IMDH_CRYPV	15	43
CC(=O)c1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738278	DG	On-Demand	Anodyne	PANC	64	44
COC(=O)/C=C\c1ccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738283	GG	On-Demand	Anodyne	PANC	51	34
CC(C)(C)OC(=O)CNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738284	FD	On-Demand	Anodyne	PANC	51	35
COc1ccc(-c2cnc(Cn3cc(NC(=O)OC(C)(C)C)cn3)o2)cc1	ZINC000853738288	FH	On-Demand	Anodyne	PANC	54	35
C=C(C)CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738291	CG	On-Demand	Mild	PANC	51	34
CC#CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738312	BE	On-Demand	Mild	PANC	51	35
COC(=O)c1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738316	EE	On-Demand	Anodyne	PANC	56	38
CN(C)c1noc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738323	DD	On-Demand	Anodyne	PANC	60	39
CON(C)CCNC(=O)NCc1cc(C(C)C)no1	ZINC000853738325	CD	On-Demand	Anodyne	SLC5A7	25	42
CCOC(=O)c1csc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738328	FF	On-Demand	Anodyne	PANC	51	35
CON(C)CCNC(=O)NCc1coc2ccccc12	ZINC000853738332	CD	On-Demand	Anodyne	MTNR1A	18	44
C[C@@H](C#N)OCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738335	CE	On-Demand	Mild	PANC	50	33
C[C@H](C#N)OCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738336	CE	On-Demand	Mild	PANC	50	33
CN(C)S(=O)(=O)c1ccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)o1	ZINC000853738360	FE	On-Demand	Anodyne	PANC	56	38
CN(C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)C1CCCCC1	ZINC000853738365	EG	On-Demand	Anodyne	PANC	54	36
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738377	EG	On-Demand	Anodyne	PANC	52	35
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)[C@@H]1C[C@H]2CC[C@H]1C2	ZINC000853738381	FG	On-Demand	Anodyne	PANC	52	35
C[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)[C@H]1C[C@H]2CC[C@H]1C2	ZINC000853738382	FG	On-Demand	Anodyne	PANC	52	35
CCOc1ccc(-c2noc(Cn3cc(NC(=O)OC(C)(C)C)cn3)n2)cc1	ZINC000853738385	GH	On-Demand	Anodyne	PANC	60	39
COC(=O)c1ccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)c(Cl)c1	ZINC000853738388	GH	On-Demand	Anodyne	PANC	52	39
CCOc1ccc(C(C)=O)cc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738389	FH	On-Demand	Anodyne	PANC	57	37
COc1ccc(OCCCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738395	EH	On-Demand	Anodyne	PANC	51	34
CC(C)c1ccc(CCNC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738398	GH	On-Demand	Anodyne	PANC	52	37
COc1ccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738402	EG	On-Demand	Anodyne	PANC	51	34
Cn1cccc1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738405	DE	On-Demand	Anodyne	PANC	51	33
COc1ccc(C)cc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738407	FG	On-Demand	Anodyne	PDGFRB	30	42
COc1ccc(C)cc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738407	FG	On-Demand	Anodyne	FLT4	24	42
COc1ccc(C)cc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738407	FG	On-Demand	Anodyne	PANC	41	32
CCOc1ccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738408	EH	On-Demand	Anodyne	PANC	50	34
CC(C)c1ccccc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738422	FH	On-Demand	Anodyne	SOAT1	41	39
CC(C)c1ccccc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738422	FH	On-Demand	Anodyne	PANC	51	34
C[C@@H](C1CC1)N(C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)C1CC1	ZINC000853738424	EG	On-Demand	Anodyne	PANC	58	40
Cn1cc(-c2nc(Cn3cc(NC(=O)OC(C)(C)C)cn3)cs2)cn1	ZINC000853738425	FG	On-Demand	Anodyne	PANC	55	37
C[C@H]1CCC[C@H](C)N1C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738438	EG	On-Demand	Anodyne	PANC	56	37
Cc1sc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c(C)c1C	ZINC000853738439	FH	On-Demand	Anodyne	PANC	41	32
CN(C)S(=O)(=O)CCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738441	ED	On-Demand	Anodyne	PANC	45	33
Cc1cccc(CNC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738446	EF	On-Demand	Anodyne	PANC	56	38
CN(CC1CCCCC1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738447	FG	On-Demand	Anodyne	PANC	55	37
Cc1cccc(C(C)C)c1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738454	FI	On-Demand	Anodyne	SOAT1	51	40
Cc1cccc(C(C)C)c1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738454	FI	On-Demand	Anodyne	PANC	49	35
CC(C)(C)OC(=O)N1CCC(CCn2cc(C3CC3)nn2)CC1	ZINC000853738461	DG	On-Demand	Anodyne	GPR119	51	48
CCC(CC)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738463	CH	On-Demand	Anodyne	PANC	51	35
C[C@H](c1ccc(Cl)cc1)N(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738472	GI	On-Demand	Anodyne	PANC	42	38
C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738475	GI	On-Demand	Anodyne	PANC	42	38
Cc1ncsc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738477	CG	On-Demand	Anodyne	PANC	56	37
COc1ccc(CCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738483	DG	On-Demand	Anodyne	PROKR1	43	30
COc1ccc(CCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738483	DG	On-Demand	Anodyne	PANC	58	39
COc1ccc(O)c(CNC(=O)NC[C@H](OC)C2CCCCC2)c1	ZINC000853738494	EF	On-Demand	Clean	MTNR1A	42	42
COc1ccc(O)c(CNC(=O)NC[C@H](OC)C2CCCCC2)c1	ZINC000853738494	EF	On-Demand	Clean	MTNR1B	31	42
COc1ccc(O)c(CNC(=O)NC[C@@H](OC)C2CCCCC2)c1	ZINC000853738496	EF	On-Demand	Clean	MTNR1A	42	42
COc1ccc(O)c(CNC(=O)NC[C@@H](OC)C2CCCCC2)c1	ZINC000853738496	EF	On-Demand	Clean	MTNR1B	31	42
CC(C)(C)CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738501	CH	On-Demand	Anodyne	PANC	53	36
Cc1noc(C)c1CCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738502	DG	On-Demand	Anodyne	PANC	55	37
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	DRD4	24	51
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	SIGMAR1	17	46
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	CCR3	18	40
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	UTS2R	21	44
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	MLNR	23	40
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	CCR2	25	48
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	SLC6A5	36	43
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738513	GF	On-Demand	Mild	MCHR1	45	42
COC(=O)CCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738514	CE	On-Demand	Anodyne	PANC	51	34
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	DRD4	24	51
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	SIGMAR1	17	46
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	CCR3	18	40
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	UTS2R	21	44
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	MLNR	23	40
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	CCR2	25	48
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	SLC6A5	36	43
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738515	GF	On-Demand	Mild	MCHR1	45	42
Cn1c(S)nnc1CCNC(=O)NCc1coc2ccccc12	ZINC000853738527	ED	On-Demand	Anodyne	INHA	61	33
O=C(NC/C=C/CO)NCCOc1cccnc1	ZINC000853738528	CC	On-Demand	Anodyne	NAMPT	24	42
CC(=O)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738529	FG	On-Demand	Anodyne	PDGFRB	26	42
CC(=O)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738529	FG	On-Demand	Anodyne	HDAC10	15	41
CC(=O)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738529	FG	On-Demand	Anodyne	FLT4	23	42
CC(=O)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738529	FG	On-Demand	Anodyne	IMDH_CRYPV	19	43
CC(=O)c1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738529	FG	On-Demand	Anodyne	PANC	53	35
O=C(NC/C=C\CO)NCCOc1cccnc1	ZINC000853738530	CC	On-Demand	Anodyne	NAMPT	24	42
CCSCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738536	CF	On-Demand	Anodyne	PANC	50	34
Cn1cc(Br)c(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738552	FF	On-Demand	Anodyne	PANC	54	37
CCc1noc(C)c1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738563	DG	On-Demand	Anodyne	PANC	60	40
O=C(NCCOc1cccnc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853738565	EE	On-Demand	Anodyne	CHRNA7	35	43
O=C(NCCOc1cccnc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853738565	EE	On-Demand	Anodyne	EPHX2	28	54
O=C(NCCOc1cccnc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853738565	EE	On-Demand	Anodyne	SCD	24	40
C#CCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738567	BE	On-Demand	Mild	PANC	51	35
O=C(Cn1cnc2[nH]c3cc(F)ccc3c2c1=O)NC1CCCCCCC1	ZINC000853738576	FG	On-Demand	Anodyne	CNR2	21	43
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2nccn2C)c1	ZINC000853738585	DD	On-Demand	Clean	MTNR1A	29	40
COc1ccc(O)c(CNC(=O)N[C@@H](C)c2nccn2C)c1	ZINC000853738585	DD	On-Demand	Clean	MTNR1B	28	40
COc1ccc(O)c(CNC(=O)N[C@H](C)c2nccn2C)c1	ZINC000853738586	DD	On-Demand	Clean	MTNR1A	29	40
COc1ccc(O)c(CNC(=O)N[C@H](C)c2nccn2C)c1	ZINC000853738586	DD	On-Demand	Clean	MTNR1B	28	40
COC(=O)C1(Cn2cc(NC(=O)OC(C)(C)C)cn2)CC1	ZINC000853738588	CE	On-Demand	Anodyne	PANC	52	35
COc1ccc(O)c(CNC(=O)NCc2cccc(OC)c2C)c1	ZINC000853738590	EF	On-Demand	Clean	MTNR1A	80	46
COc1ccc(O)c(CNC(=O)NCc2cccc(OC)c2C)c1	ZINC000853738590	EF	On-Demand	Clean	MTNR1B	71	46
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCc3c(C)cccc32)c1	ZINC000853738591	EH	On-Demand	Clean	DRD4	41	32
COc1ccc(O)c(CNC(=O)N[C@@H]2CCCc3c(C)cccc32)c1	ZINC000853738591	EH	On-Demand	Clean	MTNR1A	41	39
COc1ccc(O)c(CNC(=O)N[C@H]2CCCc3c(C)cccc32)c1	ZINC000853738592	EH	On-Demand	Clean	DRD4	41	32
COc1ccc(O)c(CNC(=O)N[C@H]2CCCc3c(C)cccc32)c1	ZINC000853738592	EH	On-Demand	Clean	MTNR1A	41	39
Cn1nc(C2CC2)nc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738595	DE	On-Demand	Anodyne	PANC	58	38
C[C@@H](CCNC(=O)NCCOc1cccnc1)N(C)C	ZINC000853738607	CD	On-Demand	Anodyne	PTAFR	17	42
O=C(NCCOc1cccnc1)N1CCCC[C@H]1CC1CCC1	ZINC000853738613	DG	On-Demand	Anodyne	FKBP1A	22	41
O=C(NCCOc1cccnc1)N1CCCC[C@H]1CC1CCC1	ZINC000853738613	DG	On-Demand	Anodyne	CHRNA7	22	41
O=C(NCCOc1cccnc1)N1CCCC[C@H]1CC1CCC1	ZINC000853738613	DG	On-Demand	Anodyne	CPT1A	57	38
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1CC1CCC1	ZINC000853738614	DG	On-Demand	Anodyne	FKBP1A	22	41
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1CC1CCC1	ZINC000853738614	DG	On-Demand	Anodyne	CHRNA7	22	41
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1CC1CCC1	ZINC000853738614	DG	On-Demand	Anodyne	CPT1A	57	38
O=C(NCCOc1cccnc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853738615	GF	On-Demand	Anodyne	CPT1A	65	39
CC(=O)Nc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738621	FF	On-Demand	Anodyne	PDGFRB	26	44
CC(=O)Nc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738621	FF	On-Demand	Anodyne	HDAC10	16	42
CC(=O)Nc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738621	FF	On-Demand	Anodyne	HDAC3	18	41
CC(=O)Nc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738621	FF	On-Demand	Anodyne	FLT4	24	44
CC(=O)Nc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738621	FF	On-Demand	Anodyne	PANC	52	34
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	PDGFRB	27	43
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	HDAC10	21	41
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	HDAC3	22	41
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	HDAC6	17	42
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	CCKBR	41	39
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	FLT4	28	43
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	FLT3	15	42
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	PANC	52	34
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	KCNK3	51	36
Cc1cccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738623	EG	On-Demand	Anodyne	KCNK9	41	35
CSc1ccc(OCCn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738626	EI	On-Demand	Anodyne	PANC	46	33
CCOc1ccccc1OCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738649	EH	On-Demand	Anodyne	PANC	54	36
CCOc1ccccc1OCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738649	EH	On-Demand	Anodyne	HCN1	47	33
CO[C@@H](C)c1noc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738652	DE	On-Demand	Anodyne	PANC	57	38
C=CCCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738676	CG	On-Demand	Mild	PANC	50	34
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)c(C)c1	ZINC000853738680	EG	On-Demand	Anodyne	PANC	46	33
CC[C@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccc(Cl)cc1	ZINC000853738698	GI	On-Demand	Anodyne	PANC	42	38
CC[C@@H](NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1)c1ccc(Cl)cc1	ZINC000853738699	GI	On-Demand	Anodyne	PANC	42	38
CC(=O)Nc1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738701	EG	On-Demand	Anodyne	ITK	16	43
CC(=O)Nc1cccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)c1	ZINC000853738701	EG	On-Demand	Anodyne	PANC	62	42
COCCc1noc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738702	DD	On-Demand	Anodyne	PANC	61	40
COc1ccccc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738710	DG	On-Demand	Anodyne	PANC	64	45
O=C(NCCOc1cccnc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853738716	GF	On-Demand	Anodyne	CPT1A	65	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(NC(=O)OC(C)(C)C)cn2)CC1	ZINC000853738717	GE	On-Demand	Anodyne	P2RY12	50	40
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(NC(=O)OC(C)(C)C)cn2)CC1	ZINC000853738718	GE	On-Demand	Anodyne	P2RY12	50	40
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	DRD4	27	55
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	SIGMAR1	20	49
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	SSTR5	34	40
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	CCR3	21	43
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	UTS2R	24	47
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	MLNR	30	42
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	CCR2	32	51
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	SLC6A5	39	46
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2ccc(C(F)(F)F)cc2)C1	ZINC000853738731	GF	On-Demand	Anodyne	MCHR1	58	44
CO[C@]1(c2nnc(Cn3cc(NC(=O)OC(C)(C)C)cn3)o2)CCOC1	ZINC000853738734	FD	On-Demand	Anodyne	PANC	51	34
O=c1c2c(ncn1CCCCCCO)[nH]c1cc(F)ccc12	ZINC000853738758	DF	On-Demand	Anodyne	MAP2K1	20	40
COc1ccc(O)c(CNC(=O)NCC2(C(=O)OC(C)(C)C)CCC2)c1	ZINC000853738761	FF	On-Demand	Clean	MTNR1A	41	42
COc1ccc(O)c(CNC(=O)NCC2(C(=O)OC(C)(C)C)CCC2)c1	ZINC000853738761	FF	On-Demand	Clean	MTNR1B	28	42
COc1ccc(O)c(CNC(=O)NCCCc2ccco2)c1	ZINC000853738767	DE	On-Demand	Clean	NQO2	28	42
COc1ccc(O)c(CNC(=O)NCCCc2ccco2)c1	ZINC000853738767	DE	On-Demand	Clean	MTNR1A	71	55
COc1ccc(O)c(CNC(=O)NCCCc2ccco2)c1	ZINC000853738767	DE	On-Demand	Clean	MTNR1B	59	55
CO[C@@H](Cn1cc(NC(=O)OC(C)(C)C)cn1)C1CCCC1	ZINC000853738779	DG	On-Demand	Anodyne	PANC	57	38
O=C(NCCOc1cccnc1)N(CCC1CC1)CC1CC1	ZINC000853738787	DF	On-Demand	Anodyne	GRIN2B	16	40
CC[C@@H](CC(F)F)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738788	DH	On-Demand	Anodyne	PANC	41	32
O=C(NCCOc1cccnc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853738790	DD	On-Demand	Anodyne	CPT1A	116	42
O=C(NCCOc1cccnc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853738791	DD	On-Demand	Anodyne	CPT1A	116	42
CC(C)(C)OC(=O)N1CC[C@H](CCn2cc(C3CC3)nn2)C1	ZINC000853738812	DF	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc(C3CC3)nn2)C1	ZINC000853738813	DF	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CCC(Cn2cc(C3CC3)nn2)CC1	ZINC000853738815	DF	On-Demand	Anodyne	GPR119	49	51
CO[C@@H](Cc1ccccc1)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738816	EG	On-Demand	Anodyne	PGC	46	33
CO[C@@H](Cc1ccccc1)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738816	EG	On-Demand	Anodyne	PAPA1_CARPA	39	44
CO[C@@H](Cc1ccccc1)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738816	EG	On-Demand	Anodyne	CTSL	17	44
CO[C@@H](Cc1ccccc1)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738816	EG	On-Demand	Anodyne	FPR1	46	37
CO[C@@H](Cc1ccccc1)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738816	EG	On-Demand	Anodyne	PANC	55	39
CC(C)(C)NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738824	CE	On-Demand	Anodyne	PANC	53	36
C#CCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738825	CC	On-Demand	Mild	PANC	51	34
Cc1ccccc1CNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738826	EF	On-Demand	Anodyne	PANC	57	48
Cc1ccc([C@H](C)NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1C	ZINC000853738827	FH	On-Demand	Anodyne	PANC	41	32
COC(=O)C1CCN(C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)CC1	ZINC000853738832	FD	On-Demand	Anodyne	PTR1	45	35
COC(=O)C1CCN(C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)CC1	ZINC000853738832	FD	On-Demand	Anodyne	PANC	54	35
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1F	ZINC000853738834	EG	On-Demand	Anodyne	PANC	51	35
CCc1noc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738839	CE	On-Demand	Anodyne	PANC	60	40
CN(Cc1ccc(F)cc1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738843	FG	On-Demand	Anodyne	PLA2G7	98	41
CN(Cc1ccc(F)cc1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738843	FG	On-Demand	Anodyne	PANC	57	43
CCN(Cc1cccc(F)c1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738845	GG	On-Demand	Anodyne	PANC	49	34
COc1ccccc1[C@H](C)NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738854	FG	On-Demand	Anodyne	PDGFRB	26	40
COc1ccccc1[C@H](C)NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738854	FG	On-Demand	Anodyne	FLT4	23	40
COc1ccccc1[C@H](C)NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738854	FG	On-Demand	Anodyne	PANC	52	35
CCCCCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738858	DF	On-Demand	Anodyne	ASAH1	84	34
CCCCCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738858	DF	On-Demand	Anodyne	PANC	50	33
CC(=O)c1ccccc1OCCn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738864	EH	On-Demand	Anodyne	PANC	56	38
COC(=O)c1oc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1C	ZINC000853738877	EF	On-Demand	Anodyne	PANC	55	38
C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738887	GI	On-Demand	Anodyne	PANC	59	42
CCc1ccc([C@H](C)NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738896	FH	On-Demand	Anodyne	PANC	51	37
COc1ccccc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738899	EF	On-Demand	Anodyne	PDGFRB	28	42
COc1ccccc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738899	EF	On-Demand	Anodyne	FLT4	24	42
COc1ccccc1NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738899	EF	On-Demand	Anodyne	PANC	55	36
CCCCNC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738904	CE	On-Demand	Anodyne	PANC	50	34
COC(=O)c1cc(F)ccc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738906	EG	On-Demand	Anodyne	PANC	60	47
Cn1ncnc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738911	CD	On-Demand	Anodyne	PANC	54	36
CO[C@@H](C)c1nc(Cn2cc(NC(=O)OC(C)(C)C)cn2)cs1	ZINC000853738913	EG	On-Demand	Anodyne	PANC	51	34
Cc1oc(-c2ccccc2)nc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738921	FI	On-Demand	Anodyne	PPARG	77	46
Cc1oc(-c2ccccc2)nc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738921	FI	On-Demand	Anodyne	PPARA	84	46
Cc1oc(-c2ccccc2)nc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738921	FI	On-Demand	Anodyne	PDE8B	70	41
Cc1oc(-c2ccccc2)nc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738921	FI	On-Demand	Anodyne	PANC	58	40
CC[C@H](C)NC(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738952	CE	On-Demand	Anodyne	PANC	46	33
CC(C)c1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738956	FH	On-Demand	Anodyne	PDGFRB	22	40
CC(C)c1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738956	FH	On-Demand	Anodyne	FLT4	20	40
CC(C)c1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1	ZINC000853738956	FH	On-Demand	Anodyne	PANC	51	34
COc1ccc(CN(C)C(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1F	ZINC000853738964	GG	On-Demand	Anodyne	PANC	47	35
COc1ccc(C)cc1Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853738971	DH	On-Demand	Anodyne	PANC	56	38
CC(C)n1ccc(Cn2cc(NC(=O)OC(C)(C)C)cn2)n1	ZINC000853738974	DG	On-Demand	Anodyne	PANC	55	37
C[C@@H](c1ccc(F)cc1)N(C)C(=O)Cn1cc(NC(=O)OC(C)(C)C)cn1	ZINC000853739001	GH	On-Demand	Anodyne	PANC	47	38
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1C	ZINC000853739003	EG	On-Demand	Anodyne	PDGFRB	27	40
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1C	ZINC000853739003	EG	On-Demand	Anodyne	FLT4	23	40
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1C	ZINC000853739003	EG	On-Demand	Anodyne	PANC	51	34
Cc1ccc(NC(=O)Cn2cc(NC(=O)OC(C)(C)C)cn2)cc1Cl	ZINC000853739007	FH	On-Demand	Anodyne	PANC	51	34
O=S(=O)(c1ccc(COc2ccc(OC3CC3)cc2)cc1)C(F)F	ZINC000853739025	FH	On-Demand	Anodyne	MMP13	17	43
O=S(=O)(c1ccc(COc2ccc(OC3CC3)cc2)cc1)C(F)F	ZINC000853739025	FH	On-Demand	Anodyne	ADAM17	20	40
O=S(=O)(c1ccc(COc2ccc(OC3CC3)cc2)cc1)C(F)F	ZINC000853739025	FH	On-Demand	Anodyne	MMP14	15	43
C[C@@H](NC(=O)N1CCn2c(O)nnc2C1)c1nc2ccccc2s1	ZINC000853739026	ED	On-Demand	Anodyne	ST14	45	32
C[C@@H](NC(=O)N1CCn2c(O)nnc2C1)c1nc2ccccc2s1	ZINC000853739026	ED	On-Demand	Anodyne	TMPRSS6	58	32
C#CCOc1ccccc1CNC(=O)N(CC)[C@H]1CCN(C)C1	ZINC000853739033	DD	On-Demand	Mild	CCR5	16	45
C#CCOc1ccccc1CNC(=O)N(CC)[C@H]1CCN(C)C1	ZINC000853739033	DD	On-Demand	Mild	MBTPS1	43	31
C#CCOc1ccccc1CNC(=O)N(CC)[C@@H]1CCN(C)C1	ZINC000853739034	DD	On-Demand	Mild	CCR5	16	45
C#CCOc1ccccc1CNC(=O)N(CC)[C@@H]1CCN(C)C1	ZINC000853739034	DD	On-Demand	Mild	MBTPS1	43	31
CS(=O)(=O)c1cccc(NC(=O)COc2ccc(OC3CC3)cc2)c1	ZINC000853739046	FF	On-Demand	Anodyne	EPHX2	25	41
CS(=O)(=O)c1cccc(NC(=O)COc2ccc(OC3CC3)cc2)c1	ZINC000853739046	FF	On-Demand	Anodyne	HIF1A	18	45
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC3CC3)cc2)CC1	ZINC000853739091	FE	On-Demand	Anodyne	P2RY12	95	42
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC3CC3)cc2)CC1	ZINC000853739091	FE	On-Demand	Anodyne	PRSS2	57	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC3CC3)cc2)CC1	ZINC000853739092	FE	On-Demand	Anodyne	P2RY12	95	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC3CC3)cc2)CC1	ZINC000853739092	FE	On-Demand	Anodyne	PRSS2	57	34
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](C)O)c1nc2ccccc2s1	ZINC000853739102	DF	On-Demand	Anodyne	TRY1_BOVIN	45	42
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](C)O)c1nc2ccccc2s1	ZINC000853739102	DF	On-Demand	Anodyne	UL80	20	40
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](C)O)c1nc2ccccc2s1	ZINC000853739102	DF	On-Demand	Anodyne	TPSAB1	16	42
C[C@H]1CN(c2ccc(NC(=O)COc3ccc(OC4CC4)cc3)cc2)C[C@@H](C)O1	ZINC000853739112	GH	On-Demand	Anodyne	MCHR1	19	41
C[C@H]1CN(c2ccc(NC(=O)COc3ccc(OC4CC4)cc3)cc2)C[C@H](C)O1	ZINC000853739114	GH	On-Demand	Anodyne	MCHR1	19	41
COC(=O)CCCOc1ccc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853739115	GF	On-Demand	Anodyne	LTA4H	22	43
COC(=O)CCCOc1ccc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853739116	GF	On-Demand	Anodyne	LTA4H	22	43
COC(=O)CCCOc1ccc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853739117	GF	On-Demand	Anodyne	LTA4H	22	43
COC(=O)CCCOc1ccc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853739118	GF	On-Demand	Anodyne	LTA4H	22	43
CCN1CC[C@H](N(CC)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000853739132	EG	On-Demand	Anodyne	CCR5	36	42
CCN1CC[C@H](N(CC)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000853739133	EG	On-Demand	Anodyne	CCR5	36	42
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](C)c2nc3ccccc3s2)C1	ZINC000853739134	EG	On-Demand	Anodyne	CCR5	36	42
CCN1CC[C@@H](N(CC)C(=O)N[C@H](C)c2nc3ccccc3s2)C1	ZINC000853739135	EG	On-Demand	Anodyne	CCR5	36	42
O=[N+]([O-])c1cc(OCCCCCCO)cc([N+](=O)[O-])c1	ZINC000853739140	CE	On-Demand	Bother	ACR	32	51
C[C@@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)c1nc2ccccc2s1	ZINC000853739159	FI	On-Demand	Anodyne	EPHX2	17	41
C#CCOc1ccccc1CNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1	ZINC000853739170	GE	On-Demand	Mild	CPT1A	106	37
C#CCOc1ccccc1CNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1	ZINC000853739171	GE	On-Demand	Mild	CPT1A	106	37
C[C@@H](CNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853739222	FF	On-Demand	Anodyne	BIRC2	31	42
C[C@@H](CNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853739222	FF	On-Demand	Anodyne	GPR119	38	44
C[C@@H](CNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853739222	FF	On-Demand	Anodyne	WNT3	41	34
C#CCOc1ccccc1CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853739241	FG	On-Demand	Mild	EPHX2	26	55
C#CCOc1ccccc1CNC(=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853739265	DD	On-Demand	Mild	EPHX2	18	46
C#CCOc1ccccc1CNC(=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853739266	DD	On-Demand	Mild	EPHX2	18	46
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853739267	EF	On-Demand	Anodyne	GPR119	17	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853739268	EF	On-Demand	Anodyne	GPR119	17	40
C[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1nc2ccccc2s1	ZINC000853739316	GG	On-Demand	Anodyne	L3MBTL3	56	35
C[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1nc2ccccc2s1	ZINC000853739318	GG	On-Demand	Anodyne	L3MBTL3	56	35
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853739331	EE	On-Demand	Mild	DRD2	40	49
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853739331	EE	On-Demand	Mild	SLC6A1	40	32
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853739331	EE	On-Demand	Mild	SIGMAR1	15	50
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853739331	EE	On-Demand	Mild	PREP	40	35
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853739331	EE	On-Demand	Mild	ACKR3	66	33
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853739332	EE	On-Demand	Mild	DRD2	40	49
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853739332	EE	On-Demand	Mild	SLC6A1	40	32
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853739332	EE	On-Demand	Mild	SIGMAR1	15	50
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853739332	EE	On-Demand	Mild	PREP	40	35
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853739332	EE	On-Demand	Mild	ACKR3	66	33
C#CCOc1ccccc1CNC(=O)N1CCCC[C@H]1c1n[nH]c(C(C)C)n1	ZINC000853739343	GG	On-Demand	Mild	CPT1A	89	37
C#CCOc1ccccc1CNC(=O)N1CCCC[C@@H]1c1n[nH]c(C(C)C)n1	ZINC000853739344	GG	On-Demand	Mild	CPT1A	89	37
COCCS(=O)(=O)CCCOc1ccc(OC2CC2)cc1	ZINC000853739347	DE	On-Demand	Anodyne	PLA2G4B	43	31
C#CCN1CCN(C(=O)COc2ccc(OC3CC3)cc2)CC1	ZINC000853739360	DD	On-Demand	Mild	HTR1D	15	40
C#CCN1CCN(C(=O)COc2ccc(OC3CC3)cc2)CC1	ZINC000853739360	DD	On-Demand	Mild	HTR1B	17	40
C#CCN1CCN(C(=O)COc2ccc(OC3CC3)cc2)CC1	ZINC000853739360	DD	On-Demand	Mild	CPT1A	49	38
C#CCN1CCN(C(=O)COc2ccc(OC3CC3)cc2)CC1	ZINC000853739360	DD	On-Demand	Mild	CPT2	42	38
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853739361	FD	On-Demand	Anodyne	DRD2	37	46
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853739362	FD	On-Demand	Anodyne	DRD2	37	46
COC[C@@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739378	GI	On-Demand	Anodyne	CSNK1D	23	40
COC[C@@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739378	GI	On-Demand	Anodyne	ROCK1	21	45
COC[C@@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739378	GI	On-Demand	Anodyne	TACR3	25	44
COC[C@@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739378	GI	On-Demand	Anodyne	ROCK2	16	45
COC[C@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739380	GI	On-Demand	Anodyne	CSNK1D	23	40
COC[C@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739380	GI	On-Demand	Anodyne	ROCK1	21	45
COC[C@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739380	GI	On-Demand	Anodyne	TACR3	25	44
COC[C@H](NC(=O)N[C@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739380	GI	On-Demand	Anodyne	ROCK2	16	45
COC[C@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739382	GI	On-Demand	Anodyne	CSNK1D	23	40
COC[C@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739382	GI	On-Demand	Anodyne	ROCK1	21	45
COC[C@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739382	GI	On-Demand	Anodyne	TACR3	25	44
COC[C@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739382	GI	On-Demand	Anodyne	ROCK2	16	45
COC[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739384	GI	On-Demand	Anodyne	CSNK1D	23	40
COC[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739384	GI	On-Demand	Anodyne	ROCK1	21	45
COC[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739384	GI	On-Demand	Anodyne	TACR3	25	44
COC[C@@H](NC(=O)N[C@@H](C)c1nc2ccccc2s1)c1cccc(OC)c1	ZINC000853739384	GI	On-Demand	Anodyne	ROCK2	16	45
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853739390	FG	On-Demand	Anodyne	MAPKAPK5	40	33
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853739390	FG	On-Demand	Anodyne	MTOR	62	37
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853739390	FG	On-Demand	Anodyne	EPHX2	44	44
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853739390	FG	On-Demand	Anodyne	MCHR1	21	51
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853739390	FG	On-Demand	Anodyne	MCHR2	23	40
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853739390	FG	On-Demand	Anodyne	STAT6	54	35
C[C@@H](NC(=O)N1CC(S(C)(=O)=O)C1)c1nc2ccccc2s1	ZINC000853739443	ED	On-Demand	Anodyne	ST14	41	32
C[C@@H](NC(=O)N1CC(S(C)(=O)=O)C1)c1nc2ccccc2s1	ZINC000853739443	ED	On-Demand	Anodyne	TMPRSS6	53	32
O=C(NCCc1nc(-c2cccc(Cl)c2)no1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853739450	GG	On-Demand	Anodyne	GRM5	18	43
O=C(NCCc1nc(-c2cccc(Cl)c2)no1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853739452	GG	On-Demand	Anodyne	GRM5	18	43
O=C(NCCc1nc(-c2cccc(Cl)c2)no1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853739454	GG	On-Demand	Anodyne	GRM5	18	43
O=C(NCCc1nc(-c2cccc(Cl)c2)no1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853739456	GG	On-Demand	Anodyne	GRM5	18	43
C[C@@H](NC(=O)N(CCN1CCOCC1)CC1CC1)c1nc2ccccc2s1	ZINC000853739518	GG	On-Demand	Anodyne	CASR	63	53
C#CCOc1ccccc1CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853739523	GE	On-Demand	Mild	SIGMAR1	24	43
C#CCOc1ccccc1CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853739523	GE	On-Demand	Mild	MCHR1	15	44
C#CCOc1ccccc1CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853739524	GE	On-Demand	Mild	SIGMAR1	24	43
C#CCOc1ccccc1CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853739524	GE	On-Demand	Mild	MCHR1	15	44
C[C@@H](NC(=O)N1C[C@@H]2CCCC[C@@H]21)c1nc2ccccc2s1	ZINC000853739533	DH	On-Demand	Anodyne	TRY1_BOVIN	41	38
C[C@@H](NC(=O)N1C[C@@H]2CCCC[C@@H]21)c1nc2ccccc2s1	ZINC000853739533	DH	On-Demand	Anodyne	TMPRSS6	46	32
C[C@H](NC(=O)N1C[C@@H]2CCCC[C@@H]21)c1nc2ccccc2s1	ZINC000853739534	DH	On-Demand	Anodyne	TRY1_BOVIN	41	38
C[C@H](NC(=O)N1C[C@@H]2CCCC[C@@H]21)c1nc2ccccc2s1	ZINC000853739534	DH	On-Demand	Anodyne	TMPRSS6	46	32
C#CCOc1ccccc1CNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853739537	FE	On-Demand	Mild	L3MBTL3	70	38
C#CCOc1ccccc1CNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853739538	FE	On-Demand	Mild	L3MBTL3	70	38
O=[N+]([O-])c1cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cc([N+](=O)[O-])c1	ZINC000853739549	GG	On-Demand	Bother	DRD4	27	61
O=[N+]([O-])c1cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cc([N+](=O)[O-])c1	ZINC000853739549	GG	On-Demand	Bother	SIGMAR1	22	51
O=[N+]([O-])c1cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cc([N+](=O)[O-])c1	ZINC000853739550	GG	On-Demand	Bother	DRD4	27	61
O=[N+]([O-])c1cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cc([N+](=O)[O-])c1	ZINC000853739550	GG	On-Demand	Bother	SIGMAR1	22	51
COCc1n[nH]c(CNC(=O)N[C@H](C)c2nc3ccccc3s2)n1	ZINC000853739555	EE	On-Demand	Anodyne	TMPRSS6	44	32
COCc1n[nH]c(CNC(=O)N[C@@H](C)c2nc3ccccc3s2)n1	ZINC000853739556	EE	On-Demand	Anodyne	TMPRSS6	44	32
CON(C)CCNC(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000853739558	DE	On-Demand	Anodyne	TMPRSS6	51	34
CON(C)CCNC(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000853739559	DE	On-Demand	Anodyne	TMPRSS6	51	34
C[C@H](NC(=O)NCCCc1nc[nH]n1)c1nc2ccccc2s1	ZINC000853739601	EE	On-Demand	Anodyne	ST14	50	38
C[C@H](NC(=O)NCCCc1nc[nH]n1)c1nc2ccccc2s1	ZINC000853739601	EE	On-Demand	Anodyne	TMPRSS6	79	38
C[C@@H](NC(=O)NCCCc1nc[nH]n1)c1nc2ccccc2s1	ZINC000853739603	EE	On-Demand	Anodyne	ST14	50	38
C[C@@H](NC(=O)NCCCc1nc[nH]n1)c1nc2ccccc2s1	ZINC000853739603	EE	On-Demand	Anodyne	TMPRSS6	79	38
C#CCOc1ccccc1CNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853739713	EE	On-Demand	Mild	CPT1A	94	37
C#CCOc1ccccc1CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853739714	EE	On-Demand	Mild	CPT1A	94	37
COC(=O)N(C)CCNC(=O)NCCc1ccc(O)c(OC)c1	ZINC000853739717	EC	On-Demand	Anodyne	MTNR1A	18	54
COC(=O)N(C)CCNC(=O)NCCc1ccc(O)c(OC)c1	ZINC000853739717	EC	On-Demand	Anodyne	NCE103	17	48
C[C@@H](NC(=O)NCCc1nnc(S)n1C)c1nc2ccccc2s1	ZINC000853739747	FE	On-Demand	Anodyne	TMPRSS6	55	33
C[C@H](NC(=O)NC/C=C\CO)c1nc2ccccc2s1	ZINC000853739767	CE	On-Demand	Anodyne	TMPRSS6	55	33
C[C@@H](NC(=O)NC/C=C/CO)c1nc2ccccc2s1	ZINC000853739768	CE	On-Demand	Anodyne	TMPRSS6	55	33
C[C@@H](NC(=O)NC/C=C\CO)c1nc2ccccc2s1	ZINC000853739769	CE	On-Demand	Anodyne	TMPRSS6	55	33
C[C@H](NC(=O)NC/C=C/CO)c1nc2ccccc2s1	ZINC000853739770	CE	On-Demand	Anodyne	TMPRSS6	55	33
CC[C@@H](O)CNC(=O)N[C@H](C)c1nc2ccccc2s1	ZINC000853739771	CE	On-Demand	Anodyne	TMPRSS6	45	34
CC[C@@H](O)CNC(=O)N[C@@H](C)c1nc2ccccc2s1	ZINC000853739772	CE	On-Demand	Anodyne	TMPRSS6	45	34
O[C@H](CCOc1ccc(OC2CC2)cc1)c1ccccc1	ZINC000853739781	CH	On-Demand	Anodyne	LTA4H	43	38
O[C@@H](CCOc1ccc(OC2CC2)cc1)c1ccccc1	ZINC000853739782	CH	On-Demand	Anodyne	LTA4H	43	38
C#CCOc1ccccc1CNC(=O)N(CC)[C@H]1CCN(CC)C1	ZINC000853739790	EE	On-Demand	Mild	CCR5	26	46
C#CCOc1ccccc1CNC(=O)N(CC)[C@@H]1CCN(CC)C1	ZINC000853739791	EE	On-Demand	Mild	CCR5	26	46
C#CCOc1ccccc1CNC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853739801	FD	On-Demand	Mild	CASR	51	37
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853739808	FH	On-Demand	Anodyne	PRNP	44	32
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853739808	FH	On-Demand	Anodyne	MCHR1	25	46
O=C(COc1ccc(OC2CC2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853739808	FH	On-Demand	Anodyne	MCHR2	24	43
O=C(NCc1ccc2ccccc2n1)N1CCC(N2CCOC2=O)CC1	ZINC000853739818	FE	On-Demand	Anodyne	SMO	48	44
O=[N+]([O-])c1ccc2nc(SC3CCC4(CC3)OCCO4)[nH]c2c1	ZINC000853739827	EG	On-Demand	Bother	TXN	21	56
C[C@@H]1CCN(C(=O)NCc2ccc3ccccc3n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853739882	GF	On-Demand	Anodyne	SMO	40	40
COC(=O)N(C)CCNC(=O)NCc1ccc2ccccc2n1	ZINC000853739884	DD	On-Demand	Anodyne	CYSLTR1	39	41
COc1nc(C)cc(NCCN(C)OC)n1	ZINC000853739890	BC	On-Demand	Anodyne	PTGDR	29	40
C[C@H](NC(=O)NCCN1C[C@@H](C)OC[C@H]1C)c1nc2ccccc2s1	ZINC000853739914	FF	On-Demand	Anodyne	ST14	46	33
C[C@H](NC(=O)NCCN1C[C@@H](C)OC[C@H]1C)c1nc2ccccc2s1	ZINC000853739914	FF	On-Demand	Anodyne	TMPRSS6	64	33
C[C@@H]1CN(CCNC(=O)N[C@H](C)c2nc3ccccc3s2)[C@H](C)CO1	ZINC000853739915	FF	On-Demand	Anodyne	ST14	46	33
C[C@@H]1CN(CCNC(=O)N[C@H](C)c2nc3ccccc3s2)[C@H](C)CO1	ZINC000853739915	FF	On-Demand	Anodyne	TMPRSS6	64	33
C[C@H](NC(=O)NCCN1C[C@@H](C)OC[C@@H]1C)c1nc2ccccc2s1	ZINC000853739916	FF	On-Demand	Anodyne	ST14	46	33
C[C@H](NC(=O)NCCN1C[C@@H](C)OC[C@@H]1C)c1nc2ccccc2s1	ZINC000853739916	FF	On-Demand	Anodyne	TMPRSS6	64	33
C#CCOc1ccccc1CNC(=O)N1CCC(c2nnc(O)n2CC)CC1	ZINC000853739919	GE	On-Demand	Mild	EPHX2	16	48
C[C@H](NC(=O)NCCN(C)CCCN(C)C)c1nc2ccccc2s1	ZINC000853739931	FF	On-Demand	Anodyne	TMPRSS6	56	35
C[C@@H](NC(=O)NCCN(C)CCCN(C)C)c1nc2ccccc2s1	ZINC000853739932	FF	On-Demand	Anodyne	TMPRSS6	56	35
C#CCOc1ccccc1CNC(=O)N[C@H](c1ccccc1)[C@@H](C)O	ZINC000853739943	EF	On-Demand	Mild	ANPEP	15	44
C#CCOc1ccccc1CNC(=O)N[C@@H](c1ccccc1)[C@@H](C)O	ZINC000853739944	EF	On-Demand	Mild	ANPEP	15	44
C#CCOc1ccccc1CNC(=O)N[C@@H](c1ccccc1)[C@H](C)O	ZINC000853739945	EF	On-Demand	Mild	ANPEP	15	44
C#CCOc1ccccc1CNC(=O)N[C@H](c1ccccc1)[C@H](C)O	ZINC000853739946	EF	On-Demand	Mild	ANPEP	15	44
CN(CCOc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000853739958	EG	On-Demand	Bother	ACHE	17	48
CN(CCOc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000853739958	EG	On-Demand	Bother	LTA4H	23	41
CN(CCOc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)Cc1ccccc1	ZINC000853739958	EG	On-Demand	Bother	SLC6A9	17	40
COc1cc(OCCCCCCO)ccc1Br	ZINC000853739996	DG	On-Demand	Anodyne	ALDH2	44	39
COc1cc(OCCCCCCO)ccc1Br	ZINC000853739996	DG	On-Demand	Anodyne	PLA2G4B	51	38
COc1cc(OCCCCCCO)ccc1Br	ZINC000853739996	DG	On-Demand	Anodyne	LSS	38	40
O=C(COc1ccc(OC2CC2)cc1)N1CCC2(CC1)OCCO2	ZINC000853740125	ED	On-Demand	Anodyne	PRSS2	46	32
O=[N+]([O-])c1cc(OCCCOCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000853740131	EG	On-Demand	Bother	ACR	25	43
O=[N+]([O-])c1cc(OCCCOCc2ccccc2)cc([N+](=O)[O-])c1	ZINC000853740131	EG	On-Demand	Bother	F2RL3	26	40
COC(=O)CCCOc1ccc(CNC(=O)NNc2ccc(C)c(F)c2)cc1	ZINC000853740132	GG	On-Demand	Reactive	LTA4H	16	41
COC(=O)CCCOc1ccc(CNC(=O)NNc2ccc(C)c(F)c2)cc1	ZINC000853740132	GG	On-Demand	Reactive	LEF	49	35
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853740134	GE	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853740135	GE	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853740136	GE	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853740137	GE	On-Demand	Anodyne	GPR119	32	41
C[C@@H](CNC(=O)N[C@H](C)c1nc2ccccc2s1)c1ccccn1	ZINC000853740144	EH	On-Demand	Anodyne	TMPRSS6	40	32
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853740153	GF	On-Demand	Anodyne	BIRC2	22	41
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853740154	GF	On-Demand	Anodyne	BIRC2	22	41
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853740155	GF	On-Demand	Anodyne	BIRC2	22	41
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853740156	GF	On-Demand	Anodyne	BIRC2	22	41
Cc1ccc(CC2CN(C(=O)N[C@@H](C)c3nc4ccccc4s3)C2)cc1	ZINC000853740161	FJ	On-Demand	Anodyne	TMPRSS6	44	31
Cc1ccc(CC2CN(C(=O)N[C@H](C)c3nc4ccccc4s3)C2)cc1	ZINC000853740162	FJ	On-Demand	Anodyne	TMPRSS6	44	31
COC(=O)Cn1cc(COc2ccc(OC3CC3)cc2)nn1	ZINC000853740177	DD	On-Demand	Anodyne	FIMH	15	40
OCc1cc(Br)cc(CO)c1OCc1nc2ccccc2s1	ZINC000853740192	GH	On-Demand	Anodyne	AKR1B1	23	41
COCCN(CCF)C(=O)NCCc1ccc(O)c(OC)c1	ZINC000853740209	DD	On-Demand	Anodyne	NCE103	15	47
O=C1NC2(CC(c3ccccc3)C2)C(=O)N1Cc1cncc(C(F)(F)F)c1	ZINC000853740215	GG	On-Demand	Anodyne	TACR1	45	38
c1nc(SC2CCC3(CC2)OCCO3)c2cc[nH]c2n1	ZINC000853740217	CF	On-Demand	Anodyne	AKT2	33	42
O=C(COc1c(CO)cc(Br)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853740259	II	On-Demand	Anodyne	HDAC6	15	45
O=C(COc1c(CO)cc(Br)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853740259	II	On-Demand	Anodyne	SLC1A1	18	42
O=C(COc1c(CO)cc(Br)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853740259	II	On-Demand	Anodyne	SLC1A2	32	42
c1ccc(-c2nnc3ccc(SC4CCC5(CC4)OCCO5)nn23)cc1	ZINC000853740272	FH	On-Demand	Anodyne	LRRK2	23	43
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)NC(C)(C)c2cccc(C#N)c2)C1	ZINC000853740335	GG	On-Demand	Mild	GPR119	24	40
CC(C)(C)OC(=O)N1CCC[C@@H](NC(=O)NC(C)(C)c2cccc(C#N)c2)C1	ZINC000853740336	GG	On-Demand	Mild	GPR119	24	40
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	ESR1	72	36
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	KCNH2	19	40
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	ESR2	52	41
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	LTA4H	49	66
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	HRH3	61	58
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	PSMB2	50	49
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	PSMB1	55	49
O=[N+]([O-])c1cc(OCCN2CCCCC2)cc([N+](=O)[O-])c1	ZINC000853740348	CE	On-Demand	Bother	KCNJ1	21	40
C[C@@H](CCNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853740368	EE	On-Demand	Anodyne	CHRNA3	21	43
C[C@@H](CCNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853740368	EE	On-Demand	Anodyne	CHRNA4	16	43
C[C@H](CCNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853740369	EE	On-Demand	Anodyne	CHRNA3	21	43
C[C@H](CCNC(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853740369	EE	On-Demand	Anodyne	CHRNA4	16	43
C[C@@H](CCNC(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853740370	EE	On-Demand	Anodyne	CHRNA3	21	43
C[C@@H](CCNC(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853740370	EE	On-Demand	Anodyne	CHRNA4	16	43
C[C@@H](CCNC(=O)N[C@H](C)c1nc2ccccc2s1)N(C)C	ZINC000853740382	DF	On-Demand	Anodyne	ST14	41	36
C[C@@H](CCNC(=O)N[C@H](C)c1nc2ccccc2s1)N(C)C	ZINC000853740382	DF	On-Demand	Anodyne	TMPRSS6	59	36
C[C@@H](NC(=O)NCC[C@@H](C)N(C)C)c1nc2ccccc2s1	ZINC000853740384	DF	On-Demand	Anodyne	ST14	41	36
C[C@@H](NC(=O)NCC[C@@H](C)N(C)C)c1nc2ccccc2s1	ZINC000853740384	DF	On-Demand	Anodyne	TMPRSS6	59	36
C#CCOc1ccccc1CNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853740404	GG	On-Demand	Mild	EPHX2	21	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccc2ccccc2n1	ZINC000853740484	GG	On-Demand	Clean	STAT6	18	41
C[C@@H](NC(=O)NCC1(O)CCC(F)(F)CC1)c1nc2ccccc2s1	ZINC000853740511	FH	On-Demand	Anodyne	TMPRSS6	46	34
C[C@H](NC(=O)NCC1(O)CCC(F)(F)CC1)c1nc2ccccc2s1	ZINC000853740513	FH	On-Demand	Anodyne	TMPRSS6	46	34
CON(C)CCNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853740546	DD	On-Demand	Anodyne	DRD2	46	52
CON(C)CCNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853740546	DD	On-Demand	Anodyne	LTA4H	18	44
CON(C)CCNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853740546	DD	On-Demand	Anodyne	SIGMAR1	29	53
CON(C)CCNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853740546	DD	On-Demand	Anodyne	MBTPS1	32	40
CON(C)CCNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000853740546	DD	On-Demand	Anodyne	ACKR3	57	33
CON(C)CCNC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853740550	DD	On-Demand	Anodyne	DRD2	46	52
CON(C)CCNC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853740550	DD	On-Demand	Anodyne	LTA4H	18	44
CON(C)CCNC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853740550	DD	On-Demand	Anodyne	SIGMAR1	29	53
CON(C)CCNC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853740550	DD	On-Demand	Anodyne	MBTPS1	32	40
CON(C)CCNC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000853740550	DD	On-Demand	Anodyne	ACKR3	57	33
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@H]32)C1	ZINC000853740557	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@H]2[C@@H]3c4ccc(F)cc4C[C@H]32)C1	ZINC000853740558	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853740559	GG	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CCC[C@H](NC(=O)N[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853740560	GG	On-Demand	Anodyne	GPR119	25	41
C[C@@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1nc2ccccc2s1	ZINC000853740573	FH	On-Demand	Anodyne	TMPRSS6	41	32
C[C@@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1nc2ccccc2s1	ZINC000853740577	FH	On-Demand	Anodyne	TMPRSS6	41	32
C[C@@H](NC(=O)NCCc1nnc(S)n1C1CC1)c1nc2ccccc2s1	ZINC000853740579	GG	On-Demand	Anodyne	TMPRSS6	44	32
C[C@@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1nc2ccccc2s1	ZINC000853740597	FG	On-Demand	Anodyne	CPT1A	92	37
C[C@@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1nc2ccccc2s1	ZINC000853740601	FG	On-Demand	Anodyne	CPT1A	92	37
COc1cccc(C2(NC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)CCC2)c1	ZINC000853740639	GG	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(NC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)CCC2)c1	ZINC000853740639	GG	On-Demand	Anodyne	SIGMAR1	15	43
COc1cccc(C2(NC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)CCC2)c1	ZINC000853740639	GG	On-Demand	Anodyne	CCR3	17	40
COc1cccc(C2(NC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)CCC2)c1	ZINC000853740639	GG	On-Demand	Anodyne	PDK1	41	36
COc1cccc(C2(NC(=O)NC3CCN(C[C@@H]4CCCO4)CC3)CCC2)c1	ZINC000853740639	GG	On-Demand	Anodyne	MCHR1	15	43
COc1cccc(C2(NC(=O)NC3CCN(C[C@H]4CCCO4)CC3)CCC2)c1	ZINC000853740640	GG	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(NC(=O)NC3CCN(C[C@H]4CCCO4)CC3)CCC2)c1	ZINC000853740640	GG	On-Demand	Anodyne	SIGMAR1	15	43
COc1cccc(C2(NC(=O)NC3CCN(C[C@H]4CCCO4)CC3)CCC2)c1	ZINC000853740640	GG	On-Demand	Anodyne	CCR3	17	40
COc1cccc(C2(NC(=O)NC3CCN(C[C@H]4CCCO4)CC3)CCC2)c1	ZINC000853740640	GG	On-Demand	Anodyne	PDK1	41	36
COc1cccc(C2(NC(=O)NC3CCN(C[C@H]4CCCO4)CC3)CCC2)c1	ZINC000853740640	GG	On-Demand	Anodyne	MCHR1	15	43
FC(F)(F)c1nc(N2CCC[C@@H](c3ccccn3)C2)c2ccccc2n1	ZINC000853740650	FI	On-Demand	Anodyne	METAP1	28	48
FC(F)(F)c1nc(N2CCC[C@H](c3ccccn3)C2)c2ccccc2n1	ZINC000853740653	FI	On-Demand	Anodyne	METAP1	28	48
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCC(c2ccon2)CC1	ZINC000853740668	FE	On-Demand	Anodyne	SMO	37	45
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCC(c2ccon2)CC1	ZINC000853740669	FE	On-Demand	Anodyne	SMO	37	45
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853740718	GD	On-Demand	Anodyne	CCR3	25	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853740719	GD	On-Demand	Anodyne	CCR3	25	40
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853740720	GD	On-Demand	Anodyne	CCR3	25	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853740721	GD	On-Demand	Anodyne	CCR3	25	40
CCn1c(=O)c(NCCN(C)OC)nc2ccccc21	ZINC000853740769	CD	On-Demand	Anodyne	PYGM	20	42
Nc1nc(Cl)cc(N2CCC[C@H](c3ccccn3)C2)n1	ZINC000853740786	CE	On-Demand	Anodyne	HRH4	51	44
Nc1nc(Cl)cc(N2CCC[C@@H](c3ccccn3)C2)n1	ZINC000853740787	CE	On-Demand	Anodyne	HRH4	51	44
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2ccc3ccccc3n2)C1	ZINC000853740807	GF	On-Demand	Anodyne	SMO	41	40
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2ccc3ccccc3n2)C1	ZINC000853740808	GF	On-Demand	Anodyne	SMO	41	40
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc4ccccc4n3)C2)cc1	ZINC000853740861	GG	On-Demand	Clean	ALOX5	26	40
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc4ccccc4n3)C2)cc1	ZINC000853740861	GG	On-Demand	Clean	ALOX5AP	45	39
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc4ccccc4n3)C2)cc1	ZINC000853740861	GG	On-Demand	Clean	MTNR1A	16	45
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc4ccccc4n3)C2)cc1	ZINC000853740861	GG	On-Demand	Clean	MTNR1B	15	45
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc4ccccc4n3)C2)cc1	ZINC000853740861	GG	On-Demand	Clean	MCHR1	17	51
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc4ccccc4n3)C2)cc1	ZINC000853740861	GG	On-Demand	Clean	NPBWR1	43	33
O=C(NCc1ccc2ccccc2n1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853740936	ED	On-Demand	Anodyne	SMO	50	42
O=C(NCc1ccc2ccccc2n1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853740937	ED	On-Demand	Anodyne	SMO	50	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853740943	FE	On-Demand	Anodyne	CCR3	35	43
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853740943	FE	On-Demand	Anodyne	EPHX2	41	44
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853740944	FE	On-Demand	Anodyne	CCR3	35	43
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853740944	FE	On-Demand	Anodyne	EPHX2	41	44
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853740961	FE	On-Demand	Anodyne	CCR3	20	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21	ZINC000853740962	FE	On-Demand	Anodyne	CCR3	20	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21	ZINC000853740963	FE	On-Demand	Anodyne	CCR3	20	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853740964	FE	On-Demand	Anodyne	CCR3	20	42
COC(=O)c1sc(N2CCC[C@H](c3ccccn3)C2)nc1Cl	ZINC000853740977	EG	On-Demand	Anodyne	PARE	78	42
COC(=O)c1sc(N2CCC[C@@H](c3ccccn3)C2)nc1Cl	ZINC000853740978	EG	On-Demand	Anodyne	PARE	78	42
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@H]1COc2cc(F)ccc2C1	ZINC000853740982	GE	On-Demand	Anodyne	CCR3	22	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@H]1COc2cc(F)ccc2C1	ZINC000853740983	GE	On-Demand	Anodyne	CCR3	22	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1COc2cc(F)ccc2C1	ZINC000853740984	GE	On-Demand	Anodyne	CCR3	22	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N[C@@H]1COc2cc(F)ccc2C1	ZINC000853740985	GE	On-Demand	Anodyne	CCR3	22	41
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853741177	FE	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853741179	FE	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853741181	FE	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853741183	FE	On-Demand	Anodyne	SIGMAR1	15	40
CN(c1ccccc1)[C@H]1CCN(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)C1	ZINC000853741333	GF	On-Demand	Anodyne	CCR8	40	33
CN(c1ccccc1)[C@H]1CCN(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)C1	ZINC000853741333	GF	On-Demand	Anodyne	SFRP1	56	35
CN(c1ccccc1)[C@H]1CCN(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)C1	ZINC000853741333	GF	On-Demand	Anodyne	WNT3	44	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)C1	ZINC000853741335	GF	On-Demand	Anodyne	CCR8	40	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)C1	ZINC000853741335	GF	On-Demand	Anodyne	SFRP1	56	35
CN(c1ccccc1)[C@@H]1CCN(C(=O)NC2CCN(C[C@H]3CCCO3)CC2)C1	ZINC000853741335	GF	On-Demand	Anodyne	WNT3	44	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)C1	ZINC000853741337	GF	On-Demand	Anodyne	CCR8	40	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)C1	ZINC000853741337	GF	On-Demand	Anodyne	SFRP1	56	35
CN(c1ccccc1)[C@@H]1CCN(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)C1	ZINC000853741337	GF	On-Demand	Anodyne	WNT3	44	33
CN(c1ccccc1)[C@H]1CCN(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)C1	ZINC000853741340	GF	On-Demand	Anodyne	CCR8	40	33
CN(c1ccccc1)[C@H]1CCN(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)C1	ZINC000853741340	GF	On-Demand	Anodyne	SFRP1	56	35
CN(c1ccccc1)[C@H]1CCN(C(=O)NC2CCN(C[C@@H]3CCCO3)CC2)C1	ZINC000853741340	GF	On-Demand	Anodyne	WNT3	44	33
O=C(NCCS(=O)(=O)CC(F)(F)F)NCc1ccc2ccccc2n1	ZINC000853741348	GE	On-Demand	Anodyne	CYSLTR1	33	40
CC(C)(C)OC(=O)NC1(CNC(=O)NCc2ccc3ccccc3n2)CCCC1	ZINC000853741386	GH	On-Demand	Anodyne	SMO	15	41
COc1cc(N2CCC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])cc1OC	ZINC000853741387	EG	On-Demand	Clean	PDE3A	20	42
COc1cc(N2CCC[C@H](c3ccccn3)C2)c([N+](=O)[O-])cc1OC	ZINC000853741390	EG	On-Demand	Clean	PDE3A	20	42
CC(C)(C)N1C[C@H](CNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)CC1=O	ZINC000853741494	GD	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)N1C[C@@H](CNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)CC1=O	ZINC000853741497	GD	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)N1C[C@H](CNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)CC1=O	ZINC000853741499	GD	On-Demand	Anodyne	CACNA1I	40	32
CC(C)(C)N1C[C@@H](CNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)CC1=O	ZINC000853741501	GD	On-Demand	Anodyne	CACNA1I	40	32
O=C(NCc1ccc2c(=O)cc[nH]c2c1)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000853741515	GD	On-Demand	Anodyne	MCHR1	19	42
O=C(NCc1ccc2c(=O)cc[nH]c2c1)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000853741517	GD	On-Demand	Anodyne	MCHR1	19	42
CON(C)CCNC(=O)NCc1ccc2ccccc2n1	ZINC000853741581	CD	On-Demand	Anodyne	ALOX5	16	40
CON(C)CCNC(=O)NCc1ccc2ccccc2n1	ZINC000853741581	CD	On-Demand	Anodyne	CYSLTR1	49	43
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)OCC(=O)NC3CCN(C4CC4)CC3)CC2)c(C)c1	ZINC000853741602	JE	On-Demand	Anodyne	EPHX2	39	56
C[C@@H](CNC(=O)NC1CCN(C[C@H]2CCCO2)CC1)c1ccccn1	ZINC000853741750	EE	On-Demand	Anodyne	EPHX2	16	42
C[C@@H](CNC(=O)NC1CCN(C[C@@H]2CCCO2)CC1)c1ccccn1	ZINC000853741752	EE	On-Demand	Anodyne	EPHX2	16	42
COC[C@H](NC(=O)NC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741807	GE	On-Demand	Anodyne	CCR3	18	40
COC[C@H](NC(=O)NC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741807	GE	On-Demand	Anodyne	MCHR1	17	41
COC[C@H](NC(=O)NC1CCN(C[C@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741808	GE	On-Demand	Anodyne	CCR3	18	40
COC[C@H](NC(=O)NC1CCN(C[C@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741808	GE	On-Demand	Anodyne	MCHR1	17	41
COC[C@@H](NC(=O)NC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741809	GE	On-Demand	Anodyne	CCR3	18	40
COC[C@@H](NC(=O)NC1CCN(C[C@@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741809	GE	On-Demand	Anodyne	MCHR1	17	41
COC[C@@H](NC(=O)NC1CCN(C[C@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741810	GE	On-Demand	Anodyne	CCR3	18	40
COC[C@@H](NC(=O)NC1CCN(C[C@H]2CCCO2)CC1)c1cccc(OC)c1	ZINC000853741810	GE	On-Demand	Anodyne	MCHR1	17	41
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853741817	FD	On-Demand	Anodyne	CPT1A	86	36
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853741818	FD	On-Demand	Anodyne	CPT1A	86	36
O=C(NC1CCN(C[C@H]2CCCO2)CC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853741819	FD	On-Demand	Anodyne	CPT1A	86	36
O=C(NC1CCN(C[C@@H]2CCCO2)CC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853741820	FD	On-Demand	Anodyne	CPT1A	86	36
COC(=O)c1cccc(NNC(=O)NC2CCN(C[C@@H]3CCCO3)CC2)c1C	ZINC000853741839	GE	On-Demand	Reactive	CCR8	49	32
COC(=O)c1cccc(NNC(=O)NC2CCN(C[C@H]3CCCO3)CC2)c1C	ZINC000853741840	GE	On-Demand	Reactive	CCR8	49	32
Cc1ccc(CC2CN(C(=O)NC3CCN(C[C@@H]4CCCO4)CC3)C2)cc1	ZINC000853741922	FF	On-Demand	Anodyne	CCR3	44	43
Cc1ccc(CC2CN(C(=O)NC3CCN(C[C@H]4CCCO4)CC3)C2)cc1	ZINC000853741923	FF	On-Demand	Anodyne	CCR3	44	43
O=C(NNC(=O)c1cccc(F)n1)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000853741958	GE	On-Demand	Reactive	TACR3	40	42
O=C(NNC(=O)c1cccc(F)n1)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000853741959	GE	On-Demand	Reactive	TACR3	40	42
C#CCCN(CCOC)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000853741999	FF	On-Demand	Mild	OPRK1	15	41
C#CCCN(CCOC)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000853742000	FF	On-Demand	Mild	OPRK1	15	41
COC(=O)c1cnc(N2CCC[C@@H](c3ccccn3)C2)cc1C(F)(F)F	ZINC000853742029	FH	On-Demand	Anodyne	RBP4	54	38
COC(=O)c1cnc(N2CCC[C@H](c3ccccn3)C2)cc1C(F)(F)F	ZINC000853742030	FH	On-Demand	Anodyne	RBP4	54	38
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000853742086	GF	On-Demand	Anodyne	DRD4	15	41
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000853742087	GF	On-Demand	Anodyne	DRD4	15	41
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000853742088	GF	On-Demand	Anodyne	DRD4	15	41
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000853742089	GF	On-Demand	Anodyne	DRD4	15	41
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)OCC(=O)NCC(=O)N3CCCC3)CC2)c(C)c1	ZINC000853742096	JD	On-Demand	Anodyne	EPHX2	33	56
COC(=O)N(C)CCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000853742121	FE	On-Demand	Anodyne	OPRK1	22	42
COC(=O)N(C)CCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000853742122	FE	On-Demand	Anodyne	OPRK1	22	42
COCCN(CCF)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000853742321	FF	On-Demand	Anodyne	OPRK1	20	42
COC(=O)c1cnc(N(C)[C@@H](CO)Cc2ccccc2)cc1C(F)(F)F	ZINC000853742563	FF	On-Demand	Anodyne	NR1H2	44	33
COC(=O)c1cnc(N(C)[C@H](CO)Cc2ccccc2)cc1C(F)(F)F	ZINC000853742564	FF	On-Demand	Anodyne	NR1H2	44	33
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@H](C)C(=O)N3CCC(C(N)=O)CC3)CC2)c(C)c1	ZINC000853742599	JD	On-Demand	Anodyne	EPHX2	27	50
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@@H](C)C(=O)N3CCC(C(N)=O)CC3)CC2)c(C)c1	ZINC000853742600	JD	On-Demand	Anodyne	EPHX2	27	50
C#CCN1CCN(C(=O)COc2cnc3c(OC)cccc3c2)CC1	ZINC000853742602	ED	On-Demand	Mild	HTR1A	19	45
C#CCN1CCN(C(=O)COc2cnc3c(OC)cccc3c2)CC1	ZINC000853742602	ED	On-Demand	Mild	HTR1B	15	45
O=C(NCc1ncccn1)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000853742651	EF	On-Demand	Anodyne	OPRK1	15	42
O=C(NCc1ncccn1)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000853742651	EF	On-Demand	Anodyne	TACR3	35	42
O=C(NCc1ncccn1)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000853742652	EF	On-Demand	Anodyne	OPRK1	15	42
O=C(NCc1ncccn1)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000853742652	EF	On-Demand	Anodyne	TACR3	35	42
CON(C)CCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000853742662	EE	On-Demand	Anodyne	OPRK1	26	44
CON(C)CCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000853742663	EE	On-Demand	Anodyne	OPRK1	26	44
O=[N+]([O-])c1ccc(N(CCOCCO)C2CCC2)c([N+](=O)[O-])c1	ZINC000853742826	ED	On-Demand	Bother	SLC27A4	43	32
CN(c1nccc(N2CCCC2)n1)[C@H](CO)Cc1ccccc1	ZINC000853742831	DE	On-Demand	Anodyne	SORD	105	39
CN(c1nccc(N2CCCC2)n1)[C@@H](CO)Cc1ccccc1	ZINC000853742832	DE	On-Demand	Anodyne	SORD	105	39
C#CCCCOc1cccc(OC(=O)NC)c1	ZINC000853742844	BE	On-Demand	Mild	ACHE	18	53
C#CCCCOc1cccc(OC(=O)NC)c1	ZINC000853742844	BE	On-Demand	Mild	BCHE	15	53
C#CCCCOc1cccc(OC(=O)NC)c1	ZINC000853742844	BE	On-Demand	Mild	MTNR1A	22	41
C#CCCCOc1cccc(OC(=O)NC)c1	ZINC000853742844	BE	On-Demand	Mild	MTNR1B	19	41
C#CCCCOc1cccc(OC(=O)NC)c1	ZINC000853742844	BE	On-Demand	Mild	FAAH	30	42
COCCCNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1	ZINC000853742878	JE	On-Demand	Anodyne	EPHX2	30	59
CC[C@H](C)NC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853742880	CD	On-Demand	Anodyne	FAAH	22	41
CC[C@H](C)NC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853742880	CD	On-Demand	Anodyne	PDS	70	37
COCCCNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1	ZINC000853742888	JE	On-Demand	Anodyne	EPHX2	30	59
CCc1ccc([C@H](C)NC(=O)COc2cccc(OC(=O)NC)c2)cc1	ZINC000853742939	FG	On-Demand	Anodyne	ACACA	23	43
CCc1ccc([C@H](C)NC(=O)COc2cccc(OC(=O)NC)c2)cc1	ZINC000853742939	FG	On-Demand	Anodyne	ACACB	23	44
CCc1ccc([C@H](C)NC(=O)COc2cccc(OC(=O)NC)c2)cc1	ZINC000853742939	FG	On-Demand	Anodyne	PDS	43	40
CN1CCC(N2CC[C@@H](NC(=O)NNc3cccc4c3OC(F)(F)O4)C2)CC1	ZINC000853742975	GD	On-Demand	Reactive	SLC6A5	20	44
CCOCCCOc1cccc(OC(=O)NC)c1	ZINC000853742990	CE	On-Demand	Anodyne	ACHE	20	54
CCOCCCOc1cccc(OC(=O)NC)c1	ZINC000853742990	CE	On-Demand	Anodyne	BCHE	18	54
CCOCCCOc1cccc(OC(=O)NC)c1	ZINC000853742990	CE	On-Demand	Anodyne	MTNR1A	31	42
CCOCCCOc1cccc(OC(=O)NC)c1	ZINC000853742990	CE	On-Demand	Anodyne	MTNR1B	26	42
CCOCCCOc1cccc(OC(=O)NC)c1	ZINC000853742990	CE	On-Demand	Anodyne	PLA2G4B	37	40
CCOCCCOc1cccc(OC(=O)NC)c1	ZINC000853742990	CE	On-Demand	Anodyne	FAAH	49	44
CCOCCCOc1cccc(OC(=O)NC)c1	ZINC000853742990	CE	On-Demand	Anodyne	PDS	56	34
CCSCCOc1cccc(OC(=O)NC)c1	ZINC000853742996	CF	On-Demand	Anodyne	ACHE	18	50
CCSCCOc1cccc(OC(=O)NC)c1	ZINC000853742996	CF	On-Demand	Anodyne	BCHE	15	50
CCSCCOc1cccc(OC(=O)NC)c1	ZINC000853742996	CF	On-Demand	Anodyne	MTNR1A	20	41
CCSCCOc1cccc(OC(=O)NC)c1	ZINC000853742996	CF	On-Demand	Anodyne	MTNR1B	18	41
CCSCCOc1cccc(OC(=O)NC)c1	ZINC000853742996	CF	On-Demand	Anodyne	PLA2G4B	32	40
CCSCCOc1cccc(OC(=O)NC)c1	ZINC000853742996	CF	On-Demand	Anodyne	FAAH	36	44
CCSCCOc1cccc(OC(=O)NC)c1	ZINC000853742996	CF	On-Demand	Anodyne	PDS	70	36
COc1cc(F)c([N+](=O)[O-])c(N(C)Cc2cnc[nH]2)c1	ZINC000853743013	CE	On-Demand	Bother	TAAR1	22	40
O=C(COc1c(F)cccc1OC(F)(F)F)Nc1ccc(N2CCCC2)cc1	ZINC000853743021	GI	On-Demand	Anodyne	P2RY1	44	38
O=C(COc1c(F)cccc1OC(F)(F)F)Nc1ccc(N2CCCC2)cc1	ZINC000853743021	GI	On-Demand	Anodyne	MCHR1	17	43
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@@H](C)C(=O)Nc3nc(C)c(C)s3)CC2)c(C)c1	ZINC000853743037	JH	On-Demand	Anodyne	EPHX2	27	49
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@H](C)C(=O)Nc3nc(C)c(C)s3)CC2)c(C)c1	ZINC000853743038	JH	On-Demand	Anodyne	EPHX2	27	49
CN(c1ccc([N+](=O)[O-])cc1F)[C@H](CO)Cc1ccccc1	ZINC000853743043	DF	On-Demand	Bother	F2RL3	46	36
CN(c1ccc([N+](=O)[O-])cc1F)[C@@H](CO)Cc1ccccc1	ZINC000853743044	DF	On-Demand	Bother	F2RL3	46	36
CCCN(CCC)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743064	DE	On-Demand	Anodyne	ACHE	17	48
CCCN(CCC)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743064	DE	On-Demand	Anodyne	FAAH	27	40
C=CCN(CC=C)C(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1	ZINC000853743080	JG	On-Demand	Mild	EPHX2	25	50
C=CCN(CC=C)C(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1	ZINC000853743082	JG	On-Demand	Mild	EPHX2	25	50
CON(C)CCNC(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000853743084	DB	On-Demand	Anodyne	SLC6A5	26	49
CN(Cc1cnc[nH]1)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000853743085	DE	On-Demand	Anodyne	TAAR1	27	43
CON(C)CCNC(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000853743090	DB	On-Demand	Anodyne	SLC6A5	26	49
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@@H](C)C(=O)N3CCC[C@@H](C(N)=O)C3)CC2)c(C)c1	ZINC000853743123	JD	On-Demand	Anodyne	EPHX2	26	50
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@@H](C)C(=O)N3CCC[C@H](C(N)=O)C3)CC2)c(C)c1	ZINC000853743126	JD	On-Demand	Anodyne	EPHX2	26	50
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@H](C)C(=O)N3CCC[C@H](C(N)=O)C3)CC2)c(C)c1	ZINC000853743129	JD	On-Demand	Anodyne	EPHX2	26	50
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@H](C)C(=O)N3CCC[C@@H](C(N)=O)C3)CC2)c(C)c1	ZINC000853743131	JD	On-Demand	Anodyne	EPHX2	26	50
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	ACHE	18	51
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	ROCK1	15	40
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	MTNR1A	38	43
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	ROCK2	18	48
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	PLA2G4B	35	41
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	FAAH	30	47
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	CRTM	40	33
CCCOc1cccc(CNC(=O)COc2cccc(OC(=O)NC)c2)c1	ZINC000853743149	FF	On-Demand	Anodyne	PDS	70	40
CCOc1ccccc1OCCOc1cccc(OC(=O)NC)c1	ZINC000853743151	EG	On-Demand	Anodyne	ACHE	19	52
CCOc1ccccc1OCCOc1cccc(OC(=O)NC)c1	ZINC000853743151	EG	On-Demand	Anodyne	BCHE	17	52
CCOc1ccccc1OCCOc1cccc(OC(=O)NC)c1	ZINC000853743151	EG	On-Demand	Anodyne	MTNR1A	19	40
CCOc1ccccc1OCCOc1cccc(OC(=O)NC)c1	ZINC000853743151	EG	On-Demand	Anodyne	MTNR1B	17	40
CCOc1ccccc1OCCOc1cccc(OC(=O)NC)c1	ZINC000853743151	EG	On-Demand	Anodyne	FAAH	38	43
CCOc1ccccc1OCCOc1cccc(OC(=O)NC)c1	ZINC000853743151	EG	On-Demand	Anodyne	PDS	72	36
C=CCCOc1cccc(OC(=O)NC)c1	ZINC000853743154	BE	On-Demand	Mild	ACHE	18	51
C=CCCOc1cccc(OC(=O)NC)c1	ZINC000853743154	BE	On-Demand	Mild	BCHE	15	51
C=CCCOc1cccc(OC(=O)NC)c1	ZINC000853743154	BE	On-Demand	Mild	MTNR1A	26	45
C=CCCOc1cccc(OC(=O)NC)c1	ZINC000853743154	BE	On-Demand	Mild	MTNR1B	23	45
C=CCCOc1cccc(OC(=O)NC)c1	ZINC000853743154	BE	On-Demand	Mild	FAAH	28	46
O=[N+]([O-])c1ccc(N(CCOCCO)C2CCC2)cc1	ZINC000853743160	CD	On-Demand	Bother	SLC27A4	51	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000853743172	GD	On-Demand	Mild	SLC6A5	17	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000853743173	GD	On-Demand	Mild	SLC6A5	17	42
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@H](C)C(=O)N(C)CC(=O)NC3CC3)CC2)c(C)c1	ZINC000853743182	JD	On-Demand	Anodyne	EPHX2	34	53
Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)O[C@@H](C)C(=O)N(C)CC(=O)NC3CC3)CC2)c(C)c1	ZINC000853743183	JD	On-Demand	Anodyne	EPHX2	34	53
CN(Cc1cnc[nH]1)c1nc(Cl)c(C(F)(F)F)cc1Cl	ZINC000853743244	EH	On-Demand	Anodyne	TAAR1	24	41
CON(C)CCNC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000853743284	CC	On-Demand	Anodyne	SLC6A5	21	41
CON(C)CCNC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000853743285	CC	On-Demand	Anodyne	SLC6A5	21	41
CN1CCC(N2CC[C@@H](NC(=O)NNc3cc(F)cc(Cl)c3)C2)CC1	ZINC000853743305	FE	On-Demand	Reactive	SLC6A5	22	49
CNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743307	BC	On-Demand	Anodyne	ACHE	17	50
CNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743307	BC	On-Demand	Anodyne	FAAH	34	40
CNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743307	BC	On-Demand	Anodyne	PDS	52	34
O=[N+]([O-])c1ccc(N(CCOCCO)C2CCC2)c(F)c1	ZINC000853743309	CE	On-Demand	Bother	SLC27A4	50	34
CN1CCC(N2CC[C@@H](NC(=O)NNc3ccc([N+](=O)[O-])cc3F)C2)CC1	ZINC000853743311	GD	On-Demand	Reactive	SLC6A5	20	43
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	ACHE	21	55
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	BCHE	19	55
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	UPP1	30	40
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	MTNR1A	37	45
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	MTNR1B	32	45
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	PLA2G4B	49	44
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	FAAH	52	48
CCCOc1cccc(OC(=O)NC)c1	ZINC000853743322	BE	On-Demand	Anodyne	PDS	67	36
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	ACHE	27	56
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	HRH2	20	40
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	CNR2	15	40
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	GGPS1	17	47
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	BCHE	22	56
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	LPAR2	49	38
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	MTNR1A	40	44
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	MTNR1B	37	43
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	PLA2G4B	102	54
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	FAAH	58	54
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	S1PR2	45	38
CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853743361	BF	On-Demand	Anodyne	PDS	60	35
CC[C@@H](C)c1ccc(NC(=O)COc2cccc(OC(=O)NC)c2)cc1	ZINC000853743391	FH	On-Demand	Anodyne	MTNR1B	17	42
CC[C@@H](C)c1ccc(NC(=O)COc2cccc(OC(=O)NC)c2)cc1	ZINC000853743391	FH	On-Demand	Anodyne	PDS	42	35
C=C(C)COc1cccc(OC(=O)NC)c1	ZINC000853743397	BE	On-Demand	Mild	ACHE	16	49
C=C(C)COc1cccc(OC(=O)NC)c1	ZINC000853743397	BE	On-Demand	Mild	MTNR1A	23	41
C=C(C)COc1cccc(OC(=O)NC)c1	ZINC000853743397	BE	On-Demand	Mild	MTNR1B	24	41
C=C(C)COc1cccc(OC(=O)NC)c1	ZINC000853743397	BE	On-Demand	Mild	FAAH	32	40
C=C(C)COc1cccc(OC(=O)NC)c1	ZINC000853743397	BE	On-Demand	Mild	PDS	47	33
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc3c(OC)cccc3c2)CC1	ZINC000853743410	GE	On-Demand	Anodyne	P2RY12	111	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc3c(OC)cccc3c2)CC1	ZINC000853743411	GE	On-Demand	Anodyne	P2RY12	111	40
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3c(C)cc(C)cc3C)CC2)CC1	ZINC000853743445	JD	On-Demand	Anodyne	EPHX2	28	52
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3c(C)cc(C)cc3C)CC2)CC1	ZINC000853743446	JD	On-Demand	Anodyne	EPHX2	28	52
Brc1cc(OCCN2CCCCC2)cnc1Br	ZINC000853743465	FG	On-Demand	Anodyne	ESR1	71	39
Brc1cc(OCCN2CCCCC2)cnc1Br	ZINC000853743465	FG	On-Demand	Anodyne	ESR2	51	39
Brc1cc(OCCN2CCCCC2)cnc1Br	ZINC000853743465	FG	On-Demand	Anodyne	LTA4H	51	50
Brc1cc(OCCN2CCCCC2)cnc1Br	ZINC000853743465	FG	On-Demand	Anodyne	HRH3	62	48
Brc1cc(OCCN2CCCCC2)cnc1Br	ZINC000853743465	FG	On-Demand	Anodyne	PSMB2	49	49
Brc1cc(OCCN2CCCCC2)cnc1Br	ZINC000853743465	FG	On-Demand	Anodyne	PSMB1	53	49
CN(Cc1cnc[nH]1)c1ccc(C(F)(F)F)c(Cl)n1	ZINC000853743469	CG	On-Demand	Anodyne	TAAR1	25	40
CN(c1ccc([N+](=O)[O-])c2nonc12)[C@@H](CO)Cc1ccccc1	ZINC000853743488	EE	On-Demand	Bother	GSTM2	131	51
CN(c1ccc([N+](=O)[O-])c2nonc12)[C@@H](CO)Cc1ccccc1	ZINC000853743488	EE	On-Demand	Bother	GSTP1	84	51
CN(c1ccc([N+](=O)[O-])c2nonc12)[C@H](CO)Cc1ccccc1	ZINC000853743489	EE	On-Demand	Bother	GSTM2	131	51
CN(c1ccc([N+](=O)[O-])c2nonc12)[C@H](CO)Cc1ccccc1	ZINC000853743489	EE	On-Demand	Bother	GSTP1	84	51
CCc1nnc(COc2cccc(OC(=O)NC)c2)o1	ZINC000853743538	CD	On-Demand	Anodyne	MAOB	22	40
C=CCN(CC=C)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743539	DD	On-Demand	Mild	ACHE	15	47
C=CCN(CC=C)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743539	DD	On-Demand	Mild	FAAH	20	42
C#CCCN(CCOC)C(=O)N[C@H]1CCN(C2CCN(C)CC2)C1	ZINC000853743579	EC	On-Demand	Mild	SLC6A5	18	41
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(C2CCN(C)CC2)C1	ZINC000853743580	EC	On-Demand	Mild	SLC6A5	18	41
CN1CCC(N2CC[C@@H](NC(=O)NCCc3nnc(S)n3C3CC3)C2)CC1	ZINC000853743585	GC	On-Demand	Anodyne	SLC6A5	18	42
COC(=O)/C=C\c1ccc(N(C)[C@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1	ZINC000853743615	FF	On-Demand	Clean	NR1H4	44	40
COC(=O)/C=C\c1ccc(N(C)[C@@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1	ZINC000853743616	FF	On-Demand	Clean	NR1H4	44	40
O=C(NNc1ccc(Cl)cc1Br)N[C@H]1CCN(C2CC2)C1	ZINC000853743642	FF	On-Demand	Reactive	SLC6A5	18	46
O=C(NNc1ccc(Cl)cc1Br)N[C@@H]1CCN(C2CC2)C1	ZINC000853743643	FF	On-Demand	Reactive	SLC6A5	18	46
O=C(N[C@@H]1CCN(C2CC2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853743675	DD	On-Demand	Anodyne	SLC6A5	15	41
O=C(N[C@@H]1CCN(C2CC2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853743676	DD	On-Demand	Anodyne	SLC6A5	15	41
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(C2CC2)C1	ZINC000853743677	DD	On-Demand	Anodyne	SLC6A5	15	41
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(C2CC2)C1	ZINC000853743678	DD	On-Demand	Anodyne	SLC6A5	15	41
CCN(Cc1cccc(F)c1)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743681	FF	On-Demand	Anodyne	ACHE	15	51
CCN(Cc1cccc(F)c1)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743681	FF	On-Demand	Anodyne	PDS	48	39
CCOCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743685	CC	On-Demand	Anodyne	MTNR1A	41	42
CCOCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743685	CC	On-Demand	Anodyne	MTNR1B	33	42
CN(Cc1cnc[nH]1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000853743690	DE	On-Demand	Anodyne	TAAR1	29	46
CCCCC[C@@H](C)NC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743691	DF	On-Demand	Anodyne	PLA2G4B	55	42
CCCCC[C@@H](C)NC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743691	DF	On-Demand	Anodyne	FAAH	28	41
C#CCCOc1cccc(OC(=O)NC)c1	ZINC000853743704	BD	On-Demand	Mild	ACHE	18	51
C#CCCOc1cccc(OC(=O)NC)c1	ZINC000853743704	BD	On-Demand	Mild	BCHE	15	51
C#CCCOc1cccc(OC(=O)NC)c1	ZINC000853743704	BD	On-Demand	Mild	MTNR1A	19	42
C#CCCOc1cccc(OC(=O)NC)c1	ZINC000853743704	BD	On-Demand	Mild	MTNR1B	17	42
CC[C@H](NC(=O)COc1cccc(OC(=O)NC)c1)c1ccc(Cl)cc1	ZINC000853743723	GH	On-Demand	Anodyne	UTS2	43	32
CC[C@H](NC(=O)COc1cccc(OC(=O)NC)c1)c1ccc(Cl)cc1	ZINC000853743723	GH	On-Demand	Anodyne	PDS	84	42
CC[C@@H](NC(=O)COc1cccc(OC(=O)NC)c1)c1ccc(Cl)cc1	ZINC000853743726	GH	On-Demand	Anodyne	UTS2	43	32
CC[C@@H](NC(=O)COc1cccc(OC(=O)NC)c1)c1ccc(Cl)cc1	ZINC000853743726	GH	On-Demand	Anodyne	PDS	84	42
CCC(CC)n1ccc(COc2cccc(OC(=O)NC)c2)n1	ZINC000853743741	DH	On-Demand	Anodyne	PDS	55	33
CC[C@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743754	BF	On-Demand	Anodyne	ACHE	16	53
CC[C@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743754	BF	On-Demand	Anodyne	MTNR1B	19	47
CC[C@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743754	BF	On-Demand	Anodyne	FAAH	36	43
CC[C@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743754	BF	On-Demand	Anodyne	PDS	101	44
CC[C@@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743755	BF	On-Demand	Anodyne	ACHE	16	53
CC[C@@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743755	BF	On-Demand	Anodyne	MTNR1B	19	47
CC[C@@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743755	BF	On-Demand	Anodyne	FAAH	36	43
CC[C@@H](C)COc1cccc(OC(=O)NC)c1	ZINC000853743755	BF	On-Demand	Anodyne	PDS	101	44
CCOc1ccccc1[C@@H](CC)NC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743769	GG	On-Demand	Anodyne	PDS	79	37
CCOc1ccccc1[C@H](CC)NC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743770	GG	On-Demand	Anodyne	PDS	79	37
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@H]1CCN(C2CC2)C1	ZINC000853743833	FF	On-Demand	Reactive	SLC6A5	15	41
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CCN(C2CC2)C1	ZINC000853743834	FF	On-Demand	Reactive	SLC6A5	15	41
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	ACHE	23	45
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	HRH2	18	41
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	BCHE	17	45
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	MTNR1A	61	44
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	MTNR1B	54	43
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	PLA2G4B	59	43
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	FAAH	39	55
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	CRTM	42	37
CCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743906	CD	On-Demand	Anodyne	PDS	59	35
CCOCCCNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1	ZINC000853743916	JE	On-Demand	Anodyne	EPHX2	29	58
CCOc1ccc(OCCOc2cccc(OC(=O)NC)c2)cc1	ZINC000853743917	EG	On-Demand	Anodyne	ACHE	21	55
CCOc1ccc(OCCOc2cccc(OC(=O)NC)c2)cc1	ZINC000853743917	EG	On-Demand	Anodyne	BCHE	19	55
CCOc1ccc(OCCOc2cccc(OC(=O)NC)c2)cc1	ZINC000853743917	EG	On-Demand	Anodyne	MTNR1A	37	43
CCOc1ccc(OCCOc2cccc(OC(=O)NC)c2)cc1	ZINC000853743917	EG	On-Demand	Anodyne	MTNR1B	33	43
CCOc1ccc(OCCOc2cccc(OC(=O)NC)c2)cc1	ZINC000853743917	EG	On-Demand	Anodyne	PLA2G4B	69	44
CCOc1ccc(OCCOc2cccc(OC(=O)NC)c2)cc1	ZINC000853743917	EG	On-Demand	Anodyne	FAAH	52	51
CCOc1ccc(OCCOc2cccc(OC(=O)NC)c2)cc1	ZINC000853743917	EG	On-Demand	Anodyne	PDS	79	37
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	ACHE	22	44
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	BCHE	16	44
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	MTNR1A	57	44
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	MTNR1B	49	43
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	PLA2G4B	81	44
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	FAAH	44	55
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	CRTM	42	37
CCCCCNC(=O)COc1cccc(OC(=O)NC)c1	ZINC000853743918	CE	On-Demand	Anodyne	PDS	51	35
CCOCCCNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2c(C)cc(C)cc2C)CC1	ZINC000853743925	JE	On-Demand	Anodyne	EPHX2	29	58
O=[N+]([O-])c1ccc(N(CCOCCO)C2CCC2)c2nonc12	ZINC000853743936	DD	On-Demand	Bother	GSTM2	113	42
O=[N+]([O-])c1ccc(N(CCOCCO)C2CCC2)c2nonc12	ZINC000853743936	DD	On-Demand	Bother	GSTP1	69	42
CN1CCC(N2CC[C@@H](NC(=O)NCCc3nnc(S)n3C)C2)CC1	ZINC000853743950	FC	On-Demand	Anodyne	SLC6A5	20	43
CCC(=O)c1ccc(N(C)[C@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1	ZINC000853744008	EG	On-Demand	Bother	COLA	47	36
CCC(=O)c1ccc(N(C)[C@@H](CO)Cc2ccccc2)c([N+](=O)[O-])c1	ZINC000853744009	EG	On-Demand	Bother	COLA	47	36
C[C@@H](CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C(C)(C)C	ZINC000853744072	CF	On-Demand	Anodyne	CPT1A	61	34
C[C@@H](CNC(=O)N1CCCC[C@H]1c1nc[nH]n1)C(C)(C)C	ZINC000853744073	CF	On-Demand	Anodyne	CPT1A	61	34
CCOc1ccc([C@@H]2CCCN2C(=O)COc2cccc(OC(=O)NC)c2)cc1	ZINC000853744083	GH	On-Demand	Anodyne	CPT1A	142	47
CCOc1ccc([C@@H]2CCCN2C(=O)COc2cccc(OC(=O)NC)c2)cc1	ZINC000853744083	GH	On-Demand	Anodyne	CPT2	50	47
C=CCOCCOc1cccc(OC(=O)NC)c1	ZINC000853744117	CD	On-Demand	Mild	ACHE	17	50
C=CCOCCOc1cccc(OC(=O)NC)c1	ZINC000853744117	CD	On-Demand	Mild	BCHE	15	50
C=CCOCCOc1cccc(OC(=O)NC)c1	ZINC000853744117	CD	On-Demand	Mild	MTNR1A	17	41
C=CCOCCOc1cccc(OC(=O)NC)c1	ZINC000853744117	CD	On-Demand	Mild	FAAH	26	45
C[C@@H](CCNC(=O)NC[C@@H](C)C(C)(C)C)N(C)C	ZINC000853744122	CE	On-Demand	Anodyne	CHRNA4	18	41
C[C@@H](CCNC(=O)NC[C@H](C)C(C)(C)C)N(C)C	ZINC000853744124	CE	On-Demand	Anodyne	CHRNA4	18	41
C[C@@H](CNC(=O)N(CCN1CCOCC1)CC1CC1)C(C)(C)C	ZINC000853744211	EE	On-Demand	Anodyne	CASR	47	37
C[C@H](CNC(=O)N(CCN1CCOCC1)CC1CC1)C(C)(C)C	ZINC000853744212	EE	On-Demand	Anodyne	CASR	47	37
CC#CCCOc1cccc(OC(=O)NC)c1	ZINC000853744216	BE	On-Demand	Mild	ACHE	17	50
CC#CCCOc1cccc(OC(=O)NC)c1	ZINC000853744216	BE	On-Demand	Mild	BCHE	15	50
C[C@@H](CNC(=O)N1CCC[C@H](N2CCOCC2)CC1)C(C)(C)C	ZINC000853744241	EF	On-Demand	Anodyne	L3MBTL3	41	36
C[C@@H](CNC(=O)N1CCC[C@@H](N2CCOCC2)CC1)C(C)(C)C	ZINC000853744243	EF	On-Demand	Anodyne	L3MBTL3	41	36
C#CCOCCOc1cccc(OC(=O)NC)c1	ZINC000853744254	BD	On-Demand	Mild	ACHE	17	51
CC[C@H]1c2ccsc2CCN1C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853744316	FG	On-Demand	Anodyne	CPT1A	45	35
CC[C@@H]1c2ccsc2CCN1C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853744317	FG	On-Demand	Anodyne	CPT1A	45	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OC(=O)NC)c2)CC1	ZINC000853744348	GD	On-Demand	Anodyne	P2RY12	112	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OC(=O)NC)c2)CC1	ZINC000853744349	GD	On-Demand	Anodyne	P2RY12	112	41
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	MMP13	32	43
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	MMP2	21	41
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	MMP3	37	41
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	MMP8	23	41
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	MMP9	22	41
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	EPHX2	28	46
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	MMP7	34	41
COc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c(OC)c1	ZINC000853744364	JF	On-Demand	Anodyne	MMP1	31	41
CCOCCCNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744395	ID	On-Demand	Anodyne	EPHX2	30	45
CCOCCCNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744396	ID	On-Demand	Anodyne	EPHX2	30	45
C[C@@H](CNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1)C(C)(C)C	ZINC000853744423	EG	On-Demand	Anodyne	SLC6A3	17	44
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744440	JF	On-Demand	Anodyne	LPL	43	34
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744440	JF	On-Demand	Anodyne	EPHX2	37	46
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744440	JF	On-Demand	Anodyne	TGM2	56	35
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744440	JF	On-Demand	Anodyne	F13A1	69	35
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744441	JF	On-Demand	Anodyne	LPL	43	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744441	JF	On-Demand	Anodyne	EPHX2	37	46
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744441	JF	On-Demand	Anodyne	TGM2	56	35
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1	ZINC000853744441	JF	On-Demand	Anodyne	F13A1	69	35
C=C(CC)COc1cccc(OC(=O)NC)c1	ZINC000853744448	BF	On-Demand	Mild	ACHE	15	46
C=C(CC)COc1cccc(OC(=O)NC)c1	ZINC000853744448	BF	On-Demand	Mild	PDS	50	34
COC[C@H](NC(=O)NC[C@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744452	DG	On-Demand	Anodyne	MTNR1A	33	43
COC[C@H](NC(=O)NC[C@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744452	DG	On-Demand	Anodyne	MTNR1B	35	43
COC[C@H](NC(=O)NC[C@@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744453	DG	On-Demand	Anodyne	MTNR1A	33	43
COC[C@H](NC(=O)NC[C@@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744453	DG	On-Demand	Anodyne	MTNR1B	35	43
COC[C@@H](NC(=O)NC[C@@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744454	DG	On-Demand	Anodyne	MTNR1A	33	43
COC[C@@H](NC(=O)NC[C@@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744454	DG	On-Demand	Anodyne	MTNR1B	35	43
COC[C@@H](NC(=O)NC[C@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744455	DG	On-Demand	Anodyne	MTNR1A	33	43
COC[C@@H](NC(=O)NC[C@H](C)C(C)(C)C)c1cccc(OC)c1	ZINC000853744455	DG	On-Demand	Anodyne	MTNR1B	35	43
C[C@@H](CNC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)C(C)(C)C	ZINC000853744485	FI	On-Demand	Anodyne	WNT3	40	32
C[C@@H](CNC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)C(C)(C)C	ZINC000853744486	FI	On-Demand	Anodyne	WNT3	40	32
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744494	JD	On-Demand	Anodyne	EPHX2	28	48
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744494	JD	On-Demand	Anodyne	TGM2	42	36
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744494	JD	On-Demand	Anodyne	F13A1	42	36
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744495	JD	On-Demand	Anodyne	EPHX2	28	48
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744495	JD	On-Demand	Anodyne	TGM2	42	36
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744495	JD	On-Demand	Anodyne	F13A1	42	36
COCCN(CCF)C(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744521	FC	On-Demand	Anodyne	CA2	46	42
COCCN(CCF)C(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744521	FC	On-Demand	Anodyne	CA1	33	40
COCCN(CCF)C(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744521	FC	On-Demand	Anodyne	CA4	43	40
CCOC(=O)c1c(COc2cccc(OC(=O)NC)c2)noc1C	ZINC000853744548	EE	On-Demand	Anodyne	CACNA1D	18	41
COCCCNC(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744551	ID	On-Demand	Anodyne	EPHX2	31	46
COCCCNC(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744552	ID	On-Demand	Anodyne	EPHX2	31	46
C=CCCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744568	CH	On-Demand	Mild	ACHE	18	51
C=CCCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744568	CH	On-Demand	Mild	BCHE	17	51
C=CCCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744568	CH	On-Demand	Mild	PLA2G4B	40	43
C=CCCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744568	CH	On-Demand	Mild	LSS	56	37
C=CCCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744568	CH	On-Demand	Mild	FAAH	37	43
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cncc(C#N)n3)CC2)C1	ZINC000853744622	FG	On-Demand	Mild	GPR119	29	57
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cncc(C#N)n3)CC2)C1	ZINC000853744623	FG	On-Demand	Mild	GPR119	29	57
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853744630	DE	On-Demand	Anodyne	SLC6A1	46	33
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853744630	DE	On-Demand	Anodyne	ACKR3	65	33
Cc1nnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)o1	ZINC000853744632	FG	On-Demand	Anodyne	GPR119	18	46
Cc1nnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)o1	ZINC000853744633	FG	On-Demand	Anodyne	GPR119	18	46
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744638	FE	On-Demand	Anodyne	P2RY12	153	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744638	FE	On-Demand	Anodyne	PRSS2	43	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744638	FE	On-Demand	Anodyne	HRH3	15	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744638	FE	On-Demand	Anodyne	GPR119	35	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744639	FE	On-Demand	Anodyne	P2RY12	153	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744639	FE	On-Demand	Anodyne	PRSS2	43	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744639	FE	On-Demand	Anodyne	HRH3	15	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(OC3CC3)c2)CC1	ZINC000853744639	FE	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccncc3C(N)=O)CC2)C1	ZINC000853744641	GG	On-Demand	Anodyne	GPR119	36	51
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccncc3C(N)=O)CC2)C1	ZINC000853744642	GG	On-Demand	Anodyne	GPR119	36	51
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc(C(N)=O)nn3)CC2)C1	ZINC000853744658	GE	On-Demand	Anodyne	SCD1	37	44
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc(C(N)=O)nn3)CC2)C1	ZINC000853744658	GE	On-Demand	Anodyne	GPR119	34	51
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc(C(N)=O)nn3)CC2)C1	ZINC000853744659	GE	On-Demand	Anodyne	SCD1	37	44
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc(C(N)=O)nn3)CC2)C1	ZINC000853744659	GE	On-Demand	Anodyne	GPR119	34	51
Cc1nnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c(C#N)c1C	ZINC000853744667	GH	On-Demand	Mild	GPR119	19	46
Cc1nnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c(C#N)c1C	ZINC000853744668	GH	On-Demand	Mild	GPR119	19	46
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853744669	FG	On-Demand	Anodyne	ADORA2B	21	40
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853744669	FG	On-Demand	Anodyne	JAK2	15	44
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853744669	FG	On-Demand	Anodyne	MTOR	48	34
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853744669	FG	On-Demand	Anodyne	EPHX2	36	43
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853744669	FG	On-Demand	Anodyne	MCHR1	22	46
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853744669	FG	On-Demand	Anodyne	EPHB4	54	37
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCOCC2)cc1	ZINC000853744669	FG	On-Demand	Anodyne	STAT6	67	40
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853744674	GD	On-Demand	Anodyne	EPHX2	15	41
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853744674	GD	On-Demand	Anodyne	SFRP1	102	35
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853744674	GD	On-Demand	Anodyne	WNT3	70	32
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@H]1CCCN(c2ccccc2)C1	ZINC000853744675	GD	On-Demand	Anodyne	EPHX2	15	41
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@H]1CCCN(c2ccccc2)C1	ZINC000853744675	GD	On-Demand	Anodyne	SFRP1	102	35
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@H]1CCCN(c2ccccc2)C1	ZINC000853744675	GD	On-Demand	Anodyne	WNT3	70	32
CON(C)CCNC(=O)NCC1(c2cccc(Br)c2)CC1	ZINC000853744678	FE	On-Demand	Anodyne	KCNA3	44	35
O=C(COc1ccc(OC2CCC2)cc1)N1CCC2(CC1)OCCO2	ZINC000853744681	EE	On-Demand	Anodyne	CPT1A	60	41
O=C(COc1ccc(OC2CCC2)cc1)N1CCC2(CC1)OCCO2	ZINC000853744681	EE	On-Demand	Anodyne	CPT2	46	41
c1cc(OCC2OCCO2)cc(OC2CC2)c1	ZINC000853744682	BD	On-Demand	Anodyne	CHRNA10	77	40
Cn1ccnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c1=O	ZINC000853744691	GF	On-Demand	Anodyne	GPR119	29	55
Cn1ccnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c1=O	ZINC000853744692	GF	On-Demand	Anodyne	GPR119	29	55
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccncc3C#N)CC2)C1	ZINC000853744693	FH	On-Demand	Mild	GPR119	49	51
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccncc3C#N)CC2)C1	ZINC000853744694	FH	On-Demand	Mild	GPR119	49	51
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000853744700	EE	On-Demand	Mild	SLC6A1	51	34
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853744701	EE	On-Demand	Mild	SLC6A1	51	34
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cc(C#N)ccn3)CC2)C1	ZINC000853744705	FH	On-Demand	Mild	GPR119	42	59
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cc(C#N)ccn3)CC2)C1	ZINC000853744706	FH	On-Demand	Mild	GPR119	42	59
O=C1CCC2=C(CCN(c3ncccc3C(F)(F)F)C2)N1	ZINC000853744710	CE	On-Demand	Anodyne	TRPV1	33	46
c1cnc(COc2cccc(OC3CC3)c2)nc1	ZINC000853744711	BF	On-Demand	Anodyne	CHRNA10	49	35
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncncc3C#N)CC2)C1	ZINC000853744714	FG	On-Demand	Mild	GPR119	35	50
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncncc3C#N)CC2)C1	ZINC000853744715	FG	On-Demand	Mild	GPR119	35	50
C#CCN1CCN(C(=O)COc2ccc(OC3CCC3)cc2)CC1	ZINC000853744716	ED	On-Demand	Mild	CPT1A	78	39
C#CCN1CCN(C(=O)COc2ccc(OC3CCC3)cc2)CC1	ZINC000853744716	ED	On-Demand	Mild	CPT2	47	39
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc4nncn4n3)CC2)C1	ZINC000853744720	GF	On-Demand	Anodyne	GPR119	23	48
C=CCN(CC=C)C(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744737	IF	On-Demand	Mild	EPHX2	24	44
C=CCN(CC=C)C(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744737	IF	On-Demand	Mild	TGM2	63	37
C=CCN(CC=C)C(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744737	IF	On-Demand	Mild	F13A1	63	36
C=CCN(CC=C)C(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744738	IF	On-Demand	Mild	EPHX2	24	44
C=CCN(CC=C)C(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744738	IF	On-Demand	Mild	TGM2	63	37
C=CCN(CC=C)C(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744738	IF	On-Demand	Mild	F13A1	63	36
C=CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744754	BG	On-Demand	Mild	ACHE	18	52
C=CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744754	BG	On-Demand	Mild	BCHE	16	52
C=CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744754	BG	On-Demand	Mild	MTNR1A	24	40
C=CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744754	BG	On-Demand	Mild	MTNR1B	19	40
C=CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744754	BG	On-Demand	Mild	PLA2G4B	26	42
C=CCCCCOc1cccc(OC(=O)NC)c1	ZINC000853744754	BG	On-Demand	Mild	FAAH	36	44
CCN(CCCOc1cccc(OC(=O)NC)c1)CC(F)(F)F	ZINC000853744762	EG	On-Demand	Anodyne	ACHE	20	54
CCN(CCCOc1cccc(OC(=O)NC)c1)CC(F)(F)F	ZINC000853744762	EG	On-Demand	Anodyne	FAAH	21	43
CCN(CCCOc1cccc(OC(=O)NC)c1)CC(F)(F)F	ZINC000853744762	EG	On-Demand	Anodyne	PDS	41	34
C=C(C)CCOc1cccc(OC(=O)NC)c1	ZINC000853744763	BF	On-Demand	Mild	ACHE	18	54
C=C(C)CCOc1cccc(OC(=O)NC)c1	ZINC000853744763	BF	On-Demand	Mild	BCHE	16	54
C=C(C)CCOc1cccc(OC(=O)NC)c1	ZINC000853744763	BF	On-Demand	Mild	MTNR1A	27	45
C=C(C)CCOc1cccc(OC(=O)NC)c1	ZINC000853744763	BF	On-Demand	Mild	MTNR1B	27	45
CC/C=C\CCOc1cccc(OC(=O)NC)c1	ZINC000853744773	BG	On-Demand	Anodyne	ACHE	17	49
CC/C=C\CCOc1cccc(OC(=O)NC)c1	ZINC000853744773	BG	On-Demand	Anodyne	BCHE	15	49
CC/C=C\CCOc1cccc(OC(=O)NC)c1	ZINC000853744773	BG	On-Demand	Anodyne	MTNR1A	21	43
CC/C=C\CCOc1cccc(OC(=O)NC)c1	ZINC000853744773	BG	On-Demand	Anodyne	MTNR1B	18	43
CC/C=C\CCOc1cccc(OC(=O)NC)c1	ZINC000853744773	BG	On-Demand	Anodyne	FAAH	32	40
CC/C=C\CCOc1cccc(OC(=O)NC)c1	ZINC000853744773	BG	On-Demand	Anodyne	PDS	41	33
CC/C=C/CCOc1cccc(OC(=O)NC)c1	ZINC000853744774	BG	On-Demand	Anodyne	ACHE	17	49
CC/C=C/CCOc1cccc(OC(=O)NC)c1	ZINC000853744774	BG	On-Demand	Anodyne	BCHE	15	49
CC/C=C/CCOc1cccc(OC(=O)NC)c1	ZINC000853744774	BG	On-Demand	Anodyne	MTNR1A	21	43
CC/C=C/CCOc1cccc(OC(=O)NC)c1	ZINC000853744774	BG	On-Demand	Anodyne	MTNR1B	18	43
CC/C=C/CCOc1cccc(OC(=O)NC)c1	ZINC000853744774	BG	On-Demand	Anodyne	FAAH	32	40
CC/C=C/CCOc1cccc(OC(=O)NC)c1	ZINC000853744774	BG	On-Demand	Anodyne	PDS	41	33
CCOC(=O)c1csc(COc2cccc(OC(=O)NC)c2)n1	ZINC000853744777	EF	On-Demand	Anodyne	FAAH	18	40
CCN(C)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853744785	CD	On-Demand	Anodyne	ACHE	19	50
CCN(C)C(=O)COc1cccc(OC(=O)NC)c1	ZINC000853744785	CD	On-Demand	Anodyne	BCHE	15	49
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1	ZINC000853744819	JH	On-Demand	Anodyne	EPHX2	26	44
CON(C)CCNC(=O)NCc1oc2ccccc2c1C	ZINC000853744824	CE	On-Demand	Anodyne	MTNR1A	22	41
CON(C)CCNC(=O)NCc1oc2ccccc2c1C	ZINC000853744824	CE	On-Demand	Anodyne	MTNR1B	19	41
CC#CCOc1cccc(OC(=O)NC)c1	ZINC000853744833	BD	On-Demand	Mild	ACHE	15	53
CC#CCOc1cccc(OC(=O)NC)c1	ZINC000853744833	BD	On-Demand	Mild	MMP13	28	40
CC#CCOc1cccc(OC(=O)NC)c1	ZINC000853744833	BD	On-Demand	Mild	ADAM17	56	40
C[C@H](CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744841	DF	On-Demand	Anodyne	MME	51	37
C[C@H](CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744841	DF	On-Demand	Anodyne	NPY5R	24	43
C[C@@H](CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744842	DF	On-Demand	Anodyne	MME	51	37
C[C@@H](CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744842	DF	On-Demand	Anodyne	NPY5R	24	43
C[C@@H](CNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744843	DF	On-Demand	Anodyne	MME	51	37
C[C@@H](CNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744843	DF	On-Demand	Anodyne	NPY5R	24	43
C[C@H](CNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744844	DF	On-Demand	Anodyne	MME	51	37
C[C@H](CNC(=O)N(C)[C@H](CO)Cc1ccccc1)C(C)(C)C	ZINC000853744844	DF	On-Demand	Anodyne	NPY5R	24	43
CON(C)CCNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744847	EB	On-Demand	Anodyne	CA2	62	41
CON(C)CCNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744847	EB	On-Demand	Anodyne	CA1	52	40
CON(C)CCNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744847	EB	On-Demand	Anodyne	CA7	40	37
CON(C)CCNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744847	EB	On-Demand	Anodyne	CA5B	51	37
CON(C)CCNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744847	EB	On-Demand	Anodyne	CA4	64	40
CON(C)CCNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744847	EB	On-Demand	Anodyne	CA5A	53	37
CON(C)CCNC(=O)NCc1cc(S(N)(=O)=O)ccc1F	ZINC000853744847	EB	On-Demand	Anodyne	CA12	35	40
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc4nncn4n3)CC2)C1	ZINC000853744850	GF	On-Demand	Anodyne	GPR119	23	48
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncc(C(F)F)cn3)CC2)C1	ZINC000853744859	GI	On-Demand	Anodyne	GPR119	45	56
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncc(C(F)F)cn3)CC2)C1	ZINC000853744863	GI	On-Demand	Anodyne	GPR119	45	56
CC(C)(C)OC(=O)N1CCC(COc2ccc3c(c2)OCC3=O)CC1	ZINC000853744885	EG	On-Demand	Anodyne	GPR119	62	66
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cnccn3)CC2)C1	ZINC000853744893	EG	On-Demand	Anodyne	GPR119	37	80
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cnccn3)CC2)C1	ZINC000853744895	EG	On-Demand	Anodyne	GPR119	37	80
C=C(C)CN(CC)C(=O)[C@@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744916	IF	On-Demand	Mild	EPHX2	20	43
C=C(C)CN(CC)C(=O)[C@H](C)OC(=O)C1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853744922	IF	On-Demand	Mild	EPHX2	20	43
Cn1ncc(C#N)c1N1CCC([C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853744929	FG	On-Demand	Mild	GPR119	33	48
Cn1ncc(C#N)c1N1CCC([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853744931	FG	On-Demand	Mild	GPR119	33	48
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cccc(C#N)n3)CC2)C1	ZINC000853744935	FH	On-Demand	Mild	GPR119	31	57
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cccc(C#N)n3)CC2)C1	ZINC000853744936	FH	On-Demand	Mild	GPR119	31	57
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744938	JD	On-Demand	Anodyne	MMP13	18	41
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744938	JD	On-Demand	Anodyne	EPHX2	33	50
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744938	JD	On-Demand	Anodyne	TGM2	50	35
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744938	JD	On-Demand	Anodyne	F13A1	45	35
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744939	JD	On-Demand	Anodyne	MMP13	18	41
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744939	JD	On-Demand	Anodyne	EPHX2	33	50
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744939	JD	On-Demand	Anodyne	TGM2	50	35
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853744939	JD	On-Demand	Anodyne	F13A1	45	35
Cn1cnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1=O	ZINC000853744941	GF	On-Demand	Anodyne	GPR119	30	50
Cn1cnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)cc1=O	ZINC000853744942	GF	On-Demand	Anodyne	GPR119	30	50
C#CCN1CCN(C(=O)COc2cccc(OC3CC3)c2)CC1	ZINC000853744946	DD	On-Demand	Mild	HTR1D	16	40
C#CCN1CCN(C(=O)COc2cccc(OC3CC3)c2)CC1	ZINC000853744946	DD	On-Demand	Mild	HTR1B	18	40
C#CCN1CCN(C(=O)COc2cccc(OC3CC3)c2)CC1	ZINC000853744946	DD	On-Demand	Mild	HRH1	16	42
C#CCN1CCN(C(=O)COc2cccc(OC3CC3)c2)CC1	ZINC000853744946	DD	On-Demand	Mild	CCR3	17	42
C#CCN1CCN(C(=O)COc2cccc(OC3CC3)c2)CC1	ZINC000853744946	DD	On-Demand	Mild	CPT1A	90	39
C#CCN1CCN(C(=O)COc2cccc(OC3CC3)c2)CC1	ZINC000853744946	DD	On-Demand	Mild	CPT2	48	39
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cnc(F)cn3)CC2)C1	ZINC000853744964	FG	On-Demand	Anodyne	GPR119	43	56
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cnc(F)cn3)CC2)C1	ZINC000853744965	FG	On-Demand	Anodyne	GPR119	43	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncccn3)CC2)C1	ZINC000853744970	EG	On-Demand	Anodyne	GPR119	49	78
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncccn3)CC2)C1	ZINC000853744971	EG	On-Demand	Anodyne	GPR119	49	78
c1cc(OCC2CCC3(CC2)OCCO3)cc(OC2CC2)c1	ZINC000853744978	DH	On-Demand	Anodyne	CHRNA10	52	36
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cnnc(O)c3Cl)CC2)C1	ZINC000853744985	GH	On-Demand	Anodyne	GPR119	27	46
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cnnc(O)c3Cl)CC2)C1	ZINC000853744986	GH	On-Demand	Anodyne	GPR119	27	46
CON(C)CCNC(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000853744988	DD	On-Demand	Anodyne	SLC6A1	44	32
CON(C)CCNC(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853744989	DD	On-Demand	Anodyne	SLC6A1	44	32
Cn1ncc2c(N3CCC([C@H]4CCCN(C(=O)OC(C)(C)C)C4)CC3)ccnc21	ZINC000853744991	GH	On-Demand	Anodyne	GPR119	34	47
Cn1ncc2c(N3CCC([C@@H]4CCCN(C(=O)OC(C)(C)C)C4)CC3)ccnc21	ZINC000853744992	GH	On-Demand	Anodyne	GPR119	34	47
FC1(F)CC(COc2ccc(OC3CCC3)cc2)C1	ZINC000853744995	CI	On-Demand	Anodyne	CHRNA10	40	34
O=C(COc1ccc(OC2CCC2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853745000	FI	On-Demand	Anodyne	MCHR1	25	46
O=C(COc1ccc(OC2CCC2)cc1)Nc1ccc(N2CCCC2)cc1	ZINC000853745000	FI	On-Demand	Anodyne	MCHR2	24	43
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cnccc3C#N)CC2)C1	ZINC000853745005	FH	On-Demand	Mild	GPR119	45	50
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cnccc3C#N)CC2)C1	ZINC000853745006	FH	On-Demand	Mild	GPR119	45	50
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC3CCC3)cc2)CC1	ZINC000853745007	GF	On-Demand	Anodyne	P2RY12	89	41
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(OC3CCC3)cc2)CC1	ZINC000853745007	GF	On-Demand	Anodyne	PRSS2	48	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC3CCC3)cc2)CC1	ZINC000853745008	GF	On-Demand	Anodyne	P2RY12	89	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(OC3CCC3)cc2)CC1	ZINC000853745008	GF	On-Demand	Anodyne	PRSS2	48	33
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cccnc3C#N)CC2)C1	ZINC000853745022	FH	On-Demand	Mild	GPR119	40	53
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cccnc3C#N)CC2)C1	ZINC000853745023	FH	On-Demand	Mild	GPR119	40	53
O=C(COc1ccc(OC2CCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853745024	GG	On-Demand	Anodyne	MTOR	59	37
O=C(COc1ccc(OC2CCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853745024	GG	On-Demand	Anodyne	EPHX2	37	44
O=C(COc1ccc(OC2CCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853745024	GG	On-Demand	Anodyne	MCHR1	21	50
O=C(COc1ccc(OC2CCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853745024	GG	On-Demand	Anodyne	MCHR2	23	40
O=C(COc1ccc(OC2CCC2)cc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853745024	GG	On-Demand	Anodyne	STAT6	54	34
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCCC2)cc1	ZINC000853745028	FH	On-Demand	Anodyne	KCNH2	26	40
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCCC2)cc1	ZINC000853745028	FH	On-Demand	Anodyne	CCR3	15	46
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCCC2)cc1	ZINC000853745028	FH	On-Demand	Anodyne	CPT1A	53	38
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCCC2)cc1	ZINC000853745028	FH	On-Demand	Anodyne	EPHX2	29	40
O=C(COc1cccc(OC2CC2)c1)Nc1ccc(N2CCCC2)cc1	ZINC000853745028	FH	On-Demand	Anodyne	MCHR1	26	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745031	JD	On-Demand	Anodyne	EPHX2	25	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745031	JD	On-Demand	Anodyne	TGM2	69	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745031	JD	On-Demand	Anodyne	F13A1	73	48
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745031	JD	On-Demand	Anodyne	GPR119	33	40
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745032	JD	On-Demand	Anodyne	EPHX2	25	45
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745032	JD	On-Demand	Anodyne	TGM2	69	48
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745032	JD	On-Demand	Anodyne	F13A1	73	48
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)CC1	ZINC000853745032	JD	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)C1	ZINC000853745035	GG	On-Demand	Bother	GPR119	40	56
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncc([N+](=O)[O-])cn3)CC2)C1	ZINC000853745036	GG	On-Demand	Bother	GPR119	40	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc(Cl)nn3)CC2)C1	ZINC000853745039	GH	On-Demand	Anodyne	GPR119	43	51
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc(Cl)nn3)CC2)C1	ZINC000853745040	GH	On-Demand	Anodyne	GPR119	43	51
Cn1ncc(COc2cccc(OC3CC3)c2)n1	ZINC000853745046	BD	On-Demand	Anodyne	CHRNA10	55	38
Cn1ncc(COc2ccc(OC3CCC3)cc2)n1	ZINC000853745047	CE	On-Demand	Anodyne	HRH3	20	40
CS(=O)(=O)c1cccc(NC(=O)COc2ccc(OC3CCC3)cc2)c1	ZINC000853745051	GG	On-Demand	Anodyne	EPHX2	18	40
CS(=O)(=O)c1cccc(NC(=O)COc2ccc(OC3CCC3)cc2)c1	ZINC000853745051	GG	On-Demand	Anodyne	HIF1A	15	44
Cc1cc(C#N)nc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853745064	GH	On-Demand	Mild	GPR119	28	59
Cc1cc(C#N)nc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853745065	GH	On-Demand	Mild	GPR119	28	59
CC(=O)c1ccc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc1	ZINC000853745072	GI	On-Demand	Anodyne	GPR119	48	56
CC(=O)c1ccc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc1	ZINC000853745073	GI	On-Demand	Anodyne	GPR119	48	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc4nnnn4n3)CC2)C1	ZINC000853745079	GE	On-Demand	Anodyne	GPR119	24	48
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc4nnnn4n3)CC2)C1	ZINC000853745080	GE	On-Demand	Anodyne	GPR119	24	48
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccnc(C(N)=O)c3)CC2)C1	ZINC000853745081	GG	On-Demand	Anodyne	GPR119	48	55
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccnc(C(N)=O)c3)CC2)C1	ZINC000853745082	GG	On-Demand	Anodyne	GPR119	48	55
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cc(F)ncn3)CC2)C1	ZINC000853745093	FG	On-Demand	Anodyne	GPR119	46	58
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cc(F)ncn3)CC2)C1	ZINC000853745094	FG	On-Demand	Anodyne	GPR119	46	58
Cc1nnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)s1	ZINC000853745095	FH	On-Demand	Anodyne	GPR119	15	46
Cc1nnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)s1	ZINC000853745096	FH	On-Demand	Anodyne	GPR119	15	46
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3nnc(C(F)F)o3)CC2)C1	ZINC000853745098	GH	On-Demand	Anodyne	GPR119	15	44
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3nnc(C(F)F)o3)CC2)C1	ZINC000853745099	GH	On-Demand	Anodyne	GPR119	15	44
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cncc(C(N)=O)n3)CC2)C1	ZINC000853745101	GE	On-Demand	Anodyne	GPR119	23	53
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cncc(C(N)=O)n3)CC2)C1	ZINC000853745102	GE	On-Demand	Anodyne	GPR119	23	53
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncc(F)cn3)CC2)C1	ZINC000853745114	FG	On-Demand	Anodyne	GPR119	53	60
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncc(F)cn3)CC2)C1	ZINC000853745115	FG	On-Demand	Anodyne	GPR119	53	60
Cc1cncc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853745122	FH	On-Demand	Anodyne	GPR119	33	56
Cc1cncc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853745123	FH	On-Demand	Anodyne	GPR119	33	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncnc4[nH]cnc34)CC2)C1	ZINC000853745124	GG	On-Demand	Anodyne	GPR119	32	48
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncnc4[nH]cnc34)CC2)C1	ZINC000853745125	GG	On-Demand	Anodyne	GPR119	32	48
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cnc(C#N)cn3)CC2)C1	ZINC000853745129	FG	On-Demand	Mild	GPR119	35	59
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cnc(C#N)cn3)CC2)C1	ZINC000853745130	FG	On-Demand	Mild	GPR119	35	59
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc3c(c2)OCC3=O)CC1	ZINC000853745136	FD	On-Demand	Anodyne	P2RY12	84	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc3c(c2)OCC3=O)CC1	ZINC000853745137	FD	On-Demand	Anodyne	P2RY12	84	38
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cc(C#N)ncn3)CC2)C1	ZINC000853745142	FG	On-Demand	Mild	GPR119	42	52
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cc(C#N)ncn3)CC2)C1	ZINC000853745143	FG	On-Demand	Mild	GPR119	42	52
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853745169	FG	On-Demand	Mild	GPR119	31	56
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cc(C#N)cnn3)CC2)C1	ZINC000853745170	FG	On-Demand	Mild	GPR119	31	56
O=C1c2ccccc2C(=O)N1OCCCOc1ccc(OC2CCC2)cc1	ZINC000853745174	FH	On-Demand	Anodyne	HRH3	40	38
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3nccn4nnnc34)CC2)C1	ZINC000853745175	GE	On-Demand	Anodyne	GPR119	19	49
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3nccn4nnnc34)CC2)C1	ZINC000853745176	GE	On-Demand	Anodyne	GPR119	19	49
O=S1(=O)CCC(COc2cccc(OC3CC3)c2)CC1	ZINC000853745181	CE	On-Demand	Anodyne	CHRNA10	78	38
COCc1cc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)ncn1	ZINC000853745183	GG	On-Demand	Anodyne	GPR119	39	55
COCc1cc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)ncn1	ZINC000853745184	GG	On-Demand	Anodyne	GPR119	39	55
C#CCCOc1cccc(OC2CC2)c1	ZINC000853745189	BF	On-Demand	Mild	CHRNA10	41	34
O=C1CCC2=C(CCN(c3ccc([N+](=O)[O-])c4nonc34)C2)N1	ZINC000853745190	DD	On-Demand	Bother	GSTM2	82	40
O=C1CCC2=C(CCN(c3ccc([N+](=O)[O-])c4nonc34)C2)N1	ZINC000853745190	DD	On-Demand	Bother	GSTP1	43	36
CC(C)(C)OC(=O)N1CC[C@H](CCOc2ccc3c(c2)OCC3=O)C1	ZINC000853745194	EG	On-Demand	Anodyne	GPR119	45	62
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2ccc3c(c2)OCC3=O)C1	ZINC000853745195	EG	On-Demand	Anodyne	GPR119	45	62
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncccc3C#N)CC2)C1	ZINC000853745198	FH	On-Demand	Mild	GPR119	44	53
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncccc3C#N)CC2)C1	ZINC000853745199	FH	On-Demand	Mild	GPR119	44	53
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3nccn4cnnc34)CC2)C1	ZINC000853745219	GF	On-Demand	Anodyne	GPR119	16	49
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3nccn4cnnc34)CC2)C1	ZINC000853745220	GF	On-Demand	Anodyne	GPR119	16	49
C#Cc1cnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc1	ZINC000853745230	FG	On-Demand	Mild	GPR119	40	56
C#Cc1cnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc1	ZINC000853745231	FG	On-Demand	Mild	GPR119	40	56
O=C1CCC2=C(CCN(c3ccc(C(=O)NC4CC4)cn3)C2)N1	ZINC000853745232	DD	On-Demand	Anodyne	HPGDS	34	51
COCCS(=O)(=O)CCCOc1ccc2c(c1)OCC2=O	ZINC000853745235	DD	On-Demand	Anodyne	MAOB	19	40
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3nccc(CO)n3)CC2)C1	ZINC000853745245	GF	On-Demand	Anodyne	GPR119	40	56
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3nccc(CO)n3)CC2)C1	ZINC000853745246	GF	On-Demand	Anodyne	GPR119	40	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccnc(C#N)n3)CC2)C1	ZINC000853745259	FG	On-Demand	Mild	GPR119	33	82
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccnc(C#N)n3)CC2)C1	ZINC000853745260	FG	On-Demand	Mild	GPR119	33	82
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncc(C#N)cc3F)CC2)C1	ZINC000853745261	GH	On-Demand	Mild	GPR119	45	52
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncc(C#N)cc3F)CC2)C1	ZINC000853745262	GH	On-Demand	Mild	GPR119	45	52
CS(=O)(=O)c1cccc(NC(=O)COc2cccc(OC3CC3)c2)c1	ZINC000853745265	FF	On-Demand	Anodyne	EPHX2	21	44
CS(=O)(=O)c1cccc(NC(=O)COc2cccc(OC3CC3)c2)c1	ZINC000853745265	FF	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)N1CCO[C@@H](COc2ccc3c(c2)OCC3=O)C1	ZINC000853745268	EE	On-Demand	Anodyne	GPR119	30	50
CC(C)(C)OC(=O)N1CCO[C@H](COc2ccc3c(c2)OCC3=O)C1	ZINC000853745269	EE	On-Demand	Anodyne	GPR119	30	50
C#CCNC(=O)COc1cccc(OC2CC2)c1	ZINC000853745281	BD	On-Demand	Mild	MTNR1B	21	42
C#CCNC(=O)COc1cccc(OC2CC2)c1	ZINC000853745281	BD	On-Demand	Mild	TNKS	41	35
O=C(COc1cccc(OC2CC2)c1)N1CCC2(CC1)OCCO2	ZINC000853745293	ED	On-Demand	Anodyne	HRH1	15	42
O=C(COc1cccc(OC2CC2)c1)N1CCC2(CC1)OCCO2	ZINC000853745293	ED	On-Demand	Anodyne	CCR3	15	42
O=C(COc1cccc(OC2CC2)c1)N1CCC2(CC1)OCCO2	ZINC000853745293	ED	On-Demand	Anodyne	CPT1A	77	41
O=C(COc1cccc(OC2CC2)c1)N1CCC2(CC1)OCCO2	ZINC000853745293	ED	On-Demand	Anodyne	CPT2	47	41
FC1(F)CC(COc2cccc(OC3CC3)c2)C1	ZINC000853745294	CH	On-Demand	Anodyne	CHRNA10	70	39
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc4nccnc4n3)CC2)C1	ZINC000853745295	GH	On-Demand	Anodyne	GPR119	32	55
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc4nccnc4n3)CC2)C1	ZINC000853745296	GH	On-Demand	Anodyne	GPR119	32	55
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc(C#N)nc3)CC2)C1	ZINC000853745297	FH	On-Demand	Mild	GPR119	50	53
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc(C#N)nc3)CC2)C1	ZINC000853745298	FH	On-Demand	Mild	GPR119	50	53
O=[N+]([O-])c1ccc(COc2cccc(OC3CC3)c2)c([N+](=O)[O-])c1	ZINC000853745305	EH	On-Demand	Bother	ACR	16	40
Cc1nnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc1C	ZINC000853745311	GG	On-Demand	Anodyne	GPR119	21	52
Cc1nnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nc1C	ZINC000853745312	GG	On-Demand	Anodyne	GPR119	21	52
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cccnn3)CC2)C1	ZINC000853745317	EG	On-Demand	Anodyne	GPR119	41	59
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cccnn3)CC2)C1	ZINC000853745318	EG	On-Demand	Anodyne	GPR119	41	59
Cn1cnc([N+](=O)[O-])c1N1CCC([C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853745327	GG	On-Demand	Bother	GPR119	28	47
Cn1cnc([N+](=O)[O-])c1N1CCC([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853745328	GG	On-Demand	Bother	GPR119	28	47
CON(C)CCNC(=O)NCc1nc(-c2ccc(Cl)cc2)no1	ZINC000853745340	ED	On-Demand	Anodyne	UTS2	41	33
CC(=O)c1ccnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853745346	GI	On-Demand	Anodyne	GPR119	42	56
CC(=O)c1ccnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)c1	ZINC000853745347	GI	On-Demand	Anodyne	GPR119	42	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc(C#N)c(N)n3)CC2)C1	ZINC000853745362	GG	On-Demand	Mild	GPR119	27	55
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc(C#N)c(N)n3)CC2)C1	ZINC000853745363	GG	On-Demand	Mild	GPR119	27	55
Cn1ncnc1N1CCC([C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853745375	EF	On-Demand	Anodyne	GPR119	35	50
Cn1ncnc1N1CCC([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853745376	EF	On-Demand	Anodyne	GPR119	35	50
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccnc(C#N)c3)CC2)C1	ZINC000853745381	FH	On-Demand	Mild	GPR119	41	57
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccnc(C#N)c3)CC2)C1	ZINC000853745382	FH	On-Demand	Mild	GPR119	41	57
Cn1nccc1COc1cccc(OC2CC2)c1	ZINC000853745385	BF	On-Demand	Anodyne	CHRNA10	50	36
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3nccnc3C#N)CC2)C1	ZINC000853745393	FG	On-Demand	Mild	GPR119	29	53
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3nccnc3C#N)CC2)C1	ZINC000853745394	FG	On-Demand	Mild	GPR119	29	53
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3cc(CO)c(F)cn3)CC2)C1	ZINC000853745414	GH	On-Demand	Anodyne	GPR119	43	49
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3cc(CO)c(F)cn3)CC2)C1	ZINC000853745415	GH	On-Demand	Anodyne	GPR119	43	49
O=C1CCC2=C(CCN(c3ccc4ccccc4n3)C2)N1	ZINC000853745416	CF	On-Demand	Anodyne	HTR3A	23	48
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCN(c2ccccc2)C1	ZINC000853745418	FD	On-Demand	Anodyne	SLC6A1	64	31
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCN(c2ccccc2)C1	ZINC000853745419	FD	On-Demand	Anodyne	SLC6A1	64	31
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000853745428	JE	On-Demand	Anodyne	EPHX2	22	46
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)C2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)C1	ZINC000853745431	JE	On-Demand	Anodyne	EPHX2	22	46
c1cc(OC2CCC2)ccc1OCC1OCCO1	ZINC000853745432	CE	On-Demand	Anodyne	CHRNA10	43	36
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc(C#N)nn3)CC2)C1	ZINC000853745447	FG	On-Demand	Mild	GPR119	35	56
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc(C#N)nn3)CC2)C1	ZINC000853745448	FG	On-Demand	Mild	GPR119	35	56
Cc1ccc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853745454	FH	On-Demand	Anodyne	GPR119	42	53
Cc1ccc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)nn1	ZINC000853745455	FH	On-Demand	Anodyne	GPR119	42	53
C#CCOCCOc1ccc2c(c1)OCC2=O	ZINC000853745457	BD	On-Demand	Mild	MAOB	19	40
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ccc(C#N)cn3)CC2)C1	ZINC000853745458	FH	On-Demand	Mild	GPR119	52	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ccc(C#N)cn3)CC2)C1	ZINC000853745459	FH	On-Demand	Mild	GPR119	52	56
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncnc4n[nH]cc34)CC2)C1	ZINC000853745463	GG	On-Demand	Anodyne	SIRT3	42	35
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(c3ncnc4n[nH]cc34)CC2)C1	ZINC000853745463	GG	On-Demand	Anodyne	GPR119	27	48
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncnc4n[nH]cc34)CC2)C1	ZINC000853745464	GG	On-Demand	Anodyne	SIRT3	42	35
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(c3ncnc4n[nH]cc34)CC2)C1	ZINC000853745464	GG	On-Demand	Anodyne	GPR119	27	48
CC(C)c1nnc(N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)o1	ZINC000853745475	GI	On-Demand	Anodyne	GPR119	15	44
CC(C)c1nnc(N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)o1	ZINC000853745476	GI	On-Demand	Anodyne	GPR119	15	44
O=C1CCC2=C(CCN(c3ccnc4cc(Cl)ccc34)C2)N1	ZINC000853745477	DG	On-Demand	Anodyne	HRP1_PLAFA	89	36
O=C1CCC2=C(CCN(c3ncnc4[nH]ccc34)C2)N1	ZINC000853745519	CD	On-Demand	Anodyne	AKT2	57	51
O=C1CCC2=C(CCN(c3ncnc4[nH]ccc34)C2)N1	ZINC000853745519	CD	On-Demand	Anodyne	AKT3	34	42
O=C1CCC2=C(CCN(c3ncnc4[nH]ccc34)C2)N1	ZINC000853745519	CD	On-Demand	Anodyne	ROCK2	15	42
O=C1CCC2=C(CCN(c3ncnc4[nH]ccc34)C2)N1	ZINC000853745519	CD	On-Demand	Anodyne	AKT1	23	44
N#Cc1ccc(N2CCC3=C(CCC(=O)N3)C2)cc1C(F)(F)F	ZINC000853745539	DF	On-Demand	Mild	AR	58	47
CCCNC(=O)c1ccc(N2CCC3=C(CCC(=O)N3)C2)nc1	ZINC000853745553	DD	On-Demand	Anodyne	HPGDS	15	40
O=C1CCC2=C(CCN(c3ncnc4cc(Br)sc34)C2)N1	ZINC000853745624	FF	On-Demand	Anodyne	SIRT3	45	32
O=C1CCC2=C(CCN(c3nc4ccccc4n4cccc34)C2)N1	ZINC000853745685	DF	On-Demand	Anodyne	HTR3A	25	40
O=C1CCC2=C(CCN(c3cncc(OCc4cccc(Cl)c4)n3)C2)N1	ZINC000853745694	FG	On-Demand	Anodyne	MAOB	19	45
O=C1CCC2=C(CCN(c3ccc(C(=O)Nc4ccccc4)nn3)C2)N1	ZINC000853745786	EE	On-Demand	Anodyne	SCD1	39	46
O=C1CCC2=C(CCN(c3ccc(C(=O)Nc4ccccc4)nn3)C2)N1	ZINC000853745786	EE	On-Demand	Anodyne	SCD	34	46
Nc1nc(N2CCC3=C(CCC(=O)N3)C2)nc2ccccc12	ZINC000853745795	CD	On-Demand	Anodyne	HTR3A	16	50
O=C(CN1C(=O)CC(C2CCCC2)CC1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853745839	GE	On-Demand	Anodyne	MTOR	53	35
O=C(CN1C(=O)CC(C2CCCC2)CC1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853745839	GE	On-Demand	Anodyne	STAT6	50	31
O=C1CCC2=C(CCN(c3nc(-c4ccccc4F)cs3)C2)N1	ZINC000853746007	EG	On-Demand	Anodyne	GABRA3	51	35
COc1ccc(-c2nnc(N3CCC4=C(CCC(=O)N4)C3)c3ccccc23)cc1	ZINC000853746008	GH	On-Demand	Anodyne	SMO	36	51
Cc1cnc2c(C)cccc2c1N1CCC2=C(CCC(=O)N2)C1	ZINC000853746057	DG	On-Demand	Anodyne	ATP4A	18	41
CS(=O)(=O)C1CN(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000853746130	FD	On-Demand	Anodyne	CTSS	27	40
CS(=O)(=O)C1CN(C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000853746132	FD	On-Demand	Anodyne	CTSS	27	40
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746168	FE	On-Demand	Anodyne	SLC6A5	32	43
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746168	FE	On-Demand	Anodyne	EPHX2	27	42
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746168	FE	On-Demand	Anodyne	MCHR1	29	43
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746168	FE	On-Demand	Anodyne	LIPG	45	34
CON(C)CCNC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746169	FE	On-Demand	Anodyne	SLC6A5	32	43
CON(C)CCNC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746169	FE	On-Demand	Anodyne	EPHX2	27	42
CON(C)CCNC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746169	FE	On-Demand	Anodyne	MCHR1	29	43
CON(C)CCNC(=O)N[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1	ZINC000853746169	FE	On-Demand	Anodyne	LIPG	45	34
C=CC[C@H](NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccncc1	ZINC000853746189	GG	On-Demand	Mild	ACHE	20	43
C=CC[C@H](NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccncc1	ZINC000853746189	GG	On-Demand	Mild	SIGMAR1	18	41
C=CC[C@H](NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccncc1	ZINC000853746189	GG	On-Demand	Mild	CACNA1I	59	39
C=CC[C@@H](NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccncc1	ZINC000853746190	GG	On-Demand	Mild	ACHE	20	43
C=CC[C@@H](NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccncc1	ZINC000853746190	GG	On-Demand	Mild	SIGMAR1	18	41
C=CC[C@@H](NC(=O)NCC1CCN(Cc2ccncc2)CC1)c1ccncc1	ZINC000853746190	GG	On-Demand	Mild	CACNA1I	59	39
C=CCCC(C)(C)NC(=O)N[C@H](c1ccccc1)C1CCOCC1	ZINC000853746210	EI	On-Demand	Mild	PGA5	42	32
C=CCCC(C)(C)NC(=O)N[C@@H](c1ccccc1)C1CCOCC1	ZINC000853746211	EI	On-Demand	Mild	PGA5	42	32
C=CC[C@@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746212	FG	On-Demand	Mild	ROCK1	17	46
C=CC[C@@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746212	FG	On-Demand	Mild	ROCK2	15	46
C=CC[C@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746213	FG	On-Demand	Mild	ROCK1	17	46
C=CC[C@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746213	FG	On-Demand	Mild	ROCK2	15	46
C=CC[C@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746214	FG	On-Demand	Mild	ROCK1	17	46
C=CC[C@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746214	FG	On-Demand	Mild	ROCK2	15	46
C=CC[C@@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746215	FG	On-Demand	Mild	ROCK1	17	46
C=CC[C@@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccncc1	ZINC000853746215	FG	On-Demand	Mild	ROCK2	15	46
C=CC[C@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1ccncc1	ZINC000853746235	FF	On-Demand	Mild	L3MBTL3	44	37
C=CC[C@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1ccncc1	ZINC000853746236	FF	On-Demand	Mild	L3MBTL3	44	37
COC(=O)c1cc(OCCCCS(C)(=O)=O)ccc1C	ZINC000853746251	DD	On-Demand	Anodyne	FFAR1	17	42
C=CC[C@@H](NC(=O)NC(C)(C)c1cccc(C#N)c1)c1ccncc1	ZINC000853746377	EH	On-Demand	Mild	IMDH_CRYPV	45	34
C=CC[C@H](NC(=O)NC(C)(C)c1cccc(C#N)c1)c1ccncc1	ZINC000853746380	EH	On-Demand	Mild	IMDH_CRYPV	45	34
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000853746382	GF	On-Demand	Anodyne	CTSS	18	41
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000853746386	GF	On-Demand	Anodyne	CTSS	18	41
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000853746388	GF	On-Demand	Anodyne	CTSS	18	41
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000853746389	GF	On-Demand	Anodyne	CTSS	18	41
O=C1CC(C2CCCC2)CC(=O)N1Cc1ccc(Cl)nc1	ZINC000853746425	DG	On-Demand	Anodyne	CHRNA4	22	40
O=C1CC(C2CCCC2)CC(=O)N1Cc1ccc(Cl)nc1	ZINC000853746425	DG	On-Demand	Anodyne	ACHP_LYMST	16	40
O=C1CC(C2CCCC2)CC(=O)N1Cc1ccc(Cl)nc1	ZINC000853746425	DG	On-Demand	Anodyne	Q8WSF8_APLCA	49	40
O=C1CC(C2CCCC2)CC(=O)N1Cc1ccc(Cl)nc1	ZINC000853746425	DG	On-Demand	Anodyne	NACHRBETA2	61	40
Cc1ccc(NC(=O)c2ccc(N3CCC4=C(CCC(=O)N4)C3)nc2)cc1	ZINC000853746496	FG	On-Demand	Anodyne	PRNP	51	38
Cc1ccc(NC(=O)c2ccc(N3CCC4=C(CCC(=O)N4)C3)nc2)cc1	ZINC000853746496	FG	On-Demand	Anodyne	HDAC1	19	40
O=C1CCC2=C(CCN(c3ccc(C(=O)Nc4cccc(Cl)c4)cn3)C2)N1	ZINC000853746543	GG	On-Demand	Anodyne	TAAR1	28	43
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000853746544	GD	On-Demand	Anodyne	P2RY12	139	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C)c(C(=O)OC)c2)CC1	ZINC000853746547	GD	On-Demand	Anodyne	P2RY12	139	42
C=CC[C@H](NC(=O)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1)c1ccncc1	ZINC000853746550	GD	On-Demand	Mild	TGM2	48	33
C=CC[C@H](NC(=O)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1)c1ccncc1	ZINC000853746550	GD	On-Demand	Mild	F13A1	54	33
COC(=O)c1cc(OCCCCCCO)ccc1C	ZINC000853746629	CF	On-Demand	Anodyne	MTNR1A	34	40
COC(=O)c1cc(OCCCCCCO)ccc1C	ZINC000853746629	CF	On-Demand	Anodyne	MTNR1B	31	40
COC(=O)c1cc(OCCCCCCO)ccc1C	ZINC000853746629	CF	On-Demand	Anodyne	PLA2G4B	86	36
O=C(CN1C(=O)CC(C2CCCC2)CC1=O)Nc1ccc(N2CCCC2)cc1	ZINC000853746674	GG	On-Demand	Anodyne	KCNQ2	29	42
O=C1CCC2=C(CCN(c3ncc(C(F)(F)F)s3)C2)N1	ZINC000853746701	DF	On-Demand	Anodyne	MLYCD	61	36
O=C(N[C@H](c1ccccc1)C1CCOCC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853746904	GE	On-Demand	Anodyne	L3MBTL3	48	33
O=C(N[C@H](c1ccccc1)C1CCOCC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853746905	GE	On-Demand	Anodyne	L3MBTL3	48	33
O=C(N[C@@H](c1ccccc1)C1CCOCC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853746906	GE	On-Demand	Anodyne	L3MBTL3	48	33
O=C(N[C@@H](c1ccccc1)C1CCOCC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853746907	GE	On-Demand	Anodyne	L3MBTL3	48	33
C=CC[C@H](NC(=O)N1CCc2cc(OC)ccc2C1)c1ccncc1	ZINC000853746920	EG	On-Demand	Mild	MAPK1	43	35
C=CC[C@@H](NC(=O)N1CCc2cc(OC)ccc2C1)c1ccncc1	ZINC000853746921	EG	On-Demand	Mild	MAPK1	43	35
C=CC[C@H](NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1)c1ccncc1	ZINC000853746956	GJ	On-Demand	Mild	ROCK2	18	42
C=CC[C@@H](NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1)c1ccncc1	ZINC000853746957	GJ	On-Demand	Mild	ROCK2	18	42
COC[C@H](NC(=O)N[C@H](c1ccccc1)C1CCOCC1)c1cccc(OC)c1	ZINC000853747035	GH	On-Demand	Anodyne	CASR	16	41
COC[C@@H](NC(=O)N[C@H](c1ccccc1)C1CCOCC1)c1cccc(OC)c1	ZINC000853747037	GH	On-Demand	Anodyne	CASR	16	41
CN1CCN(c2nc3ccccc3nc2N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853747038	GD	On-Demand	Anodyne	HTR3A	23	47
CN1CCN(c2nc3ccccc3nc2N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853747038	GD	On-Demand	Anodyne	HRH4	15	47
COC[C@H](NC(=O)N[C@@H](c1ccccc1)C1CCOCC1)c1cccc(OC)c1	ZINC000853747039	GH	On-Demand	Anodyne	CASR	16	41
COC[C@@H](NC(=O)N[C@@H](c1ccccc1)C1CCOCC1)c1cccc(OC)c1	ZINC000853747041	GH	On-Demand	Anodyne	CASR	16	41
O=C(CN1C(=O)CC(C2CCCC2)CC1=O)Nc1ccc(N2CCCCC2)cc1	ZINC000853747068	GH	On-Demand	Anodyne	KCNQ2	26	41
C=CC[C@H](NC(=O)N1CCc2ccc(Cl)c(Cl)c2C1)c1ccncc1	ZINC000853747081	GJ	On-Demand	Mild	MAPK1	44	37
C=CC[C@@H](NC(=O)N1CCc2ccc(Cl)c(Cl)c2C1)c1ccncc1	ZINC000853747087	GJ	On-Demand	Mild	MAPK1	44	37
CCOC(=O)N1CCN(C(=O)[C@H](C)N2C(=O)CC(C3CCCC3)CC2=O)CC1	ZINC000853747121	GD	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2C(=O)CC(C3CCCC3)CC2=O)CC1	ZINC000853747124	GD	On-Demand	Anodyne	P2RY12	44	35
C=CC[C@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1ccncc1	ZINC000853747164	EF	On-Demand	Mild	CPT1A	41	36
C=CC[C@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1ccncc1	ZINC000853747167	EF	On-Demand	Mild	CPT1A	41	36
C=CC[C@H](NC(=O)N1CCc2ccc(C)cc2C1)c1ccncc1	ZINC000853747169	DH	On-Demand	Mild	MAPK1	44	35
C=CC[C@@H](NC(=O)N1CCc2ccc(C)cc2C1)c1ccncc1	ZINC000853747170	DH	On-Demand	Mild	MAPK1	44	35
O=C1CC(C2CCCC2)CC(=O)N1Cc1nc2ccccc2s1	ZINC000853747384	EH	On-Demand	Anodyne	AKR1B1	26	44
O=C(N[C@H](c1ccccc1)C1CCOCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853747396	GI	On-Demand	Anodyne	EPHX2	21	44
O=C(N[C@H](c1ccccc1)C1CCOCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853747396	GI	On-Demand	Anodyne	TTK	15	45
O=C(N[C@@H](c1ccccc1)C1CCOCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853747399	GI	On-Demand	Anodyne	EPHX2	21	44
O=C(N[C@@H](c1ccccc1)C1CCOCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853747399	GI	On-Demand	Anodyne	TTK	15	45
O=C(N[C@@H](c1ccccc1)C1CCOCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853747411	FG	On-Demand	Anodyne	CPT1A	117	42
O=C(N[C@H](c1ccccc1)C1CCOCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853747413	FG	On-Demand	Anodyne	CPT1A	117	42
O=C(N[C@@H](c1ccccc1)C1CCOCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853747415	FG	On-Demand	Anodyne	CPT1A	117	42
O=C(N[C@H](c1ccccc1)C1CCOCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853747417	FG	On-Demand	Anodyne	CPT1A	117	42
O=C(N[C@@H](c1ccccc1)C1CCOCC1)N1CCC(O)(CO)CC1	ZINC000853747453	ED	On-Demand	Anodyne	CTSS	22	43
O=C(N[C@H](c1ccccc1)C1CCOCC1)N1CCC(O)(CO)CC1	ZINC000853747454	ED	On-Demand	Anodyne	CTSS	22	43
CC(C)(C)N1CC[C@@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853747474	DE	On-Demand	Bother	GSTM2	115	47
CC(C)(C)N1CC[C@@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853747474	DE	On-Demand	Bother	GSTP1	70	47
CC(C)(C)N1CC[C@@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853747474	DE	On-Demand	Bother	EPAS1	61	33
CC(C)(C)N1CC[C@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853747475	DE	On-Demand	Bother	GSTM2	115	47
CC(C)(C)N1CC[C@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853747475	DE	On-Demand	Bother	GSTP1	70	47
CC(C)(C)N1CC[C@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853747475	DE	On-Demand	Bother	EPAS1	61	33
C=CC[C@H](NC(=O)N1CCc2ccc(C(C)C)cc2C1)c1ccncc1	ZINC000853747581	EJ	On-Demand	Mild	MAPK1	49	37
C=CC[C@@H](NC(=O)N1CCc2ccc(C(C)C)cc2C1)c1ccncc1	ZINC000853747582	EJ	On-Demand	Mild	MAPK1	49	37
CCN1CC[C@H](N(CC)C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747663	FG	On-Demand	Anodyne	CASR	43	36
CCN1CC[C@H](N(CC)C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747663	FG	On-Demand	Anodyne	CCR5	56	48
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747664	FG	On-Demand	Anodyne	CASR	43	36
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747664	FG	On-Demand	Anodyne	CCR5	56	48
CCN1CC[C@H](N(CC)C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747665	FG	On-Demand	Anodyne	CASR	43	36
CCN1CC[C@H](N(CC)C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747665	FG	On-Demand	Anodyne	CCR5	56	48
CCN1CC[C@@H](N(CC)C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747666	FG	On-Demand	Anodyne	CASR	43	36
CCN1CC[C@@H](N(CC)C(=O)N[C@H](c2ccccc2)C2CCOCC2)C1	ZINC000853747666	FG	On-Demand	Anodyne	CCR5	56	48
C=CC[C@H](NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747686	FF	On-Demand	Mild	PYGL	33	45
C=CC[C@H](NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747686	FF	On-Demand	Mild	PYGM	29	45
C=CC[C@@H](NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747687	FF	On-Demand	Mild	PYGL	33	45
C=CC[C@@H](NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747687	FF	On-Demand	Mild	PYGM	29	45
C=CC[C@H](NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747688	FF	On-Demand	Mild	PYGL	33	45
C=CC[C@H](NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747688	FF	On-Demand	Mild	PYGM	29	45
C=CC[C@@H](NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747689	FF	On-Demand	Mild	PYGL	33	45
C=CC[C@@H](NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)c1ccncc1	ZINC000853747689	FF	On-Demand	Mild	PYGM	29	45
C=CC[C@H](NC(=O)N(CCN1CCOCC1)CC1CC1)c1ccncc1	ZINC000853747709	FE	On-Demand	Mild	CASR	55	43
C=CC[C@H](NC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1)c1ccncc1	ZINC000853747755	FF	On-Demand	Mild	CPT1A	52	35
C=CC[C@H](NC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1)c1ccncc1	ZINC000853747757	FF	On-Demand	Mild	CPT1A	52	35
C=CC[C@@H](NC(=O)NCc1cccnc1N1CCCC1)c1ccncc1	ZINC000853747839	FG	On-Demand	Mild	SCN2A	19	45
C=CC[C@@H](NC(=O)NCc1cccnc1N1CCCC1)c1ccncc1	ZINC000853747839	FG	On-Demand	Mild	SCN10A	19	45
C=CC[C@H](NC(=O)NCc1cccnc1N1CCCC1)c1ccncc1	ZINC000853747840	FG	On-Demand	Mild	SCN2A	19	45
C=CC[C@H](NC(=O)NCc1cccnc1N1CCCC1)c1ccncc1	ZINC000853747840	FG	On-Demand	Mild	SCN10A	19	45
C#CCNC(=O)c1ccc(NC[C@@H]2CCN2C(C)(C)C)nc1	ZINC000853747849	DD	On-Demand	Mild	CACNA1I	45	33
C#CCNC(=O)c1ccc(NC[C@H]2CCN2C(C)(C)C)nc1	ZINC000853747850	DD	On-Demand	Mild	CACNA1I	45	33
CC(C)(C)OC(=O)N1CCC(CCn2ncc(C(F)(F)F)cc2=O)CC1	ZINC000853747907	GG	On-Demand	Anodyne	GPR119	54	47
Cn1ncnc1N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853747913	EF	On-Demand	Anodyne	GPR119	46	53
Cn1ncnc1N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853747914	EF	On-Demand	Anodyne	GPR119	46	53
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc(C#N)nn3)C2)CC1	ZINC000853747923	FG	On-Demand	Mild	GPR119	50	56
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc(C#N)nn3)C2)CC1	ZINC000853747924	FG	On-Demand	Mild	GPR119	50	56
COCc1cc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)ncn1	ZINC000853747930	GG	On-Demand	Anodyne	GPR119	47	55
COCc1cc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)ncn1	ZINC000853747931	GG	On-Demand	Anodyne	GPR119	47	55
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cccc(C#N)n3)C2)CC1	ZINC000853747938	FH	On-Demand	Mild	GPR119	45	57
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cccc(C#N)n3)C2)CC1	ZINC000853747939	FH	On-Demand	Mild	GPR119	45	57
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cc(CO)c(F)cn3)C2)CC1	ZINC000853747940	GH	On-Demand	Anodyne	GPR119	55	49
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cc(CO)c(F)cn3)C2)CC1	ZINC000853747941	GH	On-Demand	Anodyne	GPR119	55	49
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc(C#N)c(N)n3)C2)CC1	ZINC000853747945	GG	On-Demand	Mild	GPR119	42	55
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc(C#N)c(N)n3)C2)CC1	ZINC000853747946	GG	On-Demand	Mild	GPR119	42	55
Cc1cncc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853747953	FH	On-Demand	Anodyne	GPR119	47	56
Cc1cncc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853747954	FH	On-Demand	Anodyne	GPR119	47	56
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3nccn4nnnc34)C2)CC1	ZINC000853747960	GE	On-Demand	Anodyne	GPR119	36	49
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3nccn4nnnc34)C2)CC1	ZINC000853747961	GE	On-Demand	Anodyne	GPR119	36	49
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3nccc(CO)n3)C2)CC1	ZINC000853747974	GF	On-Demand	Anodyne	GPR119	52	56
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3nccc(CO)n3)C2)CC1	ZINC000853747975	GF	On-Demand	Anodyne	GPR119	52	56
C=CC[C@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)c1ccncc1	ZINC000853747977	EH	On-Demand	Mild	EPHX2	18	46
C=CC[C@@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)c1ccncc1	ZINC000853747978	EH	On-Demand	Mild	EPHX2	18	46
Cc1nsc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853747979	FH	On-Demand	Anodyne	GPR119	33	48
Cc1nsc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853747980	FH	On-Demand	Anodyne	GPR119	33	48
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ccc3nccnc3c2=O)C1	ZINC000853747990	EE	On-Demand	Anodyne	GPR119	46	43
CC(C)(C)OC(=O)N1CC[C@H](CCn2ccc3nccnc3c2=O)C1	ZINC000853747991	EE	On-Demand	Anodyne	GPR119	46	43
CCCCCCCCn1ncc(C(F)(F)F)cc1=O	ZINC000853748000	CH	On-Demand	Mild	EST1_PIG	49	34
Cc1cc(C#N)nc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853748007	GH	On-Demand	Mild	GPR119	42	61
Cc1cc(C#N)nc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853748008	GH	On-Demand	Mild	GPR119	42	61
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cccnn3)C2)CC1	ZINC000853748020	EG	On-Demand	Anodyne	GPR119	52	59
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cccnn3)C2)CC1	ZINC000853748021	EG	On-Demand	Anodyne	GPR119	52	59
CCCCCCn1ncc(C(F)(F)F)cc1=O	ZINC000853748032	BF	On-Demand	Anodyne	EST1_PIG	49	34
N#Cc1ccc(OCCCn2nnc3c2CCCC3)cc1	ZINC000853748033	CE	On-Demand	Mild	HRH3	36	44
N#Cc1ccc(OCCCn2nnc3c2CCCC3)cc1	ZINC000853748033	CE	On-Demand	Mild	MEN1	43	41
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc(C#N)cn3)C2)CC1	ZINC000853748038	FH	On-Demand	Mild	GPR119	61	56
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc(C#N)cn3)C2)CC1	ZINC000853748039	FH	On-Demand	Mild	GPR119	61	56
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccncc3C(N)=O)C2)CC1	ZINC000853748046	GG	On-Demand	Anodyne	GPR119	47	52
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccncc3C(N)=O)C2)CC1	ZINC000853748047	GG	On-Demand	Anodyne	GPR119	47	52
COC1CC(CCNc2ccc([N+](=O)[O-])cc2C(C)=O)C1	ZINC000853748057	CG	On-Demand	Bother	KCNMA1	19	40
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cc(C#N)ncn3)C2)CC1	ZINC000853748061	FG	On-Demand	Mild	GPR119	50	81
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cc(C#N)ncn3)C2)CC1	ZINC000853748062	FG	On-Demand	Mild	GPR119	50	81
O=C1c2ccccc2C(=O)N1OCCCn1ncc(C(F)(F)F)cc1=O	ZINC000853748063	FD	On-Demand	Anodyne	GALR3	83	37
Cc1cc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc(N)n1	ZINC000853748073	GG	On-Demand	Anodyne	HRH4	42	34
Cc1cc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc(N)n1	ZINC000853748073	GG	On-Demand	Anodyne	GPR119	38	59
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cc(C#N)cnn3)C2)CC1	ZINC000853748084	FG	On-Demand	Mild	GPR119	47	55
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cc(C#N)cnn3)C2)CC1	ZINC000853748085	FG	On-Demand	Mild	GPR119	47	55
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cnnc(O)c3Cl)C2)CC1	ZINC000853748088	GH	On-Demand	Anodyne	GPR119	40	47
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cnnc(O)c3Cl)C2)CC1	ZINC000853748089	GH	On-Demand	Anodyne	GPR119	40	47
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cncc(C#N)n3)C2)CC1	ZINC000853748094	FG	On-Demand	Mild	GPR119	45	57
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cncc(C#N)n3)C2)CC1	ZINC000853748095	FG	On-Demand	Mild	GPR119	45	57
COc1ccc(N2CCN(C(=O)Cn3ncc(C(F)(F)F)cc3=O)CC2)cc1	ZINC000853748117	GD	On-Demand	Clean	PLA2G7	22	41
COc1ccc(N2CCN(C(=O)Cn3ncc(C(F)(F)F)cc3=O)CC2)cc1	ZINC000853748117	GD	On-Demand	Clean	CCR1	31	49
COc1ccc(N2CCN(C(=O)Cn3ncc(C(F)(F)F)cc3=O)CC2)cc1	ZINC000853748117	GD	On-Demand	Clean	NPBWR1	41	40
c1ccc2sc(Cn3nnc4c3CCCC4)nc2c1	ZINC000853748122	CF	On-Demand	Anodyne	AKR1B1	22	41
Cn1cnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1=O	ZINC000853748123	GF	On-Demand	Anodyne	GPR119	46	50
Cn1cnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)cc1=O	ZINC000853748124	GF	On-Demand	Anodyne	GPR119	46	50
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cncc4ncnn34)C2)CC1	ZINC000853748142	GF	On-Demand	Anodyne	GPR119	41	49
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cncc4ncnn34)C2)CC1	ZINC000853748143	GF	On-Demand	Anodyne	GPR119	41	49
CC(=O)c1ccnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	ZINC000853748153	GI	On-Demand	Anodyne	GPR119	50	56
CC(=O)c1ccnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1	ZINC000853748156	GI	On-Demand	Anodyne	GPR119	50	56
Cc1nnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c(C#N)c1C	ZINC000853748158	GH	On-Demand	Mild	GPR119	30	48
Cc1nnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c(C#N)c1C	ZINC000853748160	GH	On-Demand	Mild	GPR119	30	48
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cc(F)ncn3)C2)CC1	ZINC000853748164	FG	On-Demand	Anodyne	GPR119	59	58
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cc(F)ncn3)C2)CC1	ZINC000853748249	FG	On-Demand	Anodyne	GPR119	59	58
CC(C)(C)OC(=O)N1CC[C@H](CCn2nnc3c2CCCC3)C1	ZINC000853748252	DF	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CCn2nnc3c2CCCC3)C1	ZINC000853748253	DF	On-Demand	Anodyne	GPR119	32	42
O=C(Cn1ncc(C(F)(F)F)cc1=O)NC1CCCCCCC1	ZINC000853748257	EE	On-Demand	Anodyne	CCR2	43	37
O=C(Cn1ncc(C(F)(F)F)cc1=O)NC1CCCCCCC1	ZINC000853748257	EE	On-Demand	Anodyne	EPHX2	18	41
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cc(C#N)ccn3)C2)CC1	ZINC000853748289	FH	On-Demand	Mild	GPR119	54	59
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cc(C#N)ccn3)C2)CC1	ZINC000853748290	FH	On-Demand	Mild	GPR119	54	59
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3nnc(C4CC4)o3)C2)CC1	ZINC000853748294	GH	On-Demand	Anodyne	GPR119	28	47
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3nnc(C4CC4)o3)C2)CC1	ZINC000853748295	GH	On-Demand	Anodyne	GPR119	28	47
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccncc3C#N)C2)CC1	ZINC000853748301	FH	On-Demand	Mild	GPR119	59	52
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccncc3C#N)C2)CC1	ZINC000853748302	FH	On-Demand	Mild	GPR119	59	52
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncc(F)cn3)C2)CC1	ZINC000853748303	FG	On-Demand	Anodyne	GPR119	60	60
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncc(F)cn3)C2)CC1	ZINC000853748304	FG	On-Demand	Anodyne	GPR119	60	60
Cn1cnc([N+](=O)[O-])c1N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853748311	GG	On-Demand	Bother	GPR119	45	48
Cn1cnc([N+](=O)[O-])c1N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853748312	GG	On-Demand	Bother	GPR119	45	48
CC(C)(C)OC(=O)N1CC[C@H](CCn2ncc(C(F)(F)F)cc2=O)C1	ZINC000853748319	FF	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ncc(C(F)(F)F)cc2=O)C1	ZINC000853748320	FF	On-Demand	Anodyne	GPR119	43	43
C#Cc1cnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc1	ZINC000853748341	FG	On-Demand	Mild	GPR119	53	56
C#Cc1cnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc1	ZINC000853748342	FG	On-Demand	Mild	GPR119	53	56
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncc(C#N)cc3F)C2)CC1	ZINC000853748353	GH	On-Demand	Mild	GPR119	58	54
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncc(C#N)cc3F)C2)CC1	ZINC000853748355	GH	On-Demand	Mild	GPR119	58	54
O=C(Cn1ccc2nccnc2c1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748372	FD	On-Demand	Anodyne	PIK3CA	30	41
O=C(Cn1ccc2nccnc2c1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748372	FD	On-Demand	Anodyne	MAPKAPK5	44	36
O=C(Cn1ccc2nccnc2c1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748372	FD	On-Demand	Anodyne	MTOR	50	40
O=C(Cn1ccc2nccnc2c1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748372	FD	On-Demand	Anodyne	PIK3CG	27	40
O=C(Cn1ccc2nccnc2c1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748372	FD	On-Demand	Anodyne	EPHB4	47	32
O=C(Cn1ccc2nccnc2c1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748372	FD	On-Demand	Anodyne	STAT6	62	33
CC(C)(C)OC(=O)N1CCC(Cn2ccc3nccnc3c2=O)CC1	ZINC000853748385	EE	On-Demand	Anodyne	GPR119	50	46
CCCCCCCCn1ccc2nccnc2c1=O	ZINC000853748413	CG	On-Demand	Mild	PLA2G4B	50	31
COc1ccc2c(NCCC3CC(OC)C3)ccnc2c1	ZINC000853748437	CG	On-Demand	Anodyne	HRP1_PLAFA	125	46
COc1ccc2c(NCCC3CC(OC)C3)ccnc2c1	ZINC000853748437	CG	On-Demand	Anodyne	HNMT	64	40
COc1ccc2c(NCCC3CC(OC)C3)ccnc2c1	ZINC000853748437	CG	On-Demand	Anodyne	BOTA	35	42
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2ccc3nccnc3c2=O)CC1	ZINC000853748441	FG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)N1CCC(Cn2ncc(C(F)(F)F)cc2=O)CC1	ZINC000853748455	FF	On-Demand	Anodyne	GPR119	50	43
CC(C)(C)OC(=O)N1CCC(Cn2ncc(C(F)(F)F)cc2=O)CC1	ZINC000853748455	FF	On-Demand	Anodyne	SFRP1	28	42
C=CC[C@@H](NC(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1)c1ccncc1	ZINC000853748461	GH	On-Demand	Mild	SSTR3	28	43
C=CC[C@H](NC(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1)c1ccncc1	ZINC000853748462	GH	On-Demand	Mild	SSTR3	28	43
N#Cc1ccc(OCCCn2ncc(C(F)(F)F)cc2=O)cc1	ZINC000853748469	DF	On-Demand	Mild	GALR3	40	32
N#Cc1ccc(OCCCn2ncc(C(F)(F)F)cc2=O)cc1	ZINC000853748469	DF	On-Demand	Mild	MEN1	42	41
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncc([N+](=O)[O-])cn3)C2)CC1	ZINC000853748471	GG	On-Demand	Bother	GPR119	54	56
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncc([N+](=O)[O-])cn3)C2)CC1	ZINC000853748472	GG	On-Demand	Bother	GPR119	54	56
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc4nncn4n3)C2)CC1	ZINC000853748482	GF	On-Demand	Anodyne	GPR119	38	48
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc4nncn4n3)C2)CC1	ZINC000853748483	GF	On-Demand	Anodyne	GPR119	38	48
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cccnc3C#N)C2)CC1	ZINC000853748490	FH	On-Demand	Mild	GPR119	50	55
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cccnc3C#N)C2)CC1	ZINC000853748491	FH	On-Demand	Mild	GPR119	50	55
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cnc(F)cn3)C2)CC1	ZINC000853748492	FG	On-Demand	Anodyne	GPR119	54	56
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cnc(F)cn3)C2)CC1	ZINC000853748493	FG	On-Demand	Anodyne	GPR119	54	56
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc4nnnn4n3)C2)CC1	ZINC000853748506	GE	On-Demand	Anodyne	GPR119	39	48
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc4nnnn4n3)C2)CC1	ZINC000853748507	GE	On-Demand	Anodyne	GPR119	39	48
Cn1nnnc1N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853748508	FE	On-Demand	Anodyne	GPR119	32	48
Cn1nnnc1N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853748509	FE	On-Demand	Anodyne	GPR119	32	48
Cc1cc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)ncn1	ZINC000853748512	FH	On-Demand	Anodyne	GPR119	60	59
Cn1ncc2c(N3CCC[C@H](C4CCN(C(=O)OC(C)(C)C)CC4)C3)ccnc21	ZINC000853748518	GH	On-Demand	Anodyne	GPR119	47	48
Cn1ncc2c(N3CCC[C@@H](C4CCN(C(=O)OC(C)(C)C)CC4)C3)ccnc21	ZINC000853748519	GH	On-Demand	Anodyne	GPR119	47	48
C=CC[C@H](NC(=O)NCC1CCN(CC2CC2)CC1)c1ccncc1	ZINC000853748521	EG	On-Demand	Mild	CACNA1I	45	32
C=CC[C@@H](NC(=O)NCC1CCN(CC2CC2)CC1)c1ccncc1	ZINC000853748522	EG	On-Demand	Mild	CACNA1I	45	32
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncc(C(F)F)cn3)C2)CC1	ZINC000853748554	GI	On-Demand	Anodyne	GPR119	56	56
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncc(C(F)F)cn3)C2)CC1	ZINC000853748557	GI	On-Demand	Anodyne	GPR119	56	56
CCCCCCn1ccc2nccnc2c1=O	ZINC000853748594	BE	On-Demand	Anodyne	PLA2G4B	50	31
CC(C)(C)OC(=O)N1CCC(CCn2nnc3c2CCCC3)CC1	ZINC000853748656	EG	On-Demand	Anodyne	GPR119	43	46
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncccn3)C2)CC1	ZINC000853748659	EG	On-Demand	Anodyne	GPR119	59	78
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncccn3)C2)CC1	ZINC000853748660	EG	On-Demand	Anodyne	GPR119	59	78
Cc1ccc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nn1	ZINC000853748676	FH	On-Demand	Anodyne	GPR119	52	56
Cc1ccc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nn1	ZINC000853748677	FH	On-Demand	Anodyne	GPR119	52	56
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncnc4n[nH]cc34)C2)CC1	ZINC000853748682	GG	On-Demand	Anodyne	GPR119	39	48
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncnc4n[nH]cc34)C2)CC1	ZINC000853748683	GG	On-Demand	Anodyne	GPR119	39	48
CC(C)c1nnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)o1	ZINC000853748689	GI	On-Demand	Anodyne	GPR119	29	47
CC(C)c1nnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)o1	ZINC000853748690	GI	On-Demand	Anodyne	GPR119	29	47
Cn1ccnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1=O	ZINC000853748691	GF	On-Demand	Anodyne	GPR119	45	55
Cn1ccnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)c1=O	ZINC000853748692	GF	On-Demand	Anodyne	GPR119	45	55
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc(Cl)nn3)C2)CC1	ZINC000853748705	GH	On-Demand	Anodyne	GPR119	53	51
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc(Cl)nn3)C2)CC1	ZINC000853748706	GH	On-Demand	Anodyne	GPR119	53	51
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccnc(C(N)=O)c3)C2)CC1	ZINC000853748711	GG	On-Demand	Anodyne	GPR119	52	55
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccnc(C(N)=O)c3)C2)CC1	ZINC000853748712	GG	On-Demand	Anodyne	GPR119	52	55
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncnc4[nH]cnc34)C2)CC1	ZINC000853748724	GG	On-Demand	Anodyne	GPR119	41	48
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncnc4[nH]cnc34)C2)CC1	ZINC000853748725	GG	On-Demand	Anodyne	GPR119	41	48
Cc1nnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc1C	ZINC000853748726	GG	On-Demand	Anodyne	GPR119	39	52
Cc1nnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc1C	ZINC000853748727	GG	On-Demand	Anodyne	GPR119	39	52
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc3nccnc3c2=O)CC1	ZINC000853748744	FC	On-Demand	Anodyne	P2RY12	45	35
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc3nccnc3c2=O)CC1	ZINC000853748745	FC	On-Demand	Anodyne	P2RY12	45	35
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000853748770	DD	On-Demand	Anodyne	CTSD	16	41
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000853748770	DD	On-Demand	Anodyne	CTSK	18	44
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000853748770	DD	On-Demand	Anodyne	ECE1	30	41
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000853748770	DD	On-Demand	Anodyne	PGA5	22	40
COC1CC(CCNc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853748802	CE	On-Demand	Bother	GSTM2	121	45
COC1CC(CCNc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853748802	CE	On-Demand	Bother	GSTP1	75	44
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc4nccnc4n3)C2)CC1	ZINC000853748921	GH	On-Demand	Anodyne	GPR119	46	55
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc4nccnc4n3)C2)CC1	ZINC000853748922	GH	On-Demand	Anodyne	GPR119	46	55
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncc(C(F)(F)F)cc2=O)CC1	ZINC000853748923	GD	On-Demand	Anodyne	P2RY12	54	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncc(C(F)(F)F)cc2=O)CC1	ZINC000853748924	GD	On-Demand	Anodyne	P2RY12	54	37
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc(C(N)=O)nn3)C2)CC1	ZINC000853748926	GE	On-Demand	Anodyne	SCD1	17	40
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc(C(N)=O)nn3)C2)CC1	ZINC000853748926	GE	On-Demand	Anodyne	GPR119	48	53
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc(C(N)=O)nn3)C2)CC1	ZINC000853748927	GE	On-Demand	Anodyne	SCD1	17	40
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc(C(N)=O)nn3)C2)CC1	ZINC000853748927	GE	On-Demand	Anodyne	GPR119	48	53
Cc1ccc(OCCn2ncc(C(F)(F)F)cc2=O)cc1	ZINC000853748929	CF	On-Demand	Anodyne	HTR3A	16	40
Cc1ccc(OCCn2ncc(C(F)(F)F)cc2=O)cc1	ZINC000853748929	CF	On-Demand	Anodyne	GALR3	55	34
Cc1nnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)s1	ZINC000853748941	FH	On-Demand	Anodyne	GPR119	34	48
Cc1nnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)s1	ZINC000853748942	FH	On-Demand	Anodyne	GPR119	34	48
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncncc3C#N)C2)CC1	ZINC000853748945	FG	On-Demand	Mild	GPR119	52	52
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncncc3C#N)C2)CC1	ZINC000853748946	FG	On-Demand	Mild	GPR119	52	52
CC(C)(C)OC(=O)N1CCC(CCCn2ncc(C(F)(F)F)cc2=O)CC1	ZINC000853748950	GH	On-Demand	Anodyne	GPR119	55	49
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3nccn4cnnc34)C2)CC1	ZINC000853748970	GF	On-Demand	Anodyne	GPR119	33	49
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3nccn4cnnc34)C2)CC1	ZINC000853748971	GF	On-Demand	Anodyne	GPR119	33	49
Cn1ncc(C#N)c1N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853748976	FG	On-Demand	Mild	GPR119	40	48
Cn1ncc(C#N)c1N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853748977	FG	On-Demand	Mild	GPR119	40	48
CC(=O)c1ccc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc1	ZINC000853748980	GI	On-Demand	Anodyne	GPR119	57	59
CC(=O)c1ccc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)nc1	ZINC000853748981	GI	On-Demand	Anodyne	GPR119	57	59
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cnccc3C#N)C2)CC1	ZINC000853748982	FH	On-Demand	Mild	GPR119	57	52
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cnccc3C#N)C2)CC1	ZINC000853748983	FH	On-Demand	Mild	GPR119	57	52
CC(C)(C)OC(=O)N1CCC(CCCn2ccc3nccnc3c2=O)CC1	ZINC000853748989	FG	On-Demand	Anodyne	GPR119	52	46
Cc1nnc(N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)o1	ZINC000853748990	FG	On-Demand	Anodyne	GPR119	35	49
Cc1nnc(N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)o1	ZINC000853748991	FG	On-Demand	Anodyne	GPR119	35	49
O=C(Cn1ncc(C(F)(F)F)cc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748997	GD	On-Demand	Anodyne	MTOR	60	39
O=C(Cn1ncc(C(F)(F)F)cc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748997	GD	On-Demand	Anodyne	EPHX2	25	41
O=C(Cn1ncc(C(F)(F)F)cc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748997	GD	On-Demand	Anodyne	PIK3CB	18	42
O=C(Cn1ncc(C(F)(F)F)cc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748997	GD	On-Demand	Anodyne	STAT6	61	35
O=C(Cn1ncc(C(F)(F)F)cc1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853748997	GD	On-Demand	Anodyne	DGAT1	15	42
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3nc(C(N)=O)cs3)C2)CC1	ZINC000853749001	GG	On-Demand	Anodyne	GPR119	32	49
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3nc(C(N)=O)cs3)C2)CC1	ZINC000853749002	GG	On-Demand	Anodyne	GPR119	32	49
COC1CC(CCNc2nccc(N3CCCC3)n2)C1	ZINC000853749026	CE	On-Demand	Anodyne	SORD	59	36
COC1CC(CCNc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853749056	EH	On-Demand	Anodyne	PKN2	17	42
CCOCCCN1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)[C@@H](C)C1	ZINC000853749071	FF	On-Demand	Reactive	CCR3	42	39
CCOCCCN1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)[C@H](C)C1	ZINC000853749072	FF	On-Demand	Reactive	CCR3	42	39
CCOCCCN1CC[C@H](NC(=O)NNc2cc(F)ccc2C)[C@@H](C)C1	ZINC000853749073	FF	On-Demand	Reactive	CCR3	42	39
CCOCCCN1CC[C@H](NC(=O)NNc2cc(F)ccc2C)[C@H](C)C1	ZINC000853749074	FF	On-Demand	Reactive	CCR3	42	39
CC(C)(C)OC(=O)N1CCC(CCn2ccc3nccnc3c2=O)CC1	ZINC000853749090	FF	On-Demand	Anodyne	GPR119	55	48
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccnc(C#N)c3)C2)CC1	ZINC000853749118	FH	On-Demand	Mild	GPR119	52	60
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccnc(C#N)c3)C2)CC1	ZINC000853749119	FH	On-Demand	Mild	GPR119	52	60
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3nnc(C(F)F)o3)C2)CC1	ZINC000853749121	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3nnc(C(F)F)o3)C2)CC1	ZINC000853749122	GH	On-Demand	Anodyne	GPR119	30	46
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cncc(C(N)=O)n3)C2)CC1	ZINC000853749126	GE	On-Demand	Anodyne	GPR119	38	53
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cncc(C(N)=O)n3)C2)CC1	ZINC000853749127	GE	On-Demand	Anodyne	GPR119	38	53
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccnc(C#N)n3)C2)CC1	ZINC000853749153	FG	On-Demand	Mild	GPR119	49	82
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccnc(C#N)n3)C2)CC1	ZINC000853749154	FG	On-Demand	Mild	GPR119	49	82
C=CC[C@H](NC(=O)N1CCC2(CCc3ccccc3O2)CC1)c1ccncc1	ZINC000853749161	GI	On-Demand	Mild	SCD1	15	41
C=CC[C@H](NC(=O)N1CCC2(CCc3ccccc3O2)CC1)c1ccncc1	ZINC000853749161	GI	On-Demand	Mild	SCD	30	41
C=CC[C@H](NC(=O)N1CCC2(CCc3ccccc3O2)CC1)c1ccncc1	ZINC000853749161	GI	On-Demand	Mild	TRPM8	15	48
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ccc(C#N)nc3)C2)CC1	ZINC000853749166	FH	On-Demand	Mild	GPR119	59	56
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ccc(C#N)nc3)C2)CC1	ZINC000853749167	FH	On-Demand	Mild	GPR119	59	56
Fc1cccc(OCCn2nnc3c2CCCC3)c1	ZINC000853749178	CE	On-Demand	Anodyne	CHRNA10	33	41
C=CC[C@H](NC(=O)N1CCc2nccnc2C1)c1ccncc1	ZINC000853749179	DE	On-Demand	Mild	MAPK1	45	35
C=CC[C@@H](NC(=O)N1CCc2nccnc2C1)c1ccncc1	ZINC000853749180	DE	On-Demand	Mild	MAPK1	45	35
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncc([N+](=O)[O-])s3)C2)CC1	ZINC000853749182	GH	On-Demand	Bother	GPR119	48	48
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncc([N+](=O)[O-])s3)C2)CC1	ZINC000853749183	GH	On-Demand	Bother	GPR119	48	48
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3nccnc3C#N)C2)CC1	ZINC000853749194	FG	On-Demand	Mild	GPR119	47	54
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3nccnc3C#N)C2)CC1	ZINC000853749195	FG	On-Demand	Mild	GPR119	47	54
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cnc(C#N)cn3)C2)CC1	ZINC000853749198	FG	On-Demand	Mild	GPR119	52	59
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cnc(C#N)cn3)C2)CC1	ZINC000853749199	FG	On-Demand	Mild	GPR119	52	59
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3cnccn3)C2)CC1	ZINC000853749212	EG	On-Demand	Anodyne	GPR119	52	80
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3cnccn3)C2)CC1	ZINC000853749213	EG	On-Demand	Anodyne	GPR119	52	80
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(c3ncccc3C#N)C2)CC1	ZINC000853749224	FH	On-Demand	Mild	GPR119	54	55
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(c3ncccc3C#N)C2)CC1	ZINC000853749225	FH	On-Demand	Mild	GPR119	54	55
COC1CC(CCNc2nn3cc(-c4ccccc4)nc3s2)C1	ZINC000853749311	EH	On-Demand	Anodyne	VCP	54	36
O=C(N[C@@H]1CCN(CCN2CCOCC2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853749331	FC	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000853749332	FC	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@@H]1CCN(CCN2CCOCC2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853749333	FC	On-Demand	Anodyne	DRD4	18	40
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000853749334	FC	On-Demand	Anodyne	DRD4	18	40
CC[C@H](C)N(CC)C(=O)NC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000853749376	EG	On-Demand	Anodyne	CTSK	18	43
CC[C@H](C)N(CC)C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000853749378	EG	On-Demand	Anodyne	CTSK	18	43
COC1CC(CCNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1	ZINC000853749406	EF	On-Demand	Bother	KCNMA1	19	40
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000853749576	GD	On-Demand	Reactive	CACNA1H	20	42
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCN(CCN2CCOCC2)C1	ZINC000853749576	GD	On-Demand	Reactive	EPHX2	23	43
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000853749577	GD	On-Demand	Reactive	CACNA1H	20	42
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCN(CCN2CCOCC2)C1	ZINC000853749577	GD	On-Demand	Reactive	EPHX2	23	43
CCCCCCCCCn1ccc2nccnc2c1=O	ZINC000853749678	CH	On-Demand	Mild	PLA2G4B	50	31
CC(C)(C)OC(=O)N1CC[C@H](CCn2ncc(Cl)c2C2CC2)C1	ZINC000853749719	EI	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ncc(Cl)c2C2CC2)C1	ZINC000853749720	EI	On-Demand	Anodyne	GPR119	39	42
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853749726	GF	On-Demand	Anodyne	EPHX2	18	40
Fc1cccc(OCCn2ncc(Cl)c2C2CC2)c1	ZINC000853749757	CH	On-Demand	Anodyne	CHRNA10	40	43
COc1ccc(N2CCN(C(=O)Cn3ncc(Cl)c3C3CC3)CC2)cc1	ZINC000853749772	FF	On-Demand	Clean	CCKAR	15	40
COc1ccc(N2CCN(C(=O)Cn3ncc(Cl)c3C3CC3)CC2)cc1	ZINC000853749772	FF	On-Demand	Clean	CCR1	29	47
COc1ccc(N2CCN(C(=O)Cn3ncc(Cl)c3C3CC3)CC2)cc1	ZINC000853749772	FF	On-Demand	Clean	MAPK1	22	40
COc1ccc(N2CCN(C(=O)Cn3ncc(Cl)c3C3CC3)CC2)cc1	ZINC000853749772	FF	On-Demand	Clean	NPBWR1	89	41
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCc2ccc(Cl)c(Cl)c2C1	ZINC000853749774	GI	On-Demand	Anodyne	MAPK1	45	34
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853750010	EE	On-Demand	Anodyne	CPT1A	55	35
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853750012	EE	On-Demand	Anodyne	CPT1A	55	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ncc(Cl)c2C2CC2)CC1	ZINC000853750047	FE	On-Demand	Anodyne	P2RY12	42	37
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ncc(Cl)c2C2CC2)CC1	ZINC000853750048	FE	On-Demand	Anodyne	P2RY12	42	37
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853750128	FE	On-Demand	Anodyne	PYGL	33	45
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853750128	FE	On-Demand	Anodyne	PYGM	29	45
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853750130	FE	On-Demand	Anodyne	PYGL	33	45
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853750130	FE	On-Demand	Anodyne	PYGM	29	45
CC(C)(C)OC(=O)NCc1nc(Cn2ncc(Cl)c2C2CC2)no1	ZINC000853750227	FF	On-Demand	Anodyne	PANC	50	33
CN(C)CC[C@H](NC(=O)N[C@H]1C[C@@H](O)c2ccccc21)C(C)(C)C	ZINC000853750254	EF	On-Demand	Anodyne	UTS2	57	32
CN(C)CC[C@H](NC(=O)N[C@@H]1C[C@H](O)c2ccccc21)C(C)(C)C	ZINC000853750255	EF	On-Demand	Anodyne	UTS2	57	32
CN(C)CC[C@H](NC(=O)N[C@H]1C[C@H](O)c2ccccc21)C(C)(C)C	ZINC000853750256	EF	On-Demand	Anodyne	UTS2	57	32
CN(C)CC[C@H](NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21)C(C)(C)C	ZINC000853750257	EF	On-Demand	Anodyne	UTS2	57	32
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CCc2ccc(C(C)C)cc2C1	ZINC000853750301	FI	On-Demand	Anodyne	MAPK1	51	36
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000853750329	GG	On-Demand	Anodyne	PREP	40	33
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000853750331	GG	On-Demand	Anodyne	PREP	40	33
O=C(c1ccccc1)N1CC[C@@H](CON=C[C@H]2CCCO2)C1	ZINC000853750339	DE	On-Demand	Mild	L3MBTL3	47	34
O=C(c1ccccc1)N1CC[C@H](CON=C[C@H]2CCCO2)C1	ZINC000853750340	DE	On-Demand	Mild	L3MBTL3	47	34
O=C(c1ccccc1)N1CC[C@H](CON=C[C@@H]2CCCO2)C1	ZINC000853750341	DE	On-Demand	Mild	L3MBTL3	47	34
O=C(c1ccccc1)N1CC[C@@H](CON=C[C@@H]2CCCO2)C1	ZINC000853750342	DE	On-Demand	Mild	L3MBTL3	47	34
COCCc1ccc(OC[C@@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750386	FE	On-Demand	Anodyne	ADRB2	38	54
COCCc1ccc(OC[C@@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750386	FE	On-Demand	Anodyne	ADRB1	57	54
COCCc1ccc(OC[C@@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750386	FE	On-Demand	Anodyne	ADRB3	42	41
COCCc1ccc(OC[C@@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750386	FE	On-Demand	Anodyne	MRGPRX1	41	40
COCCc1ccc(OC[C@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750387	FE	On-Demand	Anodyne	ADRB2	38	54
COCCc1ccc(OC[C@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750387	FE	On-Demand	Anodyne	ADRB1	57	54
COCCc1ccc(OC[C@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750387	FE	On-Demand	Anodyne	ADRB3	42	41
COCCc1ccc(OC[C@H](O)CNc2nccc(N3CCCC3)n2)cc1	ZINC000853750387	FE	On-Demand	Anodyne	MRGPRX1	41	40
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1	ZINC000853750391	EE	On-Demand	Anodyne	ACKR3	68	36
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)n2)cc1	ZINC000853750392	DE	On-Demand	Anodyne	ADRB2	51	61
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)n2)cc1	ZINC000853750392	DE	On-Demand	Anodyne	ADRB1	71	61
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)n2)cc1	ZINC000853750392	DE	On-Demand	Anodyne	GRIN1	23	42
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)n2)cc1	ZINC000853750392	DE	On-Demand	Anodyne	ADRB3	48	47
COCCc1ccc(OC[C@H](O)CNc2cccc(F)n2)cc1	ZINC000853750393	DE	On-Demand	Anodyne	ADRB2	51	61
COCCc1ccc(OC[C@H](O)CNc2cccc(F)n2)cc1	ZINC000853750393	DE	On-Demand	Anodyne	ADRB1	71	61
COCCc1ccc(OC[C@H](O)CNc2cccc(F)n2)cc1	ZINC000853750393	DE	On-Demand	Anodyne	GRIN1	23	42
COCCc1ccc(OC[C@H](O)CNc2cccc(F)n2)cc1	ZINC000853750393	DE	On-Demand	Anodyne	ADRB3	48	47
COCCc1ccc(OC[C@@H](O)CNc2nc(C)nc3c2cnn3C)cc1	ZINC000853750425	FD	On-Demand	Anodyne	ADRB2	24	51
COCCc1ccc(OC[C@@H](O)CNc2nc(C)nc3c2cnn3C)cc1	ZINC000853750425	FD	On-Demand	Anodyne	ADRB1	37	51
COCCc1ccc(OC[C@@H](O)CNc2nc(C)nc3c2cnn3C)cc1	ZINC000853750425	FD	On-Demand	Anodyne	ADRB3	25	40
COCCc1ccc(OC[C@H](O)CNc2nc(C)nc3c2cnn3C)cc1	ZINC000853750426	FD	On-Demand	Anodyne	ADRB2	24	51
COCCc1ccc(OC[C@H](O)CNc2nc(C)nc3c2cnn3C)cc1	ZINC000853750426	FD	On-Demand	Anodyne	ADRB1	37	51
COCCc1ccc(OC[C@H](O)CNc2nc(C)nc3c2cnn3C)cc1	ZINC000853750426	FD	On-Demand	Anodyne	ADRB3	25	40
Cc1cc(OCCCCCCO)ccc1C(N)=O	ZINC000853750428	CE	On-Demand	Anodyne	ALDH2	48	38
Cc1cc(OCCCCCCO)ccc1C(N)=O	ZINC000853750428	CE	On-Demand	Anodyne	GRM2	18	44
Cc1cc(OCCCCCCO)ccc1C(N)=O	ZINC000853750428	CE	On-Demand	Anodyne	PLA2G4B	91	40
Cc1cc(OCCCCCCO)ccc1C(N)=O	ZINC000853750428	CE	On-Demand	Anodyne	ACR	41	44
Cc1cc(OCCCCCCO)ccc1C(N)=O	ZINC000853750428	CE	On-Demand	Anodyne	SLC47A1	19	44
COCCc1ccc(OC[C@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750442	DD	On-Demand	Anodyne	ADRB2	36	59
COCCc1ccc(OC[C@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750442	DD	On-Demand	Anodyne	ADRB1	55	59
COCCc1ccc(OC[C@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750442	DD	On-Demand	Anodyne	GRIN1	20	40
COCCc1ccc(OC[C@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750442	DD	On-Demand	Anodyne	ADRB3	38	43
COCCc1ccc(OC[C@@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750443	DD	On-Demand	Anodyne	ADRB2	36	59
COCCc1ccc(OC[C@@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750443	DD	On-Demand	Anodyne	ADRB1	55	59
COCCc1ccc(OC[C@@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750443	DD	On-Demand	Anodyne	GRIN1	20	40
COCCc1ccc(OC[C@@H](O)CNc2cnc(F)cn2)cc1	ZINC000853750443	DD	On-Demand	Anodyne	ADRB3	38	43
COCCc1ccc(OC[C@@H](O)CNc2cc3nnc(C)n3cn2)cc1	ZINC000853750451	FD	On-Demand	Anodyne	ADRB2	24	52
COCCc1ccc(OC[C@@H](O)CNc2cc3nnc(C)n3cn2)cc1	ZINC000853750451	FD	On-Demand	Anodyne	ADRB1	40	52
COCCc1ccc(OC[C@H](O)CNc2cc3nnc(C)n3cn2)cc1	ZINC000853750452	FD	On-Demand	Anodyne	ADRB2	24	52
COCCc1ccc(OC[C@H](O)CNc2cc3nnc(C)n3cn2)cc1	ZINC000853750452	FD	On-Demand	Anodyne	ADRB1	40	52
c1ccc2c(CCNc3nccc(N4CCCC4)n3)noc2c1	ZINC000853750453	DF	On-Demand	Anodyne	SORD	28	47
c1ccc2c(CCNc3nccc(N4CCCC4)n3)noc2c1	ZINC000853750453	DF	On-Demand	Anodyne	MRGPRX1	41	37
C[C@@H](CNc1nccc(N2CCCC2)n1)c1ccccn1	ZINC000853750461	CF	On-Demand	Anodyne	SORD	78	41
COCCc1ccc(OC[C@@H](O)CNc2nc3c(F)cccc3o2)cc1	ZINC000853750464	FG	On-Demand	Anodyne	ADRB2	32	52
COCCc1ccc(OC[C@@H](O)CNc2nc3c(F)cccc3o2)cc1	ZINC000853750464	FG	On-Demand	Anodyne	ADRB1	48	52
COCCc1ccc(OC[C@@H](O)CNc2nc3c(F)cccc3o2)cc1	ZINC000853750464	FG	On-Demand	Anodyne	ADRB3	32	41
COCCc1ccc(OC[C@H](O)CNc2nc3c(F)cccc3o2)cc1	ZINC000853750465	FG	On-Demand	Anodyne	ADRB2	32	52
COCCc1ccc(OC[C@H](O)CNc2nc3c(F)cccc3o2)cc1	ZINC000853750465	FG	On-Demand	Anodyne	ADRB1	48	52
COCCc1ccc(OC[C@H](O)CNc2nc3c(F)cccc3o2)cc1	ZINC000853750465	FG	On-Demand	Anodyne	ADRB3	32	41
O=C(Cn1ncc(Cl)c1C1CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853750490	FF	On-Demand	Anodyne	PIK3CA	38	42
O=C(Cn1ncc(Cl)c1C1CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853750490	FF	On-Demand	Anodyne	MTOR	78	42
O=C(Cn1ncc(Cl)c1C1CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853750490	FF	On-Demand	Anodyne	STAT6	55	36
C(=NOCc1ccc(CN2CCCCC2)cc1)[C@H]1CCCO1	ZINC000853750617	DG	On-Demand	Mild	HRH3	21	45
C(=NOCc1ccc(CN2CCCCC2)cc1)[C@@H]1CCCO1	ZINC000853750618	DG	On-Demand	Mild	HRH3	21	45
N#Cc1ccc(OCCCn2ncc(Cl)c2C2CC2)cc1	ZINC000853750638	DH	On-Demand	Mild	HRH3	19	44
N#Cc1ccc(OCCCn2ncc(Cl)c2C2CC2)cc1	ZINC000853750638	DH	On-Demand	Mild	MEN1	43	40
Cc1ccccc1CN1CCC(NC(=O)CON=C[C@@H]2CCCO2)CC1	ZINC000853750668	FE	On-Demand	Mild	DRD4	17	50
Cc1ccccc1CN1CCC(NC(=O)CON=C[C@@H]2CCCO2)CC1	ZINC000853750668	FE	On-Demand	Mild	SIGMAR1	17	43
Cc1ccccc1CN1CCC(NC(=O)CON=C[C@H]2CCCO2)CC1	ZINC000853750669	FE	On-Demand	Mild	DRD4	17	50
Cc1ccccc1CN1CCC(NC(=O)CON=C[C@H]2CCCO2)CC1	ZINC000853750669	FE	On-Demand	Mild	SIGMAR1	17	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(-c3nc(C)no3)cn2)cc1	ZINC000853750678	GE	On-Demand	Anodyne	ADRB2	26	50
COCCc1ccc(OC[C@@H](O)CNc2ccc(-c3nc(C)no3)cn2)cc1	ZINC000853750678	GE	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@H](O)CNc2ccc(-c3nc(C)no3)cn2)cc1	ZINC000853750680	GE	On-Demand	Anodyne	ADRB2	26	50
COCCc1ccc(OC[C@H](O)CNc2ccc(-c3nc(C)no3)cn2)cc1	ZINC000853750680	GE	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@@H](O)CNc2nc3ccccn3c2[N+](=O)[O-])cc1	ZINC000853750724	GE	On-Demand	Bother	ADRB2	31	47
COCCc1ccc(OC[C@@H](O)CNc2nc3ccccn3c2[N+](=O)[O-])cc1	ZINC000853750724	GE	On-Demand	Bother	ADRB1	50	47
COCCc1ccc(OC[C@H](O)CNc2nc3ccccn3c2[N+](=O)[O-])cc1	ZINC000853750727	GE	On-Demand	Bother	ADRB2	31	47
COCCc1ccc(OC[C@H](O)CNc2nc3ccccn3c2[N+](=O)[O-])cc1	ZINC000853750727	GE	On-Demand	Bother	ADRB1	50	47
COCCc1ccc(OC[C@@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750743	ED	On-Demand	Anodyne	ADRB2	34	56
COCCc1ccc(OC[C@@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750743	ED	On-Demand	Anodyne	ADRB1	49	56
COCCc1ccc(OC[C@@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750743	ED	On-Demand	Anodyne	ADRB3	34	43
COCCc1ccc(OC[C@@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750743	ED	On-Demand	Anodyne	CDK4	15	40
COCCc1ccc(OC[C@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750745	ED	On-Demand	Anodyne	ADRB2	34	56
COCCc1ccc(OC[C@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750745	ED	On-Demand	Anodyne	ADRB1	49	56
COCCc1ccc(OC[C@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750745	ED	On-Demand	Anodyne	ADRB3	34	43
COCCc1ccc(OC[C@H](O)CNc2nccc(N(C)C)n2)cc1	ZINC000853750745	ED	On-Demand	Anodyne	CDK4	15	40
CC(C)(C)OC(=O)N1CCC(Cn2ncc(Cl)c2C2CC2)CC1	ZINC000853750813	EI	On-Demand	Anodyne	GPR119	48	49
N#Cc1cccc(OCCCON=C[C@@H]2CCCO2)c1	ZINC000853750928	CF	On-Demand	Mild	CHRNA10	27	46
N#Cc1cccc(OCCCON=C[C@H]2CCCO2)c1	ZINC000853750929	CF	On-Demand	Mild	CHRNA10	27	46
COCCc1ccc(OC[C@@H](O)CN=c2cc[nH]c(C(=O)N(C)C)c2)cc1	ZINC000853750959	FD	On-Demand	Anodyne	ADRB1	23	44
COCCc1ccc(OC[C@H](O)CN=c2cc[nH]c(C(=O)N(C)C)c2)cc1	ZINC000853750961	FD	On-Demand	Anodyne	ADRB1	23	44
COc1ccc(OC)c([C@H]2CCCN2C(=O)CON=C[C@@H]2CCCO2)c1	ZINC000853750986	FF	On-Demand	Mild	CPT1A	59	38
COc1ccc(OC)c([C@H]2CCCN2C(=O)CON=C[C@H]2CCCO2)c1	ZINC000853750988	FF	On-Demand	Mild	CPT1A	59	38
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc3cc(C)nn23)cc1	ZINC000853750997	GF	On-Demand	Anodyne	ADRB2	32	50
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc3cc(C)nn23)cc1	ZINC000853750997	GF	On-Demand	Anodyne	ADRB1	50	50
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc3cc(C)nn23)cc1	ZINC000853750999	GF	On-Demand	Anodyne	ADRB2	32	50
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc3cc(C)nn23)cc1	ZINC000853750999	GF	On-Demand	Anodyne	ADRB1	50	50
COCCc1ccc(OC[C@@H](O)CN=c2cc[nH]c(C(N)=O)c2)cc1	ZINC000853751011	EC	On-Demand	Anodyne	ADRB2	15	45
COCCc1ccc(OC[C@@H](O)CN=c2cc[nH]c(C(N)=O)c2)cc1	ZINC000853751011	EC	On-Demand	Anodyne	ADRB1	31	45
COCCc1ccc(OC[C@H](O)CN=c2cc[nH]c(C(N)=O)c2)cc1	ZINC000853751014	EC	On-Demand	Anodyne	ADRB2	15	45
COCCc1ccc(OC[C@H](O)CN=c2cc[nH]c(C(N)=O)c2)cc1	ZINC000853751014	EC	On-Demand	Anodyne	ADRB1	31	45
COCCc1ccc(OC[C@@H](O)CNc2ncc3c(n2)CCCC3)cc1	ZINC000853751052	FE	On-Demand	Anodyne	ADRB2	34	56
COCCc1ccc(OC[C@@H](O)CNc2ncc3c(n2)CCCC3)cc1	ZINC000853751052	FE	On-Demand	Anodyne	ADRB1	48	56
COCCc1ccc(OC[C@@H](O)CNc2ncc3c(n2)CCCC3)cc1	ZINC000853751052	FE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@H](O)CNc2ncc3c(n2)CCCC3)cc1	ZINC000853751053	FE	On-Demand	Anodyne	ADRB2	34	56
COCCc1ccc(OC[C@H](O)CNc2ncc3c(n2)CCCC3)cc1	ZINC000853751053	FE	On-Demand	Anodyne	ADRB1	48	56
COCCc1ccc(OC[C@H](O)CNc2ncc3c(n2)CCCC3)cc1	ZINC000853751053	FE	On-Demand	Anodyne	ADRB3	34	42
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751073	FE	On-Demand	Anodyne	ADRB2	42	58
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751073	FE	On-Demand	Anodyne	ADRB1	60	58
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751073	FE	On-Demand	Anodyne	GRIN1	28	40
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751073	FE	On-Demand	Anodyne	ADRB3	42	45
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751074	FE	On-Demand	Anodyne	ADRB2	42	58
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751074	FE	On-Demand	Anodyne	ADRB1	60	58
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751074	FE	On-Demand	Anodyne	GRIN1	28	40
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(C)n2)cc1	ZINC000853751074	FE	On-Demand	Anodyne	ADRB3	42	45
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751075	EE	On-Demand	Anodyne	ADRB2	37	59
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751075	EE	On-Demand	Anodyne	ADRB1	55	59
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751075	EE	On-Demand	Anodyne	GRIN1	26	40
COCCc1ccc(OC[C@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751075	EE	On-Demand	Anodyne	ADRB3	37	43
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751076	EE	On-Demand	Anodyne	ADRB2	37	59
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751076	EE	On-Demand	Anodyne	ADRB1	55	59
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751076	EE	On-Demand	Anodyne	GRIN1	26	40
COCCc1ccc(OC[C@@H](O)CNc2ccc(Cl)nn2)cc1	ZINC000853751076	EE	On-Demand	Anodyne	ADRB3	37	43
COCCc1ccc(OC[C@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751078	GE	On-Demand	Bother	ADRB2	22	49
COCCc1ccc(OC[C@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751078	GE	On-Demand	Bother	ADRB1	40	49
COCCc1ccc(OC[C@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751078	GE	On-Demand	Bother	GSTM2	115	45
COCCc1ccc(OC[C@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751078	GE	On-Demand	Bother	GSTP1	74	45
COCCc1ccc(OC[C@@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751079	GE	On-Demand	Bother	ADRB2	22	49
COCCc1ccc(OC[C@@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751079	GE	On-Demand	Bother	ADRB1	40	49
COCCc1ccc(OC[C@@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751079	GE	On-Demand	Bother	GSTM2	115	45
COCCc1ccc(OC[C@@H](O)CNc2ccc([N+](=O)[O-])c3nonc23)cc1	ZINC000853751079	GE	On-Demand	Bother	GSTP1	74	45
COc1ccc([C@@H]2CCCCCN2C(=O)CON=C[C@H]2CCCO2)cc1	ZINC000853751102	FG	On-Demand	Mild	CPT1A	114	45
COc1ccc([C@@H]2CCCCCN2C(=O)CON=C[C@@H]2CCCO2)cc1	ZINC000853751103	FG	On-Demand	Mild	CPT1A	114	45
O=C(Cn1ncc(Cl)c1C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000853751220	FH	On-Demand	Bother	IMDH_CRYPV	27	42
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	CHRM2	16	45
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	CHRM1	16	45
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	DRD2	19	45
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	DRD4	48	46
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	ACHE	37	46
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	CHRM3	23	45
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	SIGMAR1	45	55
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	SSTR5	55	35
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	CCR3	24	40
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	SLC6A5	23	42
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	MCHR1	45	47
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751245	FE	On-Demand	Mild	CACNA1G	28	40
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	CHRM2	16	45
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	CHRM1	16	45
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	DRD2	19	45
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	DRD4	48	46
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	ACHE	37	46
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	CHRM3	23	45
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	SIGMAR1	45	55
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	SSTR5	55	35
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	CCR3	24	40
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	SLC6A5	23	42
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	MCHR1	45	47
C[C@@H](ON=C[C@H]1CCCO1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853751248	FE	On-Demand	Mild	CACNA1G	28	40
C(=NOC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@H]1CCCO1	ZINC000853751294	DE	On-Demand	Mild	DRD4	22	48
C(=NOC[C@H]1CN(Cc2ccccc2)CCCO1)[C@H]1CCCO1	ZINC000853751295	DE	On-Demand	Mild	DRD4	22	48
C(=NOC[C@@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1CCCO1	ZINC000853751296	DE	On-Demand	Mild	DRD4	22	48
C(=NOC[C@H]1CN(Cc2ccccc2)CCCO1)[C@@H]1CCCO1	ZINC000853751297	DE	On-Demand	Mild	DRD4	22	48
COCCc1ccc(OC[C@@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751357	GG	On-Demand	Anodyne	ADRB2	32	54
COCCc1ccc(OC[C@@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751357	GG	On-Demand	Anodyne	ADRB1	49	54
COCCc1ccc(OC[C@@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751357	GG	On-Demand	Anodyne	ADRB3	32	44
COCCc1ccc(OC[C@@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751357	GG	On-Demand	Anodyne	HRP1_PLAFA	43	40
COCCc1ccc(OC[C@@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751357	GG	On-Demand	Anodyne	HNMT	40	39
COCCc1ccc(OC[C@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751358	GG	On-Demand	Anodyne	ADRB2	32	54
COCCc1ccc(OC[C@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751358	GG	On-Demand	Anodyne	ADRB1	49	54
COCCc1ccc(OC[C@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751358	GG	On-Demand	Anodyne	ADRB3	32	44
COCCc1ccc(OC[C@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751358	GG	On-Demand	Anodyne	HRP1_PLAFA	43	40
COCCc1ccc(OC[C@H](O)CNc2ccnc3cc(OC)ccc23)cc1	ZINC000853751358	GG	On-Demand	Anodyne	HNMT	40	39
COCCc1ccc(OC[C@@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751379	EF	On-Demand	Anodyne	ADRB2	52	62
COCCc1ccc(OC[C@@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751379	EF	On-Demand	Anodyne	ADRB1	67	62
COCCc1ccc(OC[C@@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751379	EF	On-Demand	Anodyne	GRIN1	27	40
COCCc1ccc(OC[C@@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751379	EF	On-Demand	Anodyne	ADRB3	48	46
COCCc1ccc(OC[C@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751381	EF	On-Demand	Anodyne	ADRB2	52	62
COCCc1ccc(OC[C@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751381	EF	On-Demand	Anodyne	ADRB1	67	62
COCCc1ccc(OC[C@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751381	EF	On-Demand	Anodyne	GRIN1	27	40
COCCc1ccc(OC[C@H](O)CNc2cccc(Cl)n2)cc1	ZINC000853751381	EF	On-Demand	Anodyne	ADRB3	48	46
COCCc1ccc(OC[C@@H](O)CNc2ccc(N)cc2[N+](=O)[O-])cc1	ZINC000853751396	FE	On-Demand	Bother	ADRB2	30	52
COCCc1ccc(OC[C@@H](O)CNc2ccc(N)cc2[N+](=O)[O-])cc1	ZINC000853751396	FE	On-Demand	Bother	ADRB1	46	52
COCCc1ccc(OC[C@@H](O)CNc2ccc(N)cc2[N+](=O)[O-])cc1	ZINC000853751396	FE	On-Demand	Bother	ADRB3	34	41
COCCc1ccc(OC[C@H](O)CNc2ccc(N)cc2[N+](=O)[O-])cc1	ZINC000853751398	FE	On-Demand	Bother	ADRB2	30	52
COCCc1ccc(OC[C@H](O)CNc2ccc(N)cc2[N+](=O)[O-])cc1	ZINC000853751398	FE	On-Demand	Bother	ADRB1	46	52
COCCc1ccc(OC[C@H](O)CNc2ccc(N)cc2[N+](=O)[O-])cc1	ZINC000853751398	FE	On-Demand	Bother	ADRB3	34	41
COCCc1ccc(OC[C@@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751413	EF	On-Demand	Anodyne	ADRB2	40	58
COCCc1ccc(OC[C@@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751413	EF	On-Demand	Anodyne	ADRB1	63	58
COCCc1ccc(OC[C@@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751413	EF	On-Demand	Anodyne	GRIN1	29	42
COCCc1ccc(OC[C@@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751413	EF	On-Demand	Anodyne	ADRB3	44	42
COCCc1ccc(OC[C@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751415	EF	On-Demand	Anodyne	ADRB2	40	58
COCCc1ccc(OC[C@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751415	EF	On-Demand	Anodyne	ADRB1	63	58
COCCc1ccc(OC[C@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751415	EF	On-Demand	Anodyne	GRIN1	29	42
COCCc1ccc(OC[C@H](O)CNc2ccnc(Cl)c2)cc1	ZINC000853751415	EF	On-Demand	Anodyne	ADRB3	44	42
CON(C)CCNC(=O)NCCCc1ccc(Br)cc1F	ZINC000853751468	FE	On-Demand	Anodyne	MTNR1A	26	42
CON(C)CCNC(=O)NCCCc1ccc(Br)cc1F	ZINC000853751468	FE	On-Demand	Anodyne	MTNR1B	20	52
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(C3CC3)n2)cc1	ZINC000853751477	GG	On-Demand	Anodyne	ADRB2	33	52
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(C3CC3)n2)cc1	ZINC000853751477	GG	On-Demand	Anodyne	ADRB1	53	52
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(C3CC3)n2)cc1	ZINC000853751477	GG	On-Demand	Anodyne	ADRB3	34	41
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(C3CC3)n2)cc1	ZINC000853751478	GG	On-Demand	Anodyne	ADRB2	33	52
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(C3CC3)n2)cc1	ZINC000853751478	GG	On-Demand	Anodyne	ADRB1	53	52
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(C3CC3)n2)cc1	ZINC000853751478	GG	On-Demand	Anodyne	ADRB3	34	41
COC(=O)c1ccc(OCCCCCCO)cc1C	ZINC000853751479	CF	On-Demand	Anodyne	PLA2G4A	15	40
COC(=O)c1ccc(OCCCCCCO)cc1C	ZINC000853751479	CF	On-Demand	Anodyne	GRM2	17	43
COC(=O)c1ccc(OCCCCCCO)cc1C	ZINC000853751479	CF	On-Demand	Anodyne	PLA2G4B	88	39
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2cccc(F)c2)C1	ZINC000853751492	EE	On-Demand	Mild	ACKR3	46	33
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1	ZINC000853751493	EE	On-Demand	Mild	ACKR3	46	33
COc1cccc(OCCON=C[C@@H]2CCCO2)c1	ZINC000853751553	CE	On-Demand	Mild	CHRNA10	19	43
COc1cccc(OCCON=C[C@H]2CCCO2)c1	ZINC000853751554	CE	On-Demand	Mild	CHRNA10	19	43
O=C(CON=C[C@@H]1CCCO1)NCc1cccc(OCC(F)(F)F)c1	ZINC000853751655	FE	On-Demand	Mild	PDS	48	38
O=C(CON=C[C@H]1CCCO1)NCc1cccc(OCC(F)(F)F)c1	ZINC000853751656	FE	On-Demand	Mild	PDS	48	38
CC(C)(C)OC(=O)N1CCC(CCON=C[C@@H]2CCCO2)CC1	ZINC000853751675	EG	On-Demand	Mild	GPR119	27	43
CC(C)(C)OC(=O)N1CCC(CCON=C[C@H]2CCCO2)CC1	ZINC000853751676	EG	On-Demand	Mild	GPR119	27	43
N#Cc1cccc(OCCON=C[C@@H]2CCCO2)c1	ZINC000853751681	CE	On-Demand	Mild	CHRNA10	30	47
N#Cc1cccc(OCCON=C[C@H]2CCCO2)c1	ZINC000853751682	CE	On-Demand	Mild	CHRNA10	30	47
Cc1cc(OCCC2CCOCC2)ccc1C(N)=O	ZINC000853751713	CE	On-Demand	Anodyne	CHEK2	29	41
COCCc1ccc(OC[C@@H](O)CNc2ccnc3c(F)cccc23)cc1	ZINC000853751718	FG	On-Demand	Anodyne	ADRB2	36	52
COCCc1ccc(OC[C@@H](O)CNc2ccnc3c(F)cccc23)cc1	ZINC000853751718	FG	On-Demand	Anodyne	ADRB1	58	52
COCCc1ccc(OC[C@@H](O)CNc2ccnc3c(F)cccc23)cc1	ZINC000853751718	FG	On-Demand	Anodyne	ADRB3	38	41
COCCc1ccc(OC[C@H](O)CNc2ccnc3c(F)cccc23)cc1	ZINC000853751719	FG	On-Demand	Anodyne	ADRB2	36	52
COCCc1ccc(OC[C@H](O)CNc2ccnc3c(F)cccc23)cc1	ZINC000853751719	FG	On-Demand	Anodyne	ADRB1	58	52
COCCc1ccc(OC[C@H](O)CNc2ccnc3c(F)cccc23)cc1	ZINC000853751719	FG	On-Demand	Anodyne	ADRB3	38	41
COCCc1ccc(OC[C@@H](O)CNc2ncnc3c2CCC3)cc1	ZINC000853751735	EE	On-Demand	Anodyne	ADRB2	34	56
COCCc1ccc(OC[C@@H](O)CNc2ncnc3c2CCC3)cc1	ZINC000853751735	EE	On-Demand	Anodyne	ADRB1	49	56
COCCc1ccc(OC[C@@H](O)CNc2ncnc3c2CCC3)cc1	ZINC000853751735	EE	On-Demand	Anodyne	ADRB3	34	40
COCCc1ccc(OC[C@H](O)CNc2ncnc3c2CCC3)cc1	ZINC000853751736	EE	On-Demand	Anodyne	ADRB2	34	56
COCCc1ccc(OC[C@H](O)CNc2ncnc3c2CCC3)cc1	ZINC000853751736	EE	On-Demand	Anodyne	ADRB1	49	56
COCCc1ccc(OC[C@H](O)CNc2ncnc3c2CCC3)cc1	ZINC000853751736	EE	On-Demand	Anodyne	ADRB3	34	40
COCCc1ccc(OC[C@@H](O)CNc2nnc(C)cc2C(F)(F)F)cc1	ZINC000853751738	GF	On-Demand	Anodyne	ADRB2	31	53
COCCc1ccc(OC[C@@H](O)CNc2nnc(C)cc2C(F)(F)F)cc1	ZINC000853751738	GF	On-Demand	Anodyne	ADRB1	43	53
COCCc1ccc(OC[C@H](O)CNc2nnc(C)cc2C(F)(F)F)cc1	ZINC000853751739	GF	On-Demand	Anodyne	ADRB2	31	53
COCCc1ccc(OC[C@H](O)CNc2nnc(C)cc2C(F)(F)F)cc1	ZINC000853751739	GF	On-Demand	Anodyne	ADRB1	43	53
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(=O)OC)c(C)c2)CC1	ZINC000853751742	GD	On-Demand	Anodyne	P2RY12	88	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(=O)OC)c(C)c2)CC1	ZINC000853751743	GD	On-Demand	Anodyne	P2RY12	88	39
COCCc1ccc(OC[C@H](O)CNc2cncc(Cl)n2)cc1	ZINC000853751829	EE	On-Demand	Anodyne	ADRB2	40	58
COCCc1ccc(OC[C@H](O)CNc2cncc(Cl)n2)cc1	ZINC000853751829	EE	On-Demand	Anodyne	ADRB1	61	58
COCCc1ccc(OC[C@H](O)CNc2cncc(Cl)n2)cc1	ZINC000853751829	EE	On-Demand	Anodyne	ADRB3	42	45
COCCc1ccc(OC[C@@H](O)CNc2cncc(Cl)n2)cc1	ZINC000853751830	EE	On-Demand	Anodyne	ADRB2	40	58
COCCc1ccc(OC[C@@H](O)CNc2cncc(Cl)n2)cc1	ZINC000853751830	EE	On-Demand	Anodyne	ADRB1	61	58
COCCc1ccc(OC[C@@H](O)CNc2cncc(Cl)n2)cc1	ZINC000853751830	EE	On-Demand	Anodyne	ADRB3	42	45
Cc1cccc([C@@H](C)NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1C	ZINC000853751843	GH	On-Demand	Clean	VHL	48	31
O=C(CON=C[C@@H]1CCCO1)NCC1(c2ccccc2)CCOCC1	ZINC000853751925	EE	On-Demand	Mild	KCNA3	45	36
O=C(CON=C[C@H]1CCCO1)NCC1(c2ccccc2)CCOCC1	ZINC000853751926	EE	On-Demand	Mild	KCNA3	45	36
CCOc1ccc([C@@H]2CCCN2C(=O)CON=C[C@H]2CCCO2)cc1	ZINC000853751969	EF	On-Demand	Mild	CPT1A	109	37
CCOc1ccc([C@@H]2CCCN2C(=O)CON=C[C@@H]2CCCO2)cc1	ZINC000853751971	EF	On-Demand	Mild	CPT1A	109	37
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752015	GG	On-Demand	Bother	ADRB2	32	52
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752015	GG	On-Demand	Bother	ADRB1	54	52
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752015	GG	On-Demand	Bother	GRIN1	26	42
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752015	GG	On-Demand	Bother	ADRB3	37	43
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752016	GG	On-Demand	Bother	ADRB2	32	52
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752016	GG	On-Demand	Bother	ADRB1	54	52
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752016	GG	On-Demand	Bother	GRIN1	26	42
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000853752016	GG	On-Demand	Bother	ADRB3	37	43
COCCc1ccc(OC[C@@H](O)CNc2nc(C)ccc2[N+](=O)[O-])cc1	ZINC000853752022	FE	On-Demand	Bother	ADRB2	32	52
COCCc1ccc(OC[C@@H](O)CNc2nc(C)ccc2[N+](=O)[O-])cc1	ZINC000853752022	FE	On-Demand	Bother	ADRB1	48	52
COCCc1ccc(OC[C@@H](O)CNc2nc(C)ccc2[N+](=O)[O-])cc1	ZINC000853752022	FE	On-Demand	Bother	ADRB3	34	41
COCCc1ccc(OC[C@H](O)CNc2nc(C)ccc2[N+](=O)[O-])cc1	ZINC000853752023	FE	On-Demand	Bother	ADRB2	32	52
COCCc1ccc(OC[C@H](O)CNc2nc(C)ccc2[N+](=O)[O-])cc1	ZINC000853752023	FE	On-Demand	Bother	ADRB1	48	52
COCCc1ccc(OC[C@H](O)CNc2nc(C)ccc2[N+](=O)[O-])cc1	ZINC000853752023	FE	On-Demand	Bother	ADRB3	34	41
Cc1ncc2c(n1)CCC[C@H]2NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853752029	FG	On-Demand	Anodyne	EPHX2	22	43
CON(C)CCNC(=O)N[C@H]1CCCN(c2cccc(F)c2)C1	ZINC000853752031	DD	On-Demand	Anodyne	ACKR3	47	34
CON(C)CCNC(=O)N[C@@H]1CCCN(c2cccc(F)c2)C1	ZINC000853752032	DD	On-Demand	Anodyne	ACKR3	47	34
O=C(COc1cccc(C2CCCCC2)c1)N1CCC2(CC1)OCCO2	ZINC000853752048	FG	On-Demand	Anodyne	CPT1A	111	42
O=C(COc1cccc(C2CCCCC2)c1)N1CCC2(CC1)OCCO2	ZINC000853752048	FG	On-Demand	Anodyne	CPT2	49	42
COCCc1ccc(OC[C@@H](O)CNc2ccnc(C(C)C)n2)cc1	ZINC000853752050	EF	On-Demand	Anodyne	ADRB2	41	63
COCCc1ccc(OC[C@@H](O)CNc2ccnc(C(C)C)n2)cc1	ZINC000853752050	EF	On-Demand	Anodyne	ADRB1	54	63
COCCc1ccc(OC[C@@H](O)CNc2ccnc(C(C)C)n2)cc1	ZINC000853752050	EF	On-Demand	Anodyne	ADRB3	37	44
COCCc1ccc(OC[C@H](O)CNc2ccnc(C(C)C)n2)cc1	ZINC000853752052	EF	On-Demand	Anodyne	ADRB2	41	63
COCCc1ccc(OC[C@H](O)CNc2ccnc(C(C)C)n2)cc1	ZINC000853752052	EF	On-Demand	Anodyne	ADRB1	54	63
COCCc1ccc(OC[C@H](O)CNc2ccnc(C(C)C)n2)cc1	ZINC000853752052	EF	On-Demand	Anodyne	ADRB3	37	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2ccc(C(N)=O)c(C)c2)CC1	ZINC000853752055	FD	On-Demand	Anodyne	P2RY12	66	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2ccc(C(N)=O)c(C)c2)CC1	ZINC000853752057	FD	On-Demand	Anodyne	P2RY12	66	39
C#Cc1cnc(NC[C@H](O)COc2ccc(CCOC)cc2)nc1	ZINC000853752179	ED	On-Demand	Mild	ADRB2	39	59
C#Cc1cnc(NC[C@H](O)COc2ccc(CCOC)cc2)nc1	ZINC000853752179	ED	On-Demand	Mild	ADRB1	55	59
C#Cc1cnc(NC[C@H](O)COc2ccc(CCOC)cc2)nc1	ZINC000853752179	ED	On-Demand	Mild	ADRB3	40	43
C#Cc1cnc(NC[C@@H](O)COc2ccc(CCOC)cc2)nc1	ZINC000853752181	ED	On-Demand	Mild	ADRB2	39	59
C#Cc1cnc(NC[C@@H](O)COc2ccc(CCOC)cc2)nc1	ZINC000853752181	ED	On-Demand	Mild	ADRB1	55	59
C#Cc1cnc(NC[C@@H](O)COc2ccc(CCOC)cc2)nc1	ZINC000853752181	ED	On-Demand	Mild	ADRB3	40	43
COCCc1ccc(OC[C@@H](O)CNc2ncnc3c2cnn3C(C)(C)C)cc1	ZINC000853752183	GF	On-Demand	Anodyne	ADRB2	24	50
COCCc1ccc(OC[C@@H](O)CNc2ncnc3c2cnn3C(C)(C)C)cc1	ZINC000853752183	GF	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@H](O)CNc2ncnc3c2cnn3C(C)(C)C)cc1	ZINC000853752186	GF	On-Demand	Anodyne	ADRB2	24	50
COCCc1ccc(OC[C@H](O)CNc2ncnc3c2cnn3C(C)(C)C)cc1	ZINC000853752186	GF	On-Demand	Anodyne	ADRB1	35	50
COCCc1ccc(OC[C@@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752188	FG	On-Demand	Anodyne	ADRB2	37	57
COCCc1ccc(OC[C@@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752188	FG	On-Demand	Anodyne	ADRB1	52	57
COCCc1ccc(OC[C@@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752188	FG	On-Demand	Anodyne	GRIN1	28	41
COCCc1ccc(OC[C@@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752188	FG	On-Demand	Anodyne	ADRB3	36	44
COCCc1ccc(OC[C@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752190	FG	On-Demand	Anodyne	ADRB2	37	57
COCCc1ccc(OC[C@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752190	FG	On-Demand	Anodyne	ADRB1	52	57
COCCc1ccc(OC[C@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752190	FG	On-Demand	Anodyne	GRIN1	28	41
COCCc1ccc(OC[C@H](O)CNc2nc(C)ccc2Cl)cc1	ZINC000853752190	FG	On-Demand	Anodyne	ADRB3	36	44
O=C(CON=C[C@@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000853752211	FE	On-Demand	Mild	PDS	44	43
O=C(CON=C[C@H]1CCCO1)NCCOc1cccc(C(F)(F)F)c1	ZINC000853752212	FE	On-Demand	Mild	PDS	44	43
CCCOc1cccc(CNC(=O)CON=C[C@@H]2CCCO2)c1	ZINC000853752289	DE	On-Demand	Mild	PDS	55	35
CCCOc1cccc(CNC(=O)CON=C[C@H]2CCCO2)c1	ZINC000853752290	DE	On-Demand	Mild	PDS	55	35
Cc1cc(OCCCCS(C)(=O)=O)ccc1C(N)=O	ZINC000853752380	CD	On-Demand	Anodyne	GRM2	15	42
Cc1cc(OCCCCS(C)(=O)=O)ccc1C(N)=O	ZINC000853752380	CD	On-Demand	Anodyne	PLA2G4B	59	33
Cc1cc(OCCCCS(C)(=O)=O)ccc1C(N)=O	ZINC000853752380	CD	On-Demand	Anodyne	FFAR1	19	43
COCCc1ccc(OC[C@@H](O)CNc2ncnc3sc(C)cc23)cc1	ZINC000853752449	FG	On-Demand	Anodyne	ADRB2	39	52
COCCc1ccc(OC[C@@H](O)CNc2ncnc3sc(C)cc23)cc1	ZINC000853752449	FG	On-Demand	Anodyne	ADRB1	51	52
COCCc1ccc(OC[C@@H](O)CNc2ncnc3sc(C)cc23)cc1	ZINC000853752449	FG	On-Demand	Anodyne	ADRB3	38	41
COCCc1ccc(OC[C@H](O)CNc2ncnc3sc(C)cc23)cc1	ZINC000853752450	FG	On-Demand	Anodyne	ADRB2	39	52
COCCc1ccc(OC[C@H](O)CNc2ncnc3sc(C)cc23)cc1	ZINC000853752450	FG	On-Demand	Anodyne	ADRB1	51	52
COCCc1ccc(OC[C@H](O)CNc2ncnc3sc(C)cc23)cc1	ZINC000853752450	FG	On-Demand	Anodyne	ADRB3	38	41
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752451	FG	On-Demand	Anodyne	ADRB2	45	55
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752451	FG	On-Demand	Anodyne	ADRB1	73	55
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752451	FG	On-Demand	Anodyne	GRIN1	18	40
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752451	FG	On-Demand	Anodyne	ADRB3	46	42
COCCc1ccc(OC[C@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752452	FG	On-Demand	Anodyne	ADRB2	45	55
COCCc1ccc(OC[C@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752452	FG	On-Demand	Anodyne	ADRB1	73	55
COCCc1ccc(OC[C@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752452	FG	On-Demand	Anodyne	GRIN1	18	40
COCCc1ccc(OC[C@H](O)CNc2cccc(F)c2C(C)=O)cc1	ZINC000853752452	FG	On-Demand	Anodyne	ADRB3	46	42
COCCc1ccc(OC[C@@H](O)CNc2cc(C)nc(N)n2)cc1	ZINC000853752464	ED	On-Demand	Anodyne	ADRB2	36	56
COCCc1ccc(OC[C@@H](O)CNc2cc(C)nc(N)n2)cc1	ZINC000853752464	ED	On-Demand	Anodyne	ADRB1	48	56
COCCc1ccc(OC[C@@H](O)CNc2cc(C)nc(N)n2)cc1	ZINC000853752464	ED	On-Demand	Anodyne	ADRB3	35	43
COCCc1ccc(OC[C@H](O)CNc2cc(C)nc(N)n2)cc1	ZINC000853752465	ED	On-Demand	Anodyne	ADRB2	36	56
COCCc1ccc(OC[C@H](O)CNc2cc(C)nc(N)n2)cc1	ZINC000853752465	ED	On-Demand	Anodyne	ADRB1	48	56
COCCc1ccc(OC[C@H](O)CNc2cc(C)nc(N)n2)cc1	ZINC000853752465	ED	On-Demand	Anodyne	ADRB3	35	43
COCCc1ccc(OC[C@H](O)CNc2nnc(Cl)cc2C(N)=O)cc1	ZINC000853752466	GD	On-Demand	Anodyne	ADRB2	40	53
COCCc1ccc(OC[C@H](O)CNc2nnc(Cl)cc2C(N)=O)cc1	ZINC000853752466	GD	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@H](O)CNc2nnc(Cl)cc2C(N)=O)cc1	ZINC000853752466	GD	On-Demand	Anodyne	ADRB3	48	39
COCCc1ccc(OC[C@@H](O)CNc2nnc(Cl)cc2C(N)=O)cc1	ZINC000853752467	GD	On-Demand	Anodyne	ADRB2	40	53
COCCc1ccc(OC[C@@H](O)CNc2nnc(Cl)cc2C(N)=O)cc1	ZINC000853752467	GD	On-Demand	Anodyne	ADRB1	64	53
COCCc1ccc(OC[C@@H](O)CNc2nnc(Cl)cc2C(N)=O)cc1	ZINC000853752467	GD	On-Demand	Anodyne	ADRB3	48	39
COCCc1ccc(OC[C@@H](O)CNc2nccc(C(C)(C)C)n2)cc1	ZINC000853752488	FF	On-Demand	Anodyne	ADRB2	37	57
COCCc1ccc(OC[C@@H](O)CNc2nccc(C(C)(C)C)n2)cc1	ZINC000853752488	FF	On-Demand	Anodyne	ADRB1	53	57
COCCc1ccc(OC[C@@H](O)CNc2nccc(C(C)(C)C)n2)cc1	ZINC000853752488	FF	On-Demand	Anodyne	ADRB3	37	44
COCCc1ccc(OC[C@H](O)CNc2nccc(C(C)(C)C)n2)cc1	ZINC000853752489	FF	On-Demand	Anodyne	ADRB2	37	57
COCCc1ccc(OC[C@H](O)CNc2nccc(C(C)(C)C)n2)cc1	ZINC000853752489	FF	On-Demand	Anodyne	ADRB1	53	57
COCCc1ccc(OC[C@H](O)CNc2nccc(C(C)(C)C)n2)cc1	ZINC000853752489	FF	On-Demand	Anodyne	ADRB3	37	44
CON(C)CCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000853752508	EE	On-Demand	Anodyne	CCR5	26	43
CON(C)CCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000853752508	EE	On-Demand	Anodyne	EPHX2	26	40
CON(C)CCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000853752508	EE	On-Demand	Anodyne	BIRC8	43	30
CON(C)CCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000853752509	EE	On-Demand	Anodyne	CCR5	26	43
CON(C)CCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000853752509	EE	On-Demand	Anodyne	EPHX2	26	40
CON(C)CCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000853752509	EE	On-Demand	Anodyne	BIRC8	43	30
O=C(CON=C[C@H]1CCCO1)NCc1ccc(F)cc1C(F)(F)F	ZINC000853752661	EF	On-Demand	Mild	P2RX7	24	46
O=C(CON=C[C@@H]1CCCO1)NCc1ccc(F)cc1C(F)(F)F	ZINC000853752662	EF	On-Demand	Mild	P2RX7	24	46
Cc1cccc([C@@H](C)NC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)c1C	ZINC000853752686	FH	On-Demand	Anodyne	CTSA	43	32
Cc1cccc([C@@H](C)NC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)c1C	ZINC000853752688	FH	On-Demand	Anodyne	CTSA	43	32
COCCc1ccc(OC[C@H](O)CNc2cc(C#N)ccc2C(C)=O)cc1	ZINC000853752692	FF	On-Demand	Mild	ADRB2	32	52
COCCc1ccc(OC[C@H](O)CNc2cc(C#N)ccc2C(C)=O)cc1	ZINC000853752692	FF	On-Demand	Mild	ADRB1	52	52
COCCc1ccc(OC[C@H](O)CNc2cc(C#N)ccc2C(C)=O)cc1	ZINC000853752692	FF	On-Demand	Mild	ADRB3	32	40
COCCc1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2C(C)=O)cc1	ZINC000853752693	FF	On-Demand	Mild	ADRB2	32	52
COCCc1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2C(C)=O)cc1	ZINC000853752693	FF	On-Demand	Mild	ADRB1	52	52
COCCc1ccc(OC[C@@H](O)CNc2cc(C#N)ccc2C(C)=O)cc1	ZINC000853752693	FF	On-Demand	Mild	ADRB3	32	40
CCCCC[C@@H](C)NC(=O)Cn1ccc2cc(OC)c(OC)cc2c1=O	ZINC000853752700	FG	On-Demand	Anodyne	PSMB5	15	52
CCCCC[C@@H](C)NC(=O)Cn1ccc2cc(OC)c(OC)cc2c1=O	ZINC000853752700	FG	On-Demand	Anodyne	PSMB1	16	44
CCCCC[C@@H](C)NC(=O)Cn1ccc2cc(OC)c(OC)cc2c1=O	ZINC000853752700	FG	On-Demand	Anodyne	NR5A1	28	43
COCCc1ccc(OC[C@@H](O)CNc2cc(C(F)(F)F)cnc2C#N)cc1	ZINC000853752701	GG	On-Demand	Mild	ADRB2	23	49
COCCc1ccc(OC[C@@H](O)CNc2cc(C(F)(F)F)cnc2C#N)cc1	ZINC000853752701	GG	On-Demand	Mild	ADRB1	35	49
COCCc1ccc(OC[C@H](O)CNc2cc(C(F)(F)F)cnc2C#N)cc1	ZINC000853752702	GG	On-Demand	Mild	ADRB2	23	49
COCCc1ccc(OC[C@H](O)CNc2cc(C(F)(F)F)cnc2C#N)cc1	ZINC000853752702	GG	On-Demand	Mild	ADRB1	35	49
COCCc1ccc(OC[C@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752703	FF	On-Demand	Anodyne	ADRB2	40	61
COCCc1ccc(OC[C@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752703	FF	On-Demand	Anodyne	ADRB1	61	61
COCCc1ccc(OC[C@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752703	FF	On-Demand	Anodyne	GRIN1	26	44
COCCc1ccc(OC[C@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752703	FF	On-Demand	Anodyne	ADRB3	43	47
COCCc1ccc(OC[C@@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752704	FF	On-Demand	Anodyne	ADRB2	40	61
COCCc1ccc(OC[C@@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752704	FF	On-Demand	Anodyne	ADRB1	61	61
COCCc1ccc(OC[C@@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752704	FF	On-Demand	Anodyne	GRIN1	26	44
COCCc1ccc(OC[C@@H](O)CNc2c(F)c(F)nc(F)c2F)cc1	ZINC000853752704	FF	On-Demand	Anodyne	ADRB3	43	47
CCn1c(Cc2ccccc2)nnc1S[C@H](C)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853752712	IJ	On-Demand	Anodyne	KCNQ2	38	49
CCn1c(Cc2ccccc2)nnc1S[C@@H](C)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853752713	IJ	On-Demand	Anodyne	KCNQ2	38	49
CCCCCCn1ccc2cc(OC)c(OC)cc2c1=O	ZINC000853752714	CH	On-Demand	Anodyne	CNR2	26	46
CCCCCCn1ccc2cc(OC)c(OC)cc2c1=O	ZINC000853752714	CH	On-Demand	Anodyne	GRM2	16	40
COCCc1ccc(OC[C@@H](O)CNc2nccc3c2C(=O)OC3(C)C)cc1	ZINC000853752727	GF	On-Demand	Anodyne	ADRB2	30	50
COCCc1ccc(OC[C@@H](O)CNc2nccc3c2C(=O)OC3(C)C)cc1	ZINC000853752727	GF	On-Demand	Anodyne	ADRB1	51	50
COCCc1ccc(OC[C@H](O)CNc2nccc3c2C(=O)OC3(C)C)cc1	ZINC000853752728	GF	On-Demand	Anodyne	ADRB2	30	50
COCCc1ccc(OC[C@H](O)CNc2nccc3c2C(=O)OC3(C)C)cc1	ZINC000853752728	GF	On-Demand	Anodyne	ADRB1	51	50
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752729	FD	On-Demand	Anodyne	ADRB2	35	55
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752729	FD	On-Demand	Anodyne	ADRB1	53	55
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752729	FD	On-Demand	Anodyne	GRIN1	28	42
COCCc1ccc(OC[C@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752729	FD	On-Demand	Anodyne	ADRB3	38	43
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752730	FD	On-Demand	Anodyne	ADRB2	35	55
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752730	FD	On-Demand	Anodyne	ADRB1	53	55
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752730	FD	On-Demand	Anodyne	GRIN1	28	42
COCCc1ccc(OC[C@@H](O)CNc2cc(Cl)nc(N)n2)cc1	ZINC000853752730	FD	On-Demand	Anodyne	ADRB3	38	43
O=S1(=O)CCC(COc2cccc(C3CCCCC3)c2)CC1	ZINC000853752799	DH	On-Demand	Anodyne	CHRNA10	74	36
COCCc1ccc(OC[C@H](O)CNc2snc(Cl)c2C#N)cc1	ZINC000853752800	FF	On-Demand	Mild	ADRB2	31	52
COCCc1ccc(OC[C@H](O)CNc2snc(Cl)c2C#N)cc1	ZINC000853752800	FF	On-Demand	Mild	ADRB1	50	52
COCCc1ccc(OC[C@H](O)CNc2snc(Cl)c2C#N)cc1	ZINC000853752800	FF	On-Demand	Mild	ADRB3	32	41
COCCc1ccc(OC[C@@H](O)CNc2snc(Cl)c2C#N)cc1	ZINC000853752801	FF	On-Demand	Mild	ADRB2	31	52
COCCc1ccc(OC[C@@H](O)CNc2snc(Cl)c2C#N)cc1	ZINC000853752801	FF	On-Demand	Mild	ADRB1	50	52
COCCc1ccc(OC[C@@H](O)CNc2snc(Cl)c2C#N)cc1	ZINC000853752801	FF	On-Demand	Mild	ADRB3	32	41
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)c2[N+](=O)[O-])cc1	ZINC000853752833	FF	On-Demand	Bother	ADRB2	36	53
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)c2[N+](=O)[O-])cc1	ZINC000853752833	FF	On-Demand	Bother	ADRB1	60	53
COCCc1ccc(OC[C@@H](O)CNc2cccc(F)c2[N+](=O)[O-])cc1	ZINC000853752833	FF	On-Demand	Bother	ADRB3	39	41
COCCc1ccc(OC[C@H](O)CNc2cccc(F)c2[N+](=O)[O-])cc1	ZINC000853752834	FF	On-Demand	Bother	ADRB2	36	53
COCCc1ccc(OC[C@H](O)CNc2cccc(F)c2[N+](=O)[O-])cc1	ZINC000853752834	FF	On-Demand	Bother	ADRB1	60	53
COCCc1ccc(OC[C@H](O)CNc2cccc(F)c2[N+](=O)[O-])cc1	ZINC000853752834	FF	On-Demand	Bother	ADRB3	39	41
Cc1ncc2c(n1)CCC[C@H]2NC(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853752858	FF	On-Demand	Anodyne	CCR3	44	35
Cc1ncc2c(n1)CCC[C@H]2NC(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853752859	FF	On-Demand	Anodyne	CCR3	44	35
COCCc1ccc(OC[C@H](O)CNc2nc(Cl)c(C#N)s2)cc1	ZINC000853752862	FF	On-Demand	Mild	ADRB2	35	53
COCCc1ccc(OC[C@H](O)CNc2nc(Cl)c(C#N)s2)cc1	ZINC000853752862	FF	On-Demand	Mild	ADRB1	53	53
COCCc1ccc(OC[C@H](O)CNc2nc(Cl)c(C#N)s2)cc1	ZINC000853752862	FF	On-Demand	Mild	ADRB3	34	44
COCCc1ccc(OC[C@@H](O)CNc2nc(Cl)c(C#N)s2)cc1	ZINC000853752863	FF	On-Demand	Mild	ADRB2	35	53
COCCc1ccc(OC[C@@H](O)CNc2nc(Cl)c(C#N)s2)cc1	ZINC000853752863	FF	On-Demand	Mild	ADRB1	53	53
COCCc1ccc(OC[C@@H](O)CNc2nc(Cl)c(C#N)s2)cc1	ZINC000853752863	FF	On-Demand	Mild	ADRB3	34	44
c1cnc(COc2cccc(C3CCCCC3)c2)nc1	ZINC000853752864	CI	On-Demand	Anodyne	CHRNA10	53	31
COCCc1ccc(OC[C@H](O)CNc2cc(F)ncn2)cc1	ZINC000853752876	DD	On-Demand	Anodyne	ADRB2	39	58
COCCc1ccc(OC[C@H](O)CNc2cc(F)ncn2)cc1	ZINC000853752876	DD	On-Demand	Anodyne	ADRB1	56	58
COCCc1ccc(OC[C@H](O)CNc2cc(F)ncn2)cc1	ZINC000853752876	DD	On-Demand	Anodyne	ADRB3	39	42
COCCc1ccc(OC[C@@H](O)CNc2cc(F)ncn2)cc1	ZINC000853752877	DD	On-Demand	Anodyne	ADRB2	39	58
COCCc1ccc(OC[C@@H](O)CNc2cc(F)ncn2)cc1	ZINC000853752877	DD	On-Demand	Anodyne	ADRB1	56	58
COCCc1ccc(OC[C@@H](O)CNc2cc(F)ncn2)cc1	ZINC000853752877	DD	On-Demand	Anodyne	ADRB3	39	42
COCCc1ccc(OC[C@@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752878	GG	On-Demand	Mild	ADRB2	36	50
COCCc1ccc(OC[C@@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752878	GG	On-Demand	Mild	ADRB1	60	50
COCCc1ccc(OC[C@@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752878	GG	On-Demand	Mild	ADRB3	35	44
COCCc1ccc(OC[C@@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752878	GG	On-Demand	Mild	CASR	47	43
COCCc1ccc(OC[C@@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752878	GG	On-Demand	Mild	CYP2D6	23	44
COCCc1ccc(OC[C@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752879	GG	On-Demand	Mild	ADRB2	36	50
COCCc1ccc(OC[C@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752879	GG	On-Demand	Mild	ADRB1	60	50
COCCc1ccc(OC[C@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752879	GG	On-Demand	Mild	ADRB3	35	44
COCCc1ccc(OC[C@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752879	GG	On-Demand	Mild	CASR	47	43
COCCc1ccc(OC[C@H](O)CNc2nc3ccccc3cc2C#N)cc1	ZINC000853752879	GG	On-Demand	Mild	CYP2D6	23	44
C#Cc1cccnc1NC[C@H](O)COc1ccc(CCOC)cc1	ZINC000853752892	EE	On-Demand	Mild	ADRB2	35	55
C#Cc1cccnc1NC[C@H](O)COc1ccc(CCOC)cc1	ZINC000853752892	EE	On-Demand	Mild	ADRB1	53	55
C#Cc1cccnc1NC[C@H](O)COc1ccc(CCOC)cc1	ZINC000853752892	EE	On-Demand	Mild	ADRB3	36	40
C#Cc1cccnc1NC[C@@H](O)COc1ccc(CCOC)cc1	ZINC000853752893	EE	On-Demand	Mild	ADRB2	35	55
C#Cc1cccnc1NC[C@@H](O)COc1ccc(CCOC)cc1	ZINC000853752893	EE	On-Demand	Mild	ADRB1	53	55
C#Cc1cccnc1NC[C@@H](O)COc1ccc(CCOC)cc1	ZINC000853752893	EE	On-Demand	Mild	ADRB3	36	40
COCCc1ccc(OC[C@@H](O)CNc2cc(N)ccc2[N+](=O)[O-])cc1	ZINC000853752899	FE	On-Demand	Bother	ADRB2	31	52
COCCc1ccc(OC[C@@H](O)CNc2cc(N)ccc2[N+](=O)[O-])cc1	ZINC000853752899	FE	On-Demand	Bother	ADRB1	48	52
COCCc1ccc(OC[C@@H](O)CNc2cc(N)ccc2[N+](=O)[O-])cc1	ZINC000853752899	FE	On-Demand	Bother	ADRB3	33	43
COCCc1ccc(OC[C@H](O)CNc2cc(N)ccc2[N+](=O)[O-])cc1	ZINC000853752900	FE	On-Demand	Bother	ADRB2	31	52
COCCc1ccc(OC[C@H](O)CNc2cc(N)ccc2[N+](=O)[O-])cc1	ZINC000853752900	FE	On-Demand	Bother	ADRB1	48	52
COCCc1ccc(OC[C@H](O)CNc2cc(N)ccc2[N+](=O)[O-])cc1	ZINC000853752900	FE	On-Demand	Bother	ADRB3	33	43
COCCc1ccc(OC[C@@H](O)CNc2nccc(C)n2)cc1	ZINC000853752909	DD	On-Demand	Anodyne	ADRB2	38	59
COCCc1ccc(OC[C@@H](O)CNc2nccc(C)n2)cc1	ZINC000853752909	DD	On-Demand	Anodyne	ADRB1	55	59
COCCc1ccc(OC[C@@H](O)CNc2nccc(C)n2)cc1	ZINC000853752909	DD	On-Demand	Anodyne	ADRB3	38	46
COCCc1ccc(OC[C@H](O)CNc2nccc(C)n2)cc1	ZINC000853752910	DD	On-Demand	Anodyne	ADRB2	38	59
COCCc1ccc(OC[C@H](O)CNc2nccc(C)n2)cc1	ZINC000853752910	DD	On-Demand	Anodyne	ADRB1	55	59
COCCc1ccc(OC[C@H](O)CNc2nccc(C)n2)cc1	ZINC000853752910	DD	On-Demand	Anodyne	ADRB3	38	46
COCCc1ccc(OC[C@@H](O)CNc2ncc(SC)cn2)cc1	ZINC000853752911	EE	On-Demand	Anodyne	ADRB2	36	59
COCCc1ccc(OC[C@@H](O)CNc2ncc(SC)cn2)cc1	ZINC000853752911	EE	On-Demand	Anodyne	ADRB1	53	59
COCCc1ccc(OC[C@@H](O)CNc2ncc(SC)cn2)cc1	ZINC000853752911	EE	On-Demand	Anodyne	ADRB3	38	43
COCCc1ccc(OC[C@H](O)CNc2ncc(SC)cn2)cc1	ZINC000853752912	EE	On-Demand	Anodyne	ADRB2	36	59
COCCc1ccc(OC[C@H](O)CNc2ncc(SC)cn2)cc1	ZINC000853752912	EE	On-Demand	Anodyne	ADRB1	53	59
COCCc1ccc(OC[C@H](O)CNc2ncc(SC)cn2)cc1	ZINC000853752912	EE	On-Demand	Anodyne	ADRB3	38	43
Fc1cccc(OCCON=C[C@H]2CCCO2)c1	ZINC000853753056	CE	On-Demand	Mild	CHRNA10	34	43
Fc1cccc(OCCON=C[C@@H]2CCCO2)c1	ZINC000853753057	CE	On-Demand	Mild	CHRNA10	34	43
C[C@@H](ON=C[C@H]1CCCO1)c1nc(-c2cccs2)no1	ZINC000853753127	CG	On-Demand	Mild	ETHR	31	41
C[C@@H](ON=C[C@@H]1CCCO1)c1nc(-c2cccs2)no1	ZINC000853753132	CG	On-Demand	Mild	ETHR	31	41
CN(CCOc1ccc(Br)cc1)C(=O)CON=C[C@@H]1CCCO1	ZINC000853753231	GE	On-Demand	Mild	SHC	45	37
CN(CCOc1ccc(Br)cc1)C(=O)CON=C[C@@H]1CCCO1	ZINC000853753231	GE	On-Demand	Mild	LSS	30	42
CN(CCOc1ccc(Br)cc1)C(=O)CON=C[C@H]1CCCO1	ZINC000853753232	GE	On-Demand	Mild	SHC	45	37
CN(CCOc1ccc(Br)cc1)C(=O)CON=C[C@H]1CCCO1	ZINC000853753232	GE	On-Demand	Mild	LSS	30	42
CN(CC(C)(C)NC(=O)OC(C)(C)C)c1ccnc(N2CCOCC2)n1	ZINC000853753406	FE	On-Demand	Anodyne	EPHB4	77	34
CN(CC(C)(C)NC(=O)OC(C)(C)C)c1nccc(N2CCOCC2)n1	ZINC000853753552	FE	On-Demand	Anodyne	EPHB4	66	34
Cc1oc(-c2ccccc2)nc1CON=C[C@@H]1CCCO1	ZINC000853753618	CG	On-Demand	Mild	PPARG	69	43
Cc1oc(-c2ccccc2)nc1CON=C[C@@H]1CCCO1	ZINC000853753618	CG	On-Demand	Mild	PPARA	74	43
Cc1oc(-c2ccccc2)nc1CON=C[C@@H]1CCCO1	ZINC000853753618	CG	On-Demand	Mild	PDE8B	59	41
Cc1oc(-c2ccccc2)nc1CON=C[C@H]1CCCO1	ZINC000853753620	CG	On-Demand	Mild	PPARG	69	43
Cc1oc(-c2ccccc2)nc1CON=C[C@H]1CCCO1	ZINC000853753620	CG	On-Demand	Mild	PPARA	74	43
Cc1oc(-c2ccccc2)nc1CON=C[C@H]1CCCO1	ZINC000853753620	CG	On-Demand	Mild	PDE8B	59	41
FC(F)(F)c1cccc(OCCCCON=C[C@@H]2CCCO2)c1	ZINC000853753621	EI	On-Demand	Mild	GALR3	41	33
FC(F)(F)c1cccc(OCCCCON=C[C@H]2CCCO2)c1	ZINC000853753623	EI	On-Demand	Mild	GALR3	41	33
O=C(CON=C[C@@H]1CCCO1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853753742	FD	On-Demand	Mild	L3MBTL3	64	37
O=C(CON=C[C@H]1CCCO1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853753743	FD	On-Demand	Mild	L3MBTL3	64	37
COc1ccc(NC(=O)[C@H](C)ON=C[C@@H]2CCCO2)cc1OC	ZINC000853753789	DE	On-Demand	Mild	ENPP1	48	31
COc1ccc(NC(=O)[C@H](C)ON=C[C@H]2CCCO2)cc1OC	ZINC000853753793	DE	On-Demand	Mild	ENPP1	48	31
O=C(CON=C[C@@H]1CCCO1)N[C@@H]1CCOc2ccccc21	ZINC000853753833	DD	On-Demand	Mild	LUXR	63	35
O=C(CON=C[C@@H]1CCCO1)N[C@@H]1CCOc2ccccc21	ZINC000853753833	DD	On-Demand	Mild	TRAR	78	36
O=C(CON=C[C@@H]1CCCO1)N[C@H]1CCOc2ccccc21	ZINC000853753835	DD	On-Demand	Mild	LUXR	63	35
O=C(CON=C[C@@H]1CCCO1)N[C@H]1CCOc2ccccc21	ZINC000853753835	DD	On-Demand	Mild	TRAR	78	36
O=C(CON=C[C@H]1CCCO1)N[C@H]1CCOc2ccccc21	ZINC000853753837	DD	On-Demand	Mild	LUXR	63	35
O=C(CON=C[C@H]1CCCO1)N[C@H]1CCOc2ccccc21	ZINC000853753837	DD	On-Demand	Mild	TRAR	78	36
O=C(CON=C[C@H]1CCCO1)N[C@@H]1CCOc2ccccc21	ZINC000853753839	DD	On-Demand	Mild	LUXR	63	35
O=C(CON=C[C@H]1CCCO1)N[C@@H]1CCOc2ccccc21	ZINC000853753839	DD	On-Demand	Mild	TRAR	78	36
CN(CC(C)(C)NC(=O)OC(C)(C)C)c1ncnc2c1ncn2C1CC1	ZINC000853753893	FF	On-Demand	Anodyne	OXGR1	47	32
O=C(c1cccc(CON=C[C@@H]2CCCO2)c1)N1CCCCC1	ZINC000853753964	DF	On-Demand	Mild	L3MBTL3	49	40
O=C(c1cccc(CON=C[C@H]2CCCO2)c1)N1CCCCC1	ZINC000853753966	DF	On-Demand	Mild	L3MBTL3	49	40
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(F)c(Cl)c1	ZINC000853753998	DF	On-Demand	Mild	ERBB4	43	32
O=C(CON=C[C@H]1CCCO1)Nc1ccc(F)c(Cl)c1	ZINC000853753999	DF	On-Demand	Mild	ERBB4	43	32
COc1cccc(C2(NC(=O)NCC[S@](=O)C(C)(C)C)CCC2)c1	ZINC000853754002	FF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C2(NC(=O)NCC[S@@](=O)C(C)(C)C)CCC2)c1	ZINC000853754004	FF	On-Demand	Anodyne	DRD4	41	32
C[C@@H](ON=C[C@H]1CCCO1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853754026	EG	On-Demand	Mild	RBP4	48	39
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853754028	EG	On-Demand	Mild	RBP4	48	39
O=C(Nc1ccccc1)c1cccc(CON=C[C@H]2CCCO2)c1	ZINC000853754223	DH	On-Demand	Mild	KCNK3	88	39
O=C(Nc1ccccc1)c1cccc(CON=C[C@H]2CCCO2)c1	ZINC000853754223	DH	On-Demand	Mild	KCNK9	40	36
O=C(Nc1ccccc1)c1cccc(CON=C[C@@H]2CCCO2)c1	ZINC000853754225	DH	On-Demand	Mild	KCNK3	88	39
O=C(Nc1ccccc1)c1cccc(CON=C[C@@H]2CCCO2)c1	ZINC000853754225	DH	On-Demand	Mild	KCNK9	40	36
O=C(CON=C[C@H]1CCCO1)NCc1ccc(OC(F)(F)F)cc1	ZINC000853754230	EE	On-Demand	Mild	CTSS	15	40
O=C(CON=C[C@H]1CCCO1)NCc1ccc(OC(F)(F)F)cc1	ZINC000853754230	EE	On-Demand	Mild	TRAR	17	40
O=C(CON=C[C@@H]1CCCO1)NCc1ccc(OC(F)(F)F)cc1	ZINC000853754232	EE	On-Demand	Mild	CTSS	15	40
O=C(CON=C[C@@H]1CCCO1)NCc1ccc(OC(F)(F)F)cc1	ZINC000853754232	EE	On-Demand	Mild	TRAR	17	40
COc1ccccc1CNC(=O)[C@H](C)ON=C[C@H]1CCCO1	ZINC000853754307	DD	On-Demand	Mild	MBTPS1	49	34
COc1ccccc1CNC(=O)[C@H](C)ON=C[C@@H]1CCCO1	ZINC000853754308	DD	On-Demand	Mild	MBTPS1	49	34
COc1ccccc1CNC(=O)[C@@H](C)ON=C[C@@H]1CCCO1	ZINC000853754309	DD	On-Demand	Mild	MBTPS1	49	34
COc1ccccc1CNC(=O)[C@@H](C)ON=C[C@H]1CCCO1	ZINC000853754310	DD	On-Demand	Mild	MBTPS1	49	34
CN(CC(C)(C)NC(=O)OC(C)(C)C)c1ncnc2[nH]ccc12	ZINC000853754477	DF	On-Demand	Anodyne	JAK3	23	41
COc1ccc([C@@H]2CCCN2C(=O)CON=C[C@@H]2CCCO2)c(OC)c1	ZINC000853754525	FF	On-Demand	Mild	CPT1A	70	38
COc1ccc([C@@H]2CCCN2C(=O)CON=C[C@H]2CCCO2)c(OC)c1	ZINC000853754526	FF	On-Demand	Mild	CPT1A	70	38
O=C(CON=C[C@@H]1CCCO1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853754562	FH	On-Demand	Mild	CPT1A	87	35
O=C(CON=C[C@H]1CCCO1)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853754563	FH	On-Demand	Mild	CPT1A	87	35
O=C(CON=C[C@H]1CCCO1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853754564	FH	On-Demand	Mild	CPT1A	87	35
O=C(CON=C[C@@H]1CCCO1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853754565	FH	On-Demand	Mild	CPT1A	87	35
O=C(CON=C[C@H]1CCCO1)NCC1(c2ccccc2)CCCCC1	ZINC000853754583	EG	On-Demand	Mild	KCNA3	47	38
O=C(CON=C[C@@H]1CCCO1)NCC1(c2ccccc2)CCCCC1	ZINC000853754584	EG	On-Demand	Mild	KCNA3	47	38
O=C(CON=C[C@H]1CCCO1)Nc1ccccc1N1CCCC1=O	ZINC000853754674	ED	On-Demand	Mild	KCNQ2	41	35
O=C(CON=C[C@@H]1CCCO1)Nc1ccccc1N1CCCC1=O	ZINC000853754675	ED	On-Demand	Mild	KCNQ2	41	35
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853754785	ED	On-Demand	Mild	MTOR	66	37
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853754785	ED	On-Demand	Mild	STAT6	41	31
O=C(CON=C[C@H]1CCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853754786	ED	On-Demand	Mild	MTOR	66	37
O=C(CON=C[C@H]1CCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853754786	ED	On-Demand	Mild	STAT6	41	31
COc1ccc(CNC(=O)[C@H](C)ON=C[C@H]2CCCO2)cc1OC	ZINC000853754851	ED	On-Demand	Mild	MT-ND1	23	41
COc1ccc(CNC(=O)[C@H](C)ON=C[C@@H]2CCCO2)cc1OC	ZINC000853754852	ED	On-Demand	Mild	MT-ND1	23	41
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754905	GD	On-Demand	Mild	LPL	45	36
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754905	GD	On-Demand	Mild	TGM2	44	42
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754905	GD	On-Demand	Mild	ST14	41	35
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754905	GD	On-Demand	Mild	F13A1	65	42
O=C(CON=C[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754906	GD	On-Demand	Mild	LPL	45	36
O=C(CON=C[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754906	GD	On-Demand	Mild	TGM2	44	42
O=C(CON=C[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754906	GD	On-Demand	Mild	ST14	41	35
O=C(CON=C[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853754906	GD	On-Demand	Mild	F13A1	65	42
O=C(CON=C[C@H]1CCCO1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853754924	EF	On-Demand	Mild	CTSS	18	45
O=C(CON=C[C@H]1CCCO1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853754924	EF	On-Demand	Mild	EPHX2	55	45
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853754925	EF	On-Demand	Mild	CTSS	18	45
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853754925	EF	On-Demand	Mild	EPHX2	55	45
O=C(CON=C[C@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000853754928	DF	On-Demand	Mild	EPHX2	30	40
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(C(F)(F)F)cc1	ZINC000853754929	DF	On-Demand	Mild	EPHX2	30	40
Cc1nnc(NCc2cccc(NC(=O)OC(C)(C)C)c2)s1	ZINC000853754971	DH	On-Demand	Anodyne	KCNK3	44	31
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853754980	EF	On-Demand	Mild	HTR1A	21	49
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853754980	EF	On-Demand	Mild	HTR1D	32	49
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853754980	EF	On-Demand	Mild	HTR1B	26	49
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853754980	EF	On-Demand	Mild	SLC6A4	22	47
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853754980	EF	On-Demand	Mild	MPO	104	49
CN(C(=O)NCC[S@](=O)C(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853754995	ED	On-Demand	Anodyne	NPY5R	15	41
CN(C(=O)NCC[S@@](=O)C(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853754996	ED	On-Demand	Anodyne	NPY5R	15	41
CN(C(=O)NCC[S@@](=O)C(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853754997	ED	On-Demand	Anodyne	NPY5R	15	41
CN(C(=O)NCC[S@](=O)C(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853754998	ED	On-Demand	Anodyne	NPY5R	15	41
O=C(CON=C[C@@H]1CCCO1)NCCCc1ccccc1	ZINC000853755047	CD	On-Demand	Mild	CRTM	35	40
O=C(CON=C[C@@H]1CCCO1)NCCCc1ccccc1	ZINC000853755047	CD	On-Demand	Mild	CES1D	53	31
O=C(CON=C[C@H]1CCCO1)NCCCc1ccccc1	ZINC000853755048	CD	On-Demand	Mild	CRTM	35	40
O=C(CON=C[C@H]1CCCO1)NCCCc1ccccc1	ZINC000853755048	CD	On-Demand	Mild	CES1D	53	31
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853755118	EG	On-Demand	Mild	KCNK3	16	40
C[C@@H](ON=C[C@H]1CCCO1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853755119	EG	On-Demand	Mild	KCNK3	16	40
O=C(CON=C[C@H]1CCCO1)N1CCC(Cc2ccccc2)CC1	ZINC000853755143	EF	On-Demand	Mild	GRIN2B	74	49
O=C(CON=C[C@@H]1CCCO1)N1CCC(Cc2ccccc2)CC1	ZINC000853755144	EF	On-Demand	Mild	GRIN2B	74	49
O=C(CON=C[C@H]1CCCO1)Nc1ccc(Oc2ccccc2)cc1	ZINC000853755149	EH	On-Demand	Mild	LTA4H	54	43
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(Oc2ccccc2)cc1	ZINC000853755150	EH	On-Demand	Mild	LTA4H	54	43
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCc1nnc(S)n1C1CC1	ZINC000853755163	GF	On-Demand	Anodyne	HTR1A	19	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCc1nnc(S)n1C1CC1	ZINC000853755163	GF	On-Demand	Anodyne	HTR1D	35	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCc1nnc(S)n1C1CC1	ZINC000853755163	GF	On-Demand	Anodyne	HTR1B	30	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCc1nnc(S)n1C1CC1	ZINC000853755163	GF	On-Demand	Anodyne	SLC6A4	24	45
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCc1nnc(S)n1C1CC1	ZINC000853755163	GF	On-Demand	Anodyne	MPO	97	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755178	FF	On-Demand	Mild	HTR1A	16	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755178	FF	On-Demand	Mild	HTR1D	19	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755178	FF	On-Demand	Mild	HTR1B	16	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755178	FF	On-Demand	Mild	SLC6A4	19	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755178	FF	On-Demand	Mild	MPO	101	48
Cc1cccc(NC(=O)[C@H](C)ON=C[C@@H]2CCCO2)c1	ZINC000853755188	CF	On-Demand	Mild	KCNK3	55	36
Cc1cccc(NC(=O)[C@H](C)ON=C[C@@H]2CCCO2)c1	ZINC000853755188	CF	On-Demand	Mild	KCNK9	42	36
Cc1cccc(NC(=O)[C@@H](C)ON=C[C@@H]2CCCO2)c1	ZINC000853755189	CF	On-Demand	Mild	KCNK3	55	36
Cc1cccc(NC(=O)[C@@H](C)ON=C[C@@H]2CCCO2)c1	ZINC000853755189	CF	On-Demand	Mild	KCNK9	42	36
Cc1cccc(NC(=O)[C@@H](C)ON=C[C@H]2CCCO2)c1	ZINC000853755190	CF	On-Demand	Mild	KCNK3	55	36
Cc1cccc(NC(=O)[C@@H](C)ON=C[C@H]2CCCO2)c1	ZINC000853755190	CF	On-Demand	Mild	KCNK9	42	36
N#Cc1ccc(NC(=O)CON=C[C@H]2CCCO2)cc1	ZINC000853755191	CD	On-Demand	Mild	PFKFB3	50	32
N#Cc1ccc(NC(=O)CON=C[C@@H]2CCCO2)cc1	ZINC000853755192	CD	On-Demand	Mild	PFKFB3	50	32
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755194	FD	On-Demand	Anodyne	HTR1A	20	50
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755194	FD	On-Demand	Anodyne	HTR1D	52	50
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755194	FD	On-Demand	Anodyne	HTR1B	39	50
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755194	FD	On-Demand	Anodyne	SLC6A4	22	48
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755194	FD	On-Demand	Anodyne	MPO	107	51
COCc1cc([N+](=O)[O-])ccc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853755216	GJ	On-Demand	Bother	CACNA1C	43	36
COCc1cc([N+](=O)[O-])ccc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853755216	GJ	On-Demand	Bother	CACNA1D	72	36
COCc1cc([N+](=O)[O-])ccc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853755216	GJ	On-Demand	Bother	TAAR1	16	42
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853755226	FG	On-Demand	Mild	RAF1	26	41
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853755226	FG	On-Demand	Mild	IMDH_CRYPV	17	41
O=C(CON=C[C@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853755227	FG	On-Demand	Mild	RAF1	26	41
O=C(CON=C[C@H]1CCCO1)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853755227	FG	On-Demand	Mild	IMDH_CRYPV	17	41
O=C(CON=C[C@@H]1CCCO1)NC12CC3CC(CC(C3)C1)C2	ZINC000853755230	DE	On-Demand	Mild	EPHX2	48	40
O=C(CON=C[C@H]1CCCO1)NC12CC3CC(CC(C3)C1)C2	ZINC000853755231	DE	On-Demand	Mild	EPHX2	48	40
O=C(CON=C[C@@H]1CCCO1)N1CCCc2ccccc21	ZINC000853755243	CE	On-Demand	Mild	AVPR2	33	41
O=C(CON=C[C@H]1CCCO1)N1CCCc2ccccc21	ZINC000853755244	CE	On-Demand	Mild	AVPR2	33	41
O=C(CON=C[C@H]1CCCO1)Nc1cccc(C(F)(F)F)c1	ZINC000853755250	DF	On-Demand	Mild	CCR2	42	42
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(C(F)(F)F)c1	ZINC000853755251	DF	On-Demand	Mild	CCR2	42	42
Cn1ncc(NCc2cccc(NC(=O)OC(C)(C)C)c2)c(Cl)c1=O	ZINC000853755271	FG	On-Demand	Anodyne	FLT1	16	44
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755277	EE	On-Demand	Anodyne	HTR1A	26	51
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755277	EE	On-Demand	Anodyne	HTR1D	50	49
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755277	EE	On-Demand	Anodyne	HTR1B	33	49
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755277	EE	On-Demand	Anodyne	SLC6A4	24	51
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755277	EE	On-Demand	Anodyne	MPO	109	52
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755277	EE	On-Demand	Anodyne	MTNR1A	17	49
N#Cc1cn(CC(=O)Nc2ccc(N3CCCCC3)cc2)c(=O)c2ccccc12	ZINC000853755296	GH	On-Demand	Mild	PFKFB3	50	36
Cc1nc(NCc2cccc(NC(=O)OC(C)(C)C)c2)cc(-c2cccnc2)n1	ZINC000853755307	GJ	On-Demand	Anodyne	ABL1	16	40
Cc1nc(NCc2cccc(NC(=O)OC(C)(C)C)c2)cc(-c2cccnc2)n1	ZINC000853755307	GJ	On-Demand	Anodyne	VCP	34	43
Cc1nc(NCc2cccc(NC(=O)OC(C)(C)C)c2)cc(-c2cccnc2)n1	ZINC000853755307	GJ	On-Demand	Anodyne	NAMPT	19	46
N#Cc1cn(CC(=O)NC2CCCCCCC2)c(=O)c2ccccc12	ZINC000853755316	EG	On-Demand	Mild	CNR2	22	41
N#Cc1cn(CC(=O)NC2CCCCCCC2)c(=O)c2ccccc12	ZINC000853755316	EG	On-Demand	Mild	PFKFB3	44	35
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853755328	FE	On-Demand	Anodyne	HTR1A	23	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853755328	FE	On-Demand	Anodyne	HTR1D	55	36
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853755328	FE	On-Demand	Anodyne	HTR1B	46	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853755328	FE	On-Demand	Anodyne	SLC6A4	30	43
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853755328	FE	On-Demand	Anodyne	MPO	95	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853755329	FE	On-Demand	Anodyne	HTR1A	23	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853755329	FE	On-Demand	Anodyne	HTR1D	55	36
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853755329	FE	On-Demand	Anodyne	HTR1B	46	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853755329	FE	On-Demand	Anodyne	SLC6A4	30	43
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853755329	FE	On-Demand	Anodyne	MPO	95	44
CON(C)CCNC(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000853755338	GB	On-Demand	Bother	COLA	92	38
CC(C)(C)OC(=O)N1CC[C@H](CCn2cc(C#N)c3ccccc3c2=O)C1	ZINC000853755366	FH	On-Demand	Mild	GPR119	36	41
CC(C)(C)OC(=O)N1CC[C@@H](CCn2cc(C#N)c3ccccc3c2=O)C1	ZINC000853755367	FH	On-Demand	Mild	GPR119	36	41
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	HTR1A	27	54
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	HTR1D	62	54
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	HTR1B	41	54
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	SLC6A4	27	54
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	NQO2	31	52
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	MPO	117	59
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	HTR5A	19	43
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	MTNR1A	38	62
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(F)cc12	ZINC000853755375	DD	On-Demand	Anodyne	MTNR1B	23	52
CC(C)c1cccc(C(C)C)c1NC(=O)CON=C[C@@H]1CCCO1	ZINC000853755379	EI	On-Demand	Mild	SOAT1	51	42
CC(C)c1cccc(C(C)C)c1NC(=O)CON=C[C@H]1CCCO1	ZINC000853755380	EI	On-Demand	Mild	SOAT1	51	42
C[C@@H](ON=C[C@H]1CCCO1)C(=O)Nc1ccccc1	ZINC000853755387	CE	On-Demand	Mild	TIMP3	63	34
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)Nc1ccccc1	ZINC000853755389	CE	On-Demand	Mild	TIMP3	63	34
CC(C)(C)N(Cc1ccccc1)C(=O)CON=C[C@@H]1CCCO1	ZINC000853755392	DF	On-Demand	Mild	AMY2	42	29
CC(C)(C)N(Cc1ccccc1)C(=O)CON=C[C@H]1CCCO1	ZINC000853755393	DF	On-Demand	Mild	AMY2	42	29
COCCN(CCF)C(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000853755416	GC	On-Demand	Bother	COLA	68	35
O=C1CCC2=C(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)N1	ZINC000853755476	FE	On-Demand	Anodyne	HTR1A	17	45
O=C1CCC2=C(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)N1	ZINC000853755476	FE	On-Demand	Anodyne	HTR1D	40	45
O=C1CCC2=C(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)N1	ZINC000853755476	FE	On-Demand	Anodyne	HTR1B	32	45
O=C1CCC2=C(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)N1	ZINC000853755476	FE	On-Demand	Anodyne	SLC6A4	20	44
O=C1CCC2=C(CCN(C(=O)NCCc3c[nH]c4ccc(F)cc34)C2)N1	ZINC000853755476	FE	On-Demand	Anodyne	MPO	97	45
C[C@@H](ON=C[C@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755479	FH	On-Demand	Mild	TSHR	49	33
C[C@@H](ON=C[C@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755479	FH	On-Demand	Mild	LTA4H	26	52
C[C@@H](ON=C[C@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755479	FH	On-Demand	Mild	ADAM17	21	45
C[C@@H](ON=C[C@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755479	FH	On-Demand	Mild	TIMP3	64	35
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755480	FH	On-Demand	Mild	TSHR	49	33
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755480	FH	On-Demand	Mild	LTA4H	26	52
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755480	FH	On-Demand	Mild	ADAM17	21	45
C[C@@H](ON=C[C@@H]1CCCO1)C(=O)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755480	FH	On-Demand	Mild	TIMP3	64	35
O=C(CON=C[C@H]1CCCO1)Nc1ccc(-c2ccccc2)cc1	ZINC000853755482	DG	On-Demand	Mild	SLC1A2	18	41
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(-c2ccccc2)cc1	ZINC000853755483	DG	On-Demand	Mild	SLC1A2	18	41
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853755489	GE	On-Demand	Anodyne	HTR1A	17	46
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853755489	GE	On-Demand	Anodyne	HTR1D	19	43
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853755489	GE	On-Demand	Anodyne	SLC6A4	20	51
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853755489	GE	On-Demand	Anodyne	MPO	107	51
O=C(NCCc1c[nH]c2ccc(F)cc12)NCCS(=O)(=O)CC(F)(F)F	ZINC000853755489	GE	On-Demand	Anodyne	MTNR1A	17	54
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853755523	GC	On-Demand	Mild	EPHX2	15	49
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853755523	GC	On-Demand	Mild	TGM2	35	41
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853755523	GC	On-Demand	Mild	F13A1	55	41
O=C(CON=C[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853755524	GC	On-Demand	Mild	EPHX2	15	49
O=C(CON=C[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853755524	GC	On-Demand	Mild	TGM2	35	41
O=C(CON=C[C@H]1CCCO1)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853755524	GC	On-Demand	Mild	F13A1	55	41
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755548	FG	On-Demand	Mild	LTA4H	41	51
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755548	FG	On-Demand	Mild	ADAM17	16	48
O=C(CON=C[C@H]1CCCO1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755549	FG	On-Demand	Mild	LTA4H	41	51
O=C(CON=C[C@H]1CCCO1)Nc1ccc(OCc2ccccc2)cc1	ZINC000853755549	FG	On-Demand	Mild	ADAM17	16	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853755589	FG	On-Demand	Anodyne	HTR1A	24	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853755589	FG	On-Demand	Anodyne	HTR1D	54	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853755589	FG	On-Demand	Anodyne	HTR1B	49	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853755589	FG	On-Demand	Anodyne	SLC6A4	30	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853755589	FG	On-Demand	Anodyne	MPO	105	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853755590	FG	On-Demand	Anodyne	HTR1A	24	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853755590	FG	On-Demand	Anodyne	HTR1D	54	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853755590	FG	On-Demand	Anodyne	HTR1B	49	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853755590	FG	On-Demand	Anodyne	SLC6A4	30	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853755590	FG	On-Demand	Anodyne	MPO	105	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853755591	FG	On-Demand	Anodyne	HTR1A	24	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853755591	FG	On-Demand	Anodyne	HTR1D	54	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853755591	FG	On-Demand	Anodyne	HTR1B	49	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853755591	FG	On-Demand	Anodyne	SLC6A4	30	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853755591	FG	On-Demand	Anodyne	MPO	105	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853755592	FG	On-Demand	Anodyne	HTR1A	24	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853755592	FG	On-Demand	Anodyne	HTR1D	54	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853755592	FG	On-Demand	Anodyne	HTR1B	49	46
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853755592	FG	On-Demand	Anodyne	SLC6A4	30	48
O=C(NCCc1c[nH]c2ccc(F)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853755592	FG	On-Demand	Anodyne	MPO	105	48
CCOC(=O)N1CCN(C(=O)[C@H](C)n2cc(C#N)c3ccccc3c2=O)CC1	ZINC000853755602	GD	On-Demand	Mild	P2RY12	144	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2cc(C#N)c3ccccc3c2=O)CC1	ZINC000853755603	GD	On-Demand	Mild	P2RY12	144	43
Cn1cnc([N+](=O)[O-])c1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853755620	EG	On-Demand	Bother	FLT1	17	43
Cn1cnc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ncnc21	ZINC000853755641	FG	On-Demand	Anodyne	ADORA1	27	44
Cn1cnc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ncnc21	ZINC000853755641	FG	On-Demand	Anodyne	FLT1	15	43
Cn1cnc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ncnc21	ZINC000853755641	FG	On-Demand	Anodyne	PDE6A	43	36
Cn1cnc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ncnc21	ZINC000853755641	FG	On-Demand	Anodyne	ADORA3	100	50
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853755647	FE	On-Demand	Anodyne	HTR1A	24	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853755647	FE	On-Demand	Anodyne	HTR1D	61	36
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853755647	FE	On-Demand	Anodyne	HTR1B	50	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853755647	FE	On-Demand	Anodyne	SLC6A4	31	44
O=C(NCCc1c[nH]c2ccc(F)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853755647	FE	On-Demand	Anodyne	MPO	96	45
CC(C)(C)OC(=O)N1CCC(CCn2cc(C#N)c3ccccc3c2=O)CC1	ZINC000853755658	GH	On-Demand	Mild	CCR8	18	41
CC(C)(C)OC(=O)N1CCC(CCn2cc(C#N)c3ccccc3c2=O)CC1	ZINC000853755658	GH	On-Demand	Mild	GPR119	44	45
CC(C)(C)OC(=O)N1CCC(CCn2cc(C#N)c3ccccc3c2=O)CC1	ZINC000853755658	GH	On-Demand	Mild	PFKFB3	40	31
CCCCC[C@@H](C)NC(=O)Cn1cc(C#N)c2ccccc2c1=O	ZINC000853755662	EF	On-Demand	Mild	CTRB_BOVIN	48	35
CCCCCCn1cc(C#N)c2ccccc2c1=O	ZINC000853755664	CG	On-Demand	Mild	CNR1	26	43
CCCCCCn1cc(C#N)c2ccccc2c1=O	ZINC000853755664	CG	On-Demand	Mild	CNR2	42	45
C[C@@H](NC(=O)c1ccccc1NC(=O)CON=C[C@@H]1CCCO1)c1ccccc1	ZINC000853755665	GG	On-Demand	Mild	MTTP	53	34
C[C@H](NC(=O)c1ccccc1NC(=O)CON=C[C@H]1CCCO1)c1ccccc1	ZINC000853755666	GG	On-Demand	Mild	MTTP	53	34
C[C@@H](NC(=O)c1ccccc1NC(=O)CON=C[C@H]1CCCO1)c1ccccc1	ZINC000853755667	GG	On-Demand	Mild	MTTP	53	34
C[C@H](NC(=O)c1ccccc1NC(=O)CON=C[C@@H]1CCCO1)c1ccccc1	ZINC000853755668	GG	On-Demand	Mild	MTTP	53	34
O=C(CON=C[C@H]1CCCO1)Nc1cccc(Oc2ccccc2)c1	ZINC000853755672	EH	On-Demand	Mild	F13A1	15	42
O=C(CON=C[C@@H]1CCCO1)Nc1cccc(Oc2ccccc2)c1	ZINC000853755673	EH	On-Demand	Mild	F13A1	15	42
O=C(CON=C[C@@H]1CCCO1)Nc1ccc2c(c1)CCC2	ZINC000853755689	CE	On-Demand	Mild	PTPRF	40	31
O=C(CON=C[C@H]1CCCO1)Nc1ccc2c(c1)CCC2	ZINC000853755690	CE	On-Demand	Mild	PTPRF	40	31
CC(C)(C)OC(=O)N1CCC(Cn2cc(C#N)c3ccccc3c2=O)CC1	ZINC000853755699	FH	On-Demand	Mild	CCR8	18	41
CC(C)(C)OC(=O)N1CCC(Cn2cc(C#N)c3ccccc3c2=O)CC1	ZINC000853755699	FH	On-Demand	Mild	GPR119	43	45
Cn1ncc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ncnc21	ZINC000853755748	FG	On-Demand	Anodyne	PDE6A	43	36
Cn1ncc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ncnc21	ZINC000853755748	FG	On-Demand	Anodyne	ADORA3	31	40
COc1ccnc(NCc2cccc(NC(=O)OC(C)(C)C)c2)n1	ZINC000853755774	EG	On-Demand	Anodyne	ROCK2	18	40
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755778	GC	On-Demand	Mild	TGM2	81	43
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755778	GC	On-Demand	Mild	F13A1	93	43
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755778	GC	On-Demand	Mild	MERTK	32	42
O=C(CON=C[C@@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755778	GC	On-Demand	Mild	NAMPT	31	42
O=C(CON=C[C@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755779	GC	On-Demand	Mild	TGM2	81	43
O=C(CON=C[C@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755779	GC	On-Demand	Mild	F13A1	93	43
O=C(CON=C[C@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755779	GC	On-Demand	Mild	MERTK	32	42
O=C(CON=C[C@H]1CCCO1)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1	ZINC000853755779	GC	On-Demand	Mild	NAMPT	31	42
O=C(CON=C[C@@H]1CCCO1)Nc1ccc2ccccc2c1	ZINC000853755794	CF	On-Demand	Mild	IMDH_CRYPV	20	41
O=C(CON=C[C@H]1CCCO1)Nc1ccc2ccccc2c1	ZINC000853755795	CF	On-Demand	Mild	IMDH_CRYPV	20	41
O=C(CON=C[C@H]1CCCO1)NCc1ccc2c(c1)OCO2	ZINC000853755804	DD	On-Demand	Mild	NOS2	101	41
O=C(CON=C[C@@H]1CCCO1)NCc1ccc2c(c1)OCO2	ZINC000853755805	DD	On-Demand	Mild	NOS2	101	41
COC[C@H](NC(=O)NCC[S@@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755811	FE	On-Demand	Anodyne	DRD4	40	31
COC[C@H](NC(=O)NCC[S@@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755811	FE	On-Demand	Anodyne	MTNR1A	33	41
COC[C@H](NC(=O)NCC[S@@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755811	FE	On-Demand	Anodyne	MTNR1B	32	41
COC[C@@H](NC(=O)NCC[S@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755812	FE	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)NCC[S@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755812	FE	On-Demand	Anodyne	MTNR1A	33	41
COC[C@@H](NC(=O)NCC[S@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755812	FE	On-Demand	Anodyne	MTNR1B	32	41
COC[C@H](NC(=O)NCC[S@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755813	FE	On-Demand	Anodyne	DRD4	40	31
COC[C@H](NC(=O)NCC[S@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755813	FE	On-Demand	Anodyne	MTNR1A	33	41
COC[C@H](NC(=O)NCC[S@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755813	FE	On-Demand	Anodyne	MTNR1B	32	41
COC[C@@H](NC(=O)NCC[S@@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755814	FE	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)NCC[S@@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755814	FE	On-Demand	Anodyne	MTNR1A	33	41
COC[C@@H](NC(=O)NCC[S@@](=O)C(C)(C)C)c1cccc(OC)c1	ZINC000853755814	FE	On-Demand	Anodyne	MTNR1B	32	41
C#CCCN(CCOC)C(=O)NCCNS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000853755815	GC	On-Demand	Mild	COLA	46	34
C[C@@H]1Cc2ccccc2N1C(=O)CON=C[C@@H]1CCCO1	ZINC000853755820	CE	On-Demand	Mild	DRD4	24	42
C[C@@H]1Cc2ccccc2N1C(=O)CON=C[C@H]1CCCO1	ZINC000853755821	CE	On-Demand	Mild	DRD4	24	42
Cn1nnc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ncnc21	ZINC000853755830	FF	On-Demand	Anodyne	ADORA3	45	44
Cc1nc(NCc2cccc(NC(=O)OC(C)(C)C)c2)ccc1[N+](=O)[O-]	ZINC000853755837	FI	On-Demand	Bother	TAAR1	18	40
Cn1ncc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)nc(N)nc21	ZINC000853755843	FF	On-Demand	Anodyne	DRTS_TRYCR	43	30
O=C(c1cccc(OCc2cccc(C(=O)C(F)(F)F)c2)c1)N1CCOCC1	ZINC000853755845	GG	On-Demand	Anodyne	ITGAL	34	43
O=C(c1cccc(OCc2cccc(C(=O)C(F)(F)F)c2)c1)N1CCOCC1	ZINC000853755845	GG	On-Demand	Anodyne	EPHX2	17	44
Cn1ncc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)ccnc21	ZINC000853755847	FH	On-Demand	Anodyne	FLT1	19	42
C#CCNC(=O)COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853755848	DC	On-Demand	Mild	DRD4	43	32
C#CCNC(=O)COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853755848	DC	On-Demand	Mild	EPHX2	17	42
O=C(c1cccc(OCC2CCC3(CC2)OCCO3)c1)N1CCOCC1	ZINC000853755885	FE	On-Demand	Anodyne	ITGAL	18	40
O=C(c1cccc(OCC2CCC3(CC2)OCCO3)c1)N1CCOCC1	ZINC000853755885	FE	On-Demand	Anodyne	EPHX2	15	40
O=C(c1cccc(OCC2CCC3(CC2)OCCO3)c1)N1CCOCC1	ZINC000853755885	FE	On-Demand	Anodyne	C5AR1	15	40
C#CCN1CCN(C(=O)COc2cccc(C(=O)N3CCOCC3)c2)CC1	ZINC000853755899	FC	On-Demand	Mild	CPT1A	40	39
Cc1nc(NCc2cccc(NC(=O)OC(C)(C)C)c2)sc1S(N)(=O)=O	ZINC000853755911	GG	On-Demand	Anodyne	CA2	18	43
Cc1nc(NCc2cccc(NC(=O)OC(C)(C)C)c2)sc1S(N)(=O)=O	ZINC000853755911	GG	On-Demand	Anodyne	CA1	18	43
O=C(c1cccc(OCCC2OCCCO2)c1)N1CCOCC1	ZINC000853755920	DD	On-Demand	Anodyne	HRH3	24	45
O=C(c1cccc(OCCC2OCCCO2)c1)N1CCOCC1	ZINC000853755920	DD	On-Demand	Anodyne	EPHX2	22	42
O=C(c1cccc(OCCC2OCCCO2)c1)N1CCOCC1	ZINC000853755920	DD	On-Demand	Anodyne	L3MBTL3	34	40
COC(=O)Cn1cc(COc2cccc(C(=O)N3CCOCC3)c2)nn1	ZINC000853755940	FC	On-Demand	Anodyne	DRD4	40	31
Cc1cnc(COc2cccc(C(=O)N3CCOCC3)c2)s1	ZINC000853755960	DF	On-Demand	Anodyne	HRH3	17	43
O=C(c1cccc(OCc2c(F)c(F)c(F)c(F)c2F)c1)N1CCOCC1	ZINC000853755963	GG	On-Demand	Anodyne	EPHX2	17	43
CC(C)c1nnc2c(NCc3cccc(NC(=O)OC(C)(C)C)c3)nccn12	ZINC000853755965	GI	On-Demand	Anodyne	ZAP70	35	41
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)c1cccs1	ZINC000853755966	EF	On-Demand	Anodyne	FCER2	44	37
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)c1cccs1	ZINC000853755967	EF	On-Demand	Anodyne	FCER2	44	37
O=C(c1cccc(OCc2csc(Cl)n2)c1)N1CCOCC1	ZINC000853755982	EF	On-Demand	Anodyne	ITGAL	22	40
O=C(c1cccc(OCc2csc(Cl)n2)c1)N1CCOCC1	ZINC000853755982	EF	On-Demand	Anodyne	LRRK2	22	40
N#CCOc1ccc(Cl)cc1COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853755983	GG	On-Demand	Mild	PTGER1	53	39
N#CCOc1ccc(Cl)cc1COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853755983	GG	On-Demand	Mild	HRH3	26	41
Cn1ncc(COc2cccc(C(=O)N3CCOCC3)c2)n1	ZINC000853755989	DC	On-Demand	Anodyne	HRH3	16	41
Cn1ccnc(NCc2cccc(NC(=O)OC(C)(C)C)c2)c1=O	ZINC000853755990	EF	On-Demand	Anodyne	FLT1	18	45
c1ccc(COc2cc(NCC3CCN(C4CCOCC4)CC3)ncn2)cc1	ZINC000853755991	GG	On-Demand	Anodyne	GRIN2B	21	43
O=C(COc1cccc(C(=O)N2CCOCC2)c1)N1CCC2(CC1)OCCO2	ZINC000853756012	GC	On-Demand	Anodyne	EPHX2	17	40
C#CCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756021	CD	On-Demand	Mild	HRH3	15	44
C#CCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756021	CD	On-Demand	Mild	EPHX2	19	43
Nc1ccc(NC[C@H]2CCN(c3ccccc3Cl)C2)c([N+](=O)[O-])c1	ZINC000853756027	EH	On-Demand	Bother	PRKCQ	26	40
Nc1ccc(NC[C@@H]2CCN(c3ccccc3Cl)C2)c([N+](=O)[O-])c1	ZINC000853756028	EH	On-Demand	Bother	PRKCQ	26	40
O=C(c1cccc(OCCOc2cccc(F)c2)c1)N1CCCC1	ZINC000853756032	EH	On-Demand	Anodyne	HRH3	31	51
O=C(c1cccc(OCCOc2cccc(F)c2)c1)N1CCCC1	ZINC000853756032	EH	On-Demand	Anodyne	GRM5	15	40
O=C(c1cccc(OCCOc2cccc(F)c2)c1)N1CCCC1	ZINC000853756032	EH	On-Demand	Anodyne	CHRNA10	47	43
O=C(c1cccc(OCCOc2cccc(F)c2)c1)N1CCCC1	ZINC000853756032	EH	On-Demand	Anodyne	L3MBTL3	58	44
O=C(c1cccc(OCCOc2cccc(F)c2)c1)N1CCCC1	ZINC000853756032	EH	On-Demand	Anodyne	HPGD	43	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756037	GE	On-Demand	Anodyne	DRD4	40	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756037	GE	On-Demand	Anodyne	ACHE	25	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756037	GE	On-Demand	Anodyne	SIGMAR1	39	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756037	GE	On-Demand	Anodyne	CCR3	39	43
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756037	GE	On-Demand	Anodyne	SLC18A3	41	38
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756037	GE	On-Demand	Anodyne	MCHR1	18	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756038	GE	On-Demand	Anodyne	DRD4	40	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756038	GE	On-Demand	Anodyne	ACHE	25	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756038	GE	On-Demand	Anodyne	SIGMAR1	39	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756038	GE	On-Demand	Anodyne	CCR3	39	43
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756038	GE	On-Demand	Anodyne	SLC18A3	41	38
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCC1Cc2ccccc2C1	ZINC000853756038	GE	On-Demand	Anodyne	MCHR1	18	41
O=C(c1cccc(OCc2ccc(F)cn2)c1)N1CCCC1	ZINC000853756039	DG	On-Demand	Anodyne	GRM5	20	43
O=C(c1cccc(OCc2ccc(F)cn2)c1)N1CCCC1	ZINC000853756039	DG	On-Demand	Anodyne	HPGD	42	40
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)CC(C)C	ZINC000853756048	DG	On-Demand	Anodyne	DRD4	41	31
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)CC(C)C	ZINC000853756048	DG	On-Demand	Anodyne	HPGD	42	42
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)CC(C)C	ZINC000853756048	DG	On-Demand	Anodyne	PDS	64	38
O=C(NCC1Cc2ccccc2C1)N1CC[C@H](Cn2ccnn2)C1	ZINC000853756052	ED	On-Demand	Anodyne	GRIN2B	15	41
O=C(NCC1Cc2ccccc2C1)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853756053	ED	On-Demand	Anodyne	GRIN2B	15	41
Cn1nccc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756054	CE	On-Demand	Anodyne	DRD4	41	31
Cn1nccc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756054	CE	On-Demand	Anodyne	HPGD	49	44
O=C(c1cccc(OCCOC(F)F)c1)N1CCCC1	ZINC000853756055	CF	On-Demand	Anodyne	L3MBTL3	45	42
O=C(c1cccc(OCCOC(F)F)c1)N1CCCC1	ZINC000853756055	CF	On-Demand	Anodyne	HPGD	44	40
COCCc1ccc(OC[C@@H](O)CNC(=O)NCC2Cc3ccccc3C2)cc1	ZINC000853756064	GE	On-Demand	Anodyne	ADRB2	40	53
COCCc1ccc(OC[C@@H](O)CNC(=O)NCC2Cc3ccccc3C2)cc1	ZINC000853756064	GE	On-Demand	Anodyne	ADRB1	74	53
COCCc1ccc(OC[C@@H](O)CNC(=O)NCC2Cc3ccccc3C2)cc1	ZINC000853756064	GE	On-Demand	Anodyne	ADRB3	49	41
COCCc1ccc(OC[C@H](O)CNC(=O)NCC2Cc3ccccc3C2)cc1	ZINC000853756065	GE	On-Demand	Anodyne	ADRB2	40	53
COCCc1ccc(OC[C@H](O)CNC(=O)NCC2Cc3ccccc3C2)cc1	ZINC000853756065	GE	On-Demand	Anodyne	ADRB1	74	53
COCCc1ccc(OC[C@H](O)CNC(=O)NCC2Cc3ccccc3C2)cc1	ZINC000853756065	GE	On-Demand	Anodyne	ADRB3	49	41
COC[C@H](NC(=O)NCC1Cc2ccccc2C1)c1cccc(OC)c1	ZINC000853756067	FG	On-Demand	Anodyne	DRD4	40	32
COC[C@H](NC(=O)NCC1Cc2ccccc2C1)c1cccc(OC)c1	ZINC000853756067	FG	On-Demand	Anodyne	MTNR1A	46	42
COC[C@H](NC(=O)NCC1Cc2ccccc2C1)c1cccc(OC)c1	ZINC000853756067	FG	On-Demand	Anodyne	MTNR1B	48	42
COC[C@@H](NC(=O)NCC1Cc2ccccc2C1)c1cccc(OC)c1	ZINC000853756068	FG	On-Demand	Anodyne	DRD4	40	32
COC[C@@H](NC(=O)NCC1Cc2ccccc2C1)c1cccc(OC)c1	ZINC000853756068	FG	On-Demand	Anodyne	MTNR1A	46	42
COC[C@@H](NC(=O)NCC1Cc2ccccc2C1)c1cccc(OC)c1	ZINC000853756068	FG	On-Demand	Anodyne	MTNR1B	48	42
O=C(c1cccc(OCCC2OCCO2)c1)N1CCCC1	ZINC000853756081	CE	On-Demand	Anodyne	HRH3	26	48
O=C(c1cccc(OCCC2OCCO2)c1)N1CCCC1	ZINC000853756081	CE	On-Demand	Anodyne	L3MBTL3	64	44
O=C(c1cccc(OCCC2OCCO2)c1)N1CCCC1	ZINC000853756081	CE	On-Demand	Anodyne	HPGD	43	40
O=C(c1cccc(OCc2cccc3nsnc23)c1)N1CCCC1	ZINC000853756084	EH	On-Demand	Anodyne	HPGD	40	40
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccc(F)cc2C)C1	ZINC000853756088	FF	On-Demand	Anodyne	ACKR3	60	34
N#CCOc1ccc(Cl)cc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756089	FI	On-Demand	Mild	PTGER1	67	41
N#CCOc1ccc(Cl)cc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756089	FI	On-Demand	Mild	HRH3	28	44
CCOC(=O)c1csc(COc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853756090	FG	On-Demand	Anodyne	CCKAR	45	35
CCOC(=O)c1csc(COc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853756090	FG	On-Demand	Anodyne	HPGD	46	40
Cn1ncc(COc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853756110	CD	On-Demand	Anodyne	DRD4	40	31
Cn1ncc(COc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853756110	CD	On-Demand	Anodyne	PREP	29	40
Cn1ncc(COc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853756110	CD	On-Demand	Anodyne	HPGD	50	44
C[C@@H]1CCCN(C(=O)NCC2Cc3ccccc3C2)[C@H]1CCO	ZINC000853756114	DF	On-Demand	Anodyne	PREP	43	41
C[C@@H]1CCCN(C(=O)NCC2Cc3ccccc3C2)[C@@H]1CCO	ZINC000853756116	DF	On-Demand	Anodyne	PREP	43	41
O=C1[C@H]2CC[C@@H](C2)C(=O)N1Cc1noc(-c2cccs2)n1	ZINC000853756117	DE	On-Demand	Anodyne	ETHR	36	42
O=C(c1cccc(OC/C(Cl)=C\Cl)c1)N1CCOCC1	ZINC000853756128	DF	On-Demand	Anodyne	EPHX2	19	45
O=C(c1cccc(OC/C(Cl)=C/Cl)c1)N1CCOCC1	ZINC000853756129	DF	On-Demand	Anodyne	EPHX2	19	45
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756131	FD	On-Demand	Anodyne	DRD2	34	41
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756131	FD	On-Demand	Anodyne	ADRA1D	42	41
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756131	FD	On-Demand	Anodyne	ADRA1A	35	41
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756131	FD	On-Demand	Anodyne	ADRA1B	26	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756132	FD	On-Demand	Anodyne	DRD2	34	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756132	FD	On-Demand	Anodyne	ADRA1D	42	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756132	FD	On-Demand	Anodyne	ADRA1A	35	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccc2OC(F)F)C1	ZINC000853756132	FD	On-Demand	Anodyne	ADRA1B	26	41
O=C(c1cccc(OCC2OCCO2)c1)N1CCOCC1	ZINC000853756133	CC	On-Demand	Anodyne	EPHX2	19	45
O=C(c1cccc(OCC2OCCO2)c1)N1CCOCC1	ZINC000853756133	CC	On-Demand	Anodyne	LRRK2	16	40
O=C(c1cccc(OCc2nc3ccccc3s2)c1)N1CCOCC1	ZINC000853756134	FG	On-Demand	Anodyne	CYSLTR1	27	46
O=C(c1cccc(OCc2ncccn2)c1)N1CCOCC1	ZINC000853756151	CD	On-Demand	Anodyne	CYSLTR1	24	41
O=C(c1cccc(OCc2ncccn2)c1)N1CCOCC1	ZINC000853756151	CD	On-Demand	Anodyne	ITGAL	30	45
O=C(c1cccc(OCc2ncccn2)c1)N1CCOCC1	ZINC000853756151	CD	On-Demand	Anodyne	EPHX2	17	44
Cc1ccc(COc2cccc(C(=O)N3CCOCC3)c2)c(Cl)n1	ZINC000853756155	EG	On-Demand	Anodyne	BDKRB2	53	33
Cc1ccc(COc2cccc(C(=O)N3CCOCC3)c2)c(Cl)n1	ZINC000853756155	EG	On-Demand	Anodyne	LRRK2	23	40
O=C(c1cccc(OC[C@@H]2CC3(CC3)C(=O)O2)c1)N1CCOCC1	ZINC000853756157	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(c1cccc(OC[C@H]2CC3(CC3)C(=O)O2)c1)N1CCOCC1	ZINC000853756158	ED	On-Demand	Anodyne	EPHX2	17	43
O=C(c1cccc(OCC[C@H](O)c2ccccc2)c1)N1CCOCC1	ZINC000853756164	EF	On-Demand	Anodyne	CASR	43	37
O=C(c1cccc(OCC[C@H](O)c2ccccc2)c1)N1CCOCC1	ZINC000853756164	EF	On-Demand	Anodyne	EPHX2	17	43
O=C(c1cccc(OCC[C@@H](O)c2ccccc2)c1)N1CCOCC1	ZINC000853756165	EF	On-Demand	Anodyne	CASR	43	37
O=C(c1cccc(OCC[C@@H](O)c2ccccc2)c1)N1CCOCC1	ZINC000853756165	EF	On-Demand	Anodyne	EPHX2	17	43
O=C(c1cccc(OCC2CC(F)(F)C2)c1)N1CCOCC1	ZINC000853756166	DF	On-Demand	Anodyne	ITGAL	21	40
O=C(c1cccc(OCC2CC(F)(F)C2)c1)N1CCOCC1	ZINC000853756166	DF	On-Demand	Anodyne	EPHX2	23	44
Cn1cnc(NCc2cccc(NC(=O)OC(C)(C)C)c2)cc1=O	ZINC000853756170	EF	On-Demand	Anodyne	FLT1	18	41
COc1cc(NCc2cccc(NC(=O)OC(C)(C)C)c2)ccc1[N+](=O)[O-]	ZINC000853756182	FJ	On-Demand	Bother	TAAR1	21	45
COc1cc(NCc2cccc(NC(=O)OC(C)(C)C)c2)ccc1[N+](=O)[O-]	ZINC000853756182	FJ	On-Demand	Bother	DRTS_TRYCR	47	32
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCOCC1	ZINC000853756184	DE	On-Demand	Anodyne	HRH3	24	48
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCOCC1	ZINC000853756184	DE	On-Demand	Anodyne	EPHX2	28	43
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCOCC1	ZINC000853756184	DE	On-Demand	Anodyne	L3MBTL3	36	40
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCOCC1	ZINC000853756195	FG	On-Demand	Anodyne	ITGAL	35	48
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCOCC1	ZINC000853756195	FG	On-Demand	Anodyne	EPHX2	19	48
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCOCC1	ZINC000853756195	FG	On-Demand	Anodyne	NR1H2	20	48
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCOCC1	ZINC000853756195	FG	On-Demand	Anodyne	MLYCD	18	40
N#Cc1cc(F)ccc1COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756200	EF	On-Demand	Mild	EPHX2	15	42
O=C(c1cccc(OCCOC(F)F)c1)N1CCOCC1	ZINC000853756202	DD	On-Demand	Anodyne	ITGAL	58	37
O=C(c1cccc(OCCOC(F)F)c1)N1CCOCC1	ZINC000853756202	DD	On-Demand	Anodyne	EPHX2	19	43
Cn1ncc2c(N)nc(NCc3cccc(NC(=O)OC(C)(C)C)c3)nc21	ZINC000853756216	FF	On-Demand	Anodyne	DRTS_TRYCR	44	30
O=C(c1cccc(OCc2ccc(Cl)s2)c1)N1CCCC1	ZINC000853756227	DI	On-Demand	Anodyne	NR1H4	42	35
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853756229	EG	On-Demand	Anodyne	NPY1R	17	41
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853756229	EG	On-Demand	Anodyne	CCKAR	37	45
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853756229	EG	On-Demand	Anodyne	HDAC3	28	44
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853756229	EG	On-Demand	Anodyne	HDAC6	27	44
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853756229	EG	On-Demand	Anodyne	CCKBR	64	45
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853756229	EG	On-Demand	Anodyne	SLC1A2	22	44
CCN1CC[C@@H](N(CC)C(=O)NCC2Cc3ccccc3C2)C1	ZINC000853756233	DF	On-Demand	Anodyne	CCR5	31	48
CCN1CC[C@H](N(CC)C(=O)NCC2Cc3ccccc3C2)C1	ZINC000853756234	DF	On-Demand	Anodyne	CCR5	31	48
O=C(c1cccc(OCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1)N1CCCC1	ZINC000853756249	FG	On-Demand	Bother	ACR	21	43
C#CCNC(=O)c1ccc(NC[C@@H]2CCN(c3ccccc3Cl)C2)nc1	ZINC000853756250	FG	On-Demand	Mild	CACNA1I	60	37
C#CCNC(=O)c1ccc(NC[C@H]2CCN(c3ccccc3Cl)C2)nc1	ZINC000853756251	FG	On-Demand	Mild	CACNA1I	60	37
O=C(c1cccc(OCc2ccc(S(=O)(=O)C(F)F)cc2)c1)N1CCCC1	ZINC000853756252	GG	On-Demand	Anodyne	TRY2_BOVIN	44	36
O=C(c1cccc(OCc2ccc(S(=O)(=O)C(F)F)cc2)c1)N1CCCC1	ZINC000853756252	GG	On-Demand	Anodyne	ADAMTS4	28	45
NC(=O)c1cc(Cl)nnc1NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853756257	FF	On-Demand	Anodyne	SIRT3	62	35
NC(=O)c1cc(Cl)nnc1NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853756257	FF	On-Demand	Anodyne	SIRT2	55	34
NC(=O)c1cc(Cl)nnc1NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853756257	FF	On-Demand	Anodyne	SIRT1	53	33
NC(=O)c1cc(Cl)nnc1NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853756258	FF	On-Demand	Anodyne	SIRT3	62	35
NC(=O)c1cc(Cl)nnc1NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853756258	FF	On-Demand	Anodyne	SIRT2	55	34
NC(=O)c1cc(Cl)nnc1NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853756258	FF	On-Demand	Anodyne	SIRT1	53	33
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853756265	FE	On-Demand	Anodyne	DRD4	42	33
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853756265	FE	On-Demand	Anodyne	DRD3	16	41
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853756265	FE	On-Demand	Anodyne	MTNR1A	19	53
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853756265	FE	On-Demand	Anodyne	MTNR1B	21	53
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853756265	FE	On-Demand	Anodyne	CHRNA10	60	42
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853756265	FE	On-Demand	Anodyne	ACKR3	67	33
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCCC1	ZINC000853756272	DG	On-Demand	Anodyne	HRH3	37	49
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCCC1	ZINC000853756272	DG	On-Demand	Anodyne	CHEK2	17	42
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCCC1	ZINC000853756272	DG	On-Demand	Anodyne	PREP	28	40
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCCC1	ZINC000853756272	DG	On-Demand	Anodyne	EPHX2	24	43
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCCC1	ZINC000853756272	DG	On-Demand	Anodyne	L3MBTL3	70	44
O=C(c1cccc(OCCC2CCOCC2)c1)N1CCCC1	ZINC000853756272	DG	On-Demand	Anodyne	HPGD	51	38
O=C(COc1cccc(C(=O)N2CCOCC2)c1)NC1CCCCCCC1	ZINC000853756275	FF	On-Demand	Anodyne	ITGAL	40	36
O=C(COc1cccc(C(=O)N2CCOCC2)c1)NC1CCCCCCC1	ZINC000853756275	FF	On-Demand	Anodyne	CNR2	19	40
O=C(COc1cccc(C(=O)N2CCOCC2)c1)NC1CCCCCCC1	ZINC000853756275	FF	On-Demand	Anodyne	CPT1A	81	42
O=C(COc1cccc(C(=O)N2CCOCC2)c1)NC1CCCCCCC1	ZINC000853756275	FF	On-Demand	Anodyne	CPT2	42	35
O=C(COc1cccc(C(=O)N2CCOCC2)c1)NC1CCCCCCC1	ZINC000853756275	FF	On-Demand	Anodyne	FAAH	26	40
O=C(COc1cccc(C(=O)N2CCOCC2)c1)NC1CCCCCCC1	ZINC000853756275	FF	On-Demand	Anodyne	EPHX2	42	49
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853756282	FD	On-Demand	Anodyne	MTOR	68	37
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853756282	FD	On-Demand	Anodyne	EPHX2	20	47
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853756282	FD	On-Demand	Anodyne	STAT6	52	32
O=C(c1cccc(OCc2nc3ccccc3s2)c1)N1CCCC1	ZINC000853756300	EI	On-Demand	Anodyne	CYSLTR1	17	46
O=C(c1cccc(OCc2nc3ccccc3s2)c1)N1CCCC1	ZINC000853756300	EI	On-Demand	Anodyne	CPT1A	46	35
O=C(c1cccc(OCc2nc3ccccc3s2)c1)N1CCCC1	ZINC000853756300	EI	On-Demand	Anodyne	HPGD	40	40
O=C(c1cccc(OCc2csc(Cl)n2)c1)N1CCCC1	ZINC000853756301	DH	On-Demand	Anodyne	CPT1A	42	40
O=C(c1cccc(OCc2csc(Cl)n2)c1)N1CCCC1	ZINC000853756301	DH	On-Demand	Anodyne	NR1H4	56	38
CC(C)(C)OC(=O)N1CC[C@@H](CCN2C(=O)[C@H]3CC[C@@H](C3)C2=O)C1	ZINC000853756307	EE	On-Demand	Anodyne	GPR119	32	41
CC(C)(C)OC(=O)N1CC[C@H](CCN2C(=O)[C@H]3CC[C@@H](C3)C2=O)C1	ZINC000853756308	EE	On-Demand	Anodyne	GPR119	32	41
O=C(c1cccc(OCc2cccc(Br)n2)c1)N1CCCC1	ZINC000853756309	FH	On-Demand	Anodyne	CYSLTR1	32	42
O=C(c1cccc(OCc2cccc(Br)n2)c1)N1CCCC1	ZINC000853756309	FH	On-Demand	Anodyne	HPGD	49	43
O=C(c1cccc(OCc2ncccn2)c1)N1CCCC1	ZINC000853756316	CE	On-Demand	Anodyne	DRD4	40	32
O=C(c1cccc(OCc2ncccn2)c1)N1CCCC1	ZINC000853756316	CE	On-Demand	Anodyne	HRH3	20	45
O=C(c1cccc(OCc2ncccn2)c1)N1CCCC1	ZINC000853756316	CE	On-Demand	Anodyne	CPT1A	45	34
O=C(c1cccc(OCc2ncccn2)c1)N1CCCC1	ZINC000853756316	CE	On-Demand	Anodyne	GRM5	15	45
O=C(c1cccc(OCc2ncccn2)c1)N1CCCC1	ZINC000853756316	CE	On-Demand	Anodyne	PARP1	17	40
O=C(c1cccc(OCc2ncccn2)c1)N1CCCC1	ZINC000853756316	CE	On-Demand	Anodyne	L3MBTL3	57	44
O=C(c1cccc(OCc2ncccn2)c1)N1CCCC1	ZINC000853756316	CE	On-Demand	Anodyne	HPGD	53	47
COc1c(C)ncnc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853756327	EH	On-Demand	Anodyne	PDE5A	15	43
COc1c(C)ncnc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853756327	EH	On-Demand	Anodyne	EGFR	27	48
COc1c(C)ncnc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853756327	EH	On-Demand	Anodyne	PDE6A	52	43
COc1c(C)ncnc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853756327	EH	On-Demand	Anodyne	CLK4	25	41
O=C(c1cccc(OCc2ccc(Cl)s2)c1)N1CCOCC1	ZINC000853756331	EG	On-Demand	Anodyne	EPHX2	15	46
CCCCCCn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756337	DG	On-Demand	Anodyne	CNR1	41	49
CCCCCCn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756337	DG	On-Demand	Anodyne	CNR2	73	49
CCCCCCn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756337	DG	On-Demand	Anodyne	ASAH1	74	33
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756342	FC	On-Demand	Anodyne	DRD4	41	32
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756342	FC	On-Demand	Anodyne	HRH3	15	42
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756342	FC	On-Demand	Anodyne	EPHX2	21	41
O=C(c1cccc(OCc2cnc(Cl)s2)c1)N1CCOCC1	ZINC000853756344	EF	On-Demand	Anodyne	LRRK2	21	41
O=C(c1cccc(OCCC2OCCO2)c1)N1CCOCC1	ZINC000853756345	DD	On-Demand	Anodyne	HRH3	18	44
O=C(c1cccc(OCCC2OCCO2)c1)N1CCOCC1	ZINC000853756345	DD	On-Demand	Anodyne	EPHX2	25	43
CCCCC[C@@H](C)NC(=O)COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756348	FF	On-Demand	Anodyne	P2RY12	55	42
CCCCC[C@@H](C)NC(=O)COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756348	FF	On-Demand	Anodyne	PLA2G4B	45	43
FC(F)(F)c1nnc2ccc(NCC3CCN(C4CCOCC4)CC3)nn12	ZINC000853756351	GE	On-Demand	Anodyne	PIM1	15	48
O=C(c1cccc(OCc2cccc(Br)n2)c1)N1CCOCC1	ZINC000853756359	GF	On-Demand	Anodyne	CYSLTR1	42	42
O=C(c1cccc(OCc2cccc(Br)n2)c1)N1CCOCC1	ZINC000853756359	GF	On-Demand	Anodyne	LRRK2	15	41
O=C(c1cccc(OCc2cccc(Cl)n2)c1)N1CCOCC1	ZINC000853756360	EF	On-Demand	Anodyne	CYSLTR1	41	42
O=C(c1cccc(OCc2cccc(Cl)n2)c1)N1CCOCC1	ZINC000853756360	EF	On-Demand	Anodyne	NR1H4	42	35
O=C(c1cccc(OCc2cccc(Cl)n2)c1)N1CCOCC1	ZINC000853756360	EF	On-Demand	Anodyne	LRRK2	21	41
O=[N+]([O-])c1ccc(NCC2CCN(C3CCOCC3)CC2)c2nonc12	ZINC000853756361	FE	On-Demand	Bother	GSTM2	110	45
O=[N+]([O-])c1ccc(NCC2CCN(C3CCOCC3)CC2)c2nonc12	ZINC000853756361	FE	On-Demand	Bother	GSTP1	67	45
O=[N+]([O-])c1ccc(NCC2CCN(C3CCOCC3)CC2)c2nonc12	ZINC000853756361	FE	On-Demand	Bother	EPAS1	40	30
O=C(c1cccc(OCCC2SCCS2)c1)N1CCOCC1	ZINC000853756368	EF	On-Demand	Anodyne	HRH3	15	43
O=C(c1cccc(OCCC2SCCS2)c1)N1CCOCC1	ZINC000853756368	EF	On-Demand	Anodyne	EPHX2	26	43
O=C(c1cccc(OCc2ccc(Cl)c([N+](=O)[O-])c2)c1)N1CCOCC1	ZINC000853756371	GG	On-Demand	Bother	ACR	18	40
O=[N+]([O-])c1ccc(Cl)cc1NCC1CCN(C2CCOCC2)CC1	ZINC000853756375	FH	On-Demand	Bother	PRKCQ	24	40
CCCCCCCCn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756376	EI	On-Demand	Mild	CNR1	41	49
CCCCCCCCn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756376	EI	On-Demand	Mild	CNR2	73	49
CCCCCCCCn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756376	EI	On-Demand	Mild	ASAH1	74	33
COCCS(=O)(=O)CCCn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756388	GD	On-Demand	Anodyne	CNR2	18	42
O=C(c1cccc(OCc2ccc3c(c2)COC3)c1)N1CCOCC1	ZINC000853756391	EF	On-Demand	Anodyne	ALOX5	18	40
O=C(c1cccc(OCc2ccc3c(c2)COC3)c1)N1CCOCC1	ZINC000853756391	EF	On-Demand	Anodyne	ITGAL	19	40
C#CCCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756404	CD	On-Demand	Mild	HRH3	18	45
C#CCCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756404	CD	On-Demand	Mild	EPHX2	22	43
O=C(c1cccc(OCC[C@@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000853756406	EG	On-Demand	Anodyne	EPHX2	27	44
O=C(c1cccc(OCC[C@H]2CC2(Cl)Cl)c1)N1CCOCC1	ZINC000853756407	EG	On-Demand	Anodyne	EPHX2	27	44
C#CCNC(=O)c1ccc(NCC2CCN(C3CCOCC3)CC2)nc1	ZINC000853756414	FD	On-Demand	Mild	IKBKB	17	41
C#CCNC(=O)c1ccc(NCC2CCN(C3CCOCC3)CC2)nc1	ZINC000853756414	FD	On-Demand	Mild	CACNA1I	60	36
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCOCC1	ZINC000853756419	EG	On-Demand	Anodyne	ITGAL	25	44
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCOCC1	ZINC000853756419	EG	On-Demand	Anodyne	EPHX2	17	43
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCOCC1	ZINC000853756419	EG	On-Demand	Anodyne	NR1H2	15	43
C[C@H](C#N)OCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756423	DD	On-Demand	Mild	HRH3	20	43
C[C@H](C#N)OCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756423	DD	On-Demand	Mild	EPHX2	17	41
C[C@@H](C#N)OCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756424	DD	On-Demand	Mild	HRH3	20	43
C[C@@H](C#N)OCCOc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756424	DD	On-Demand	Mild	EPHX2	17	41
COC(=O)c1cccc(NC[C@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853756439	EG	On-Demand	Anodyne	VCP	41	36
COC(=O)c1cccc(NC[C@@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853756440	EG	On-Demand	Anodyne	VCP	41	36
O=C(c1cccc(OCc2cccc(Cl)n2)c1)N1CCCC1	ZINC000853756445	DH	On-Demand	Anodyne	CYSLTR1	31	42
O=C(c1cccc(OCc2cccc(Cl)n2)c1)N1CCCC1	ZINC000853756445	DH	On-Demand	Anodyne	NR1H4	51	36
O=C(c1cccc(OCc2cccc(Cl)n2)c1)N1CCCC1	ZINC000853756445	DH	On-Demand	Anodyne	L3MBTL3	33	40
O=C(c1cccc(OCc2cccc(Cl)n2)c1)N1CCCC1	ZINC000853756445	DH	On-Demand	Anodyne	HPGD	40	41
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)[C@H]1CCOC1	ZINC000853756448	DE	On-Demand	Anodyne	L3MBTL3	46	39
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)[C@H]1CCOC1	ZINC000853756448	DE	On-Demand	Anodyne	HPGD	47	42
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)[C@@H]1CCOC1	ZINC000853756449	DE	On-Demand	Anodyne	L3MBTL3	46	39
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)[C@@H]1CCOC1	ZINC000853756449	DE	On-Demand	Anodyne	HPGD	47	42
O=C(c1cccc(OC/C(Cl)=C\Cl)c1)N1CCCC1	ZINC000853756453	DH	On-Demand	Anodyne	CPT1A	47	37
O=C(c1cccc(OC/C(Cl)=C\Cl)c1)N1CCCC1	ZINC000853756453	DH	On-Demand	Anodyne	PREP	27	40
O=C(c1cccc(OC/C(Cl)=C\Cl)c1)N1CCCC1	ZINC000853756453	DH	On-Demand	Anodyne	L3MBTL3	49	42
O=C(c1cccc(OC/C(Cl)=C\Cl)c1)N1CCCC1	ZINC000853756453	DH	On-Demand	Anodyne	HPGD	39	40
O=C(c1cccc(OC/C(Cl)=C/Cl)c1)N1CCCC1	ZINC000853756454	DH	On-Demand	Anodyne	CPT1A	47	37
O=C(c1cccc(OC/C(Cl)=C/Cl)c1)N1CCCC1	ZINC000853756454	DH	On-Demand	Anodyne	PREP	27	40
O=C(c1cccc(OC/C(Cl)=C/Cl)c1)N1CCCC1	ZINC000853756454	DH	On-Demand	Anodyne	L3MBTL3	49	42
O=C(c1cccc(OC/C(Cl)=C/Cl)c1)N1CCCC1	ZINC000853756454	DH	On-Demand	Anodyne	HPGD	39	40
O=C(c1cccc(OCc2c(F)c(F)c(F)c(F)c2F)c1)N1CCCC1	ZINC000853756458	FI	On-Demand	Anodyne	DRD4	41	32
O=C(c1cccc(OCc2c(F)c(F)c(F)c(F)c2F)c1)N1CCCC1	ZINC000853756458	FI	On-Demand	Anodyne	PREP	24	40
O=C(c1cccc(OCc2c(F)c(F)c(F)c(F)c2F)c1)N1CCCC1	ZINC000853756458	FI	On-Demand	Anodyne	L3MBTL3	51	43
O=C(c1cccc(OCc2c(F)c(F)c(F)c(F)c2F)c1)N1CCCC1	ZINC000853756458	FI	On-Demand	Anodyne	HPGD	42	41
Cn1nc(C2CC2)nc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756466	EF	On-Demand	Anodyne	CPT1A	46	36
Cn1nc(C2CC2)nc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756466	EF	On-Demand	Anodyne	L3MBTL3	46	40
Cn1nc(C2CC2)nc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756466	EF	On-Demand	Anodyne	HPGD	49	43
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCCC1	ZINC000853756469	DH	On-Demand	Anodyne	PARP1	15	41
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCCC1	ZINC000853756469	DH	On-Demand	Anodyne	ACR	15	46
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCCC1	ZINC000853756469	DH	On-Demand	Anodyne	NR1H2	17	41
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCCC1	ZINC000853756469	DH	On-Demand	Anodyne	L3MBTL3	46	42
O=C(c1cccc(OCc2ccc(CF)cc2)c1)N1CCCC1	ZINC000853756469	DH	On-Demand	Anodyne	HPGD	41	40
Nc1ccc([N+](=O)[O-])c(NC[C@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853756477	EH	On-Demand	Bother	PRKCQ	26	40
Nc1ccc([N+](=O)[O-])c(NC[C@@H]2CCN(c3ccccc3Cl)C2)c1	ZINC000853756478	EH	On-Demand	Bother	PRKCQ	26	40
COc1ccc(N2CCN(C(=O)CN3C(=O)[C@H]4CC[C@@H](C4)C3=O)CC2)cc1	ZINC000853756479	FD	On-Demand	Clean	F10	19	41
COc1ccc(N2CCN(C(=O)CN3C(=O)[C@H]4CC[C@@H](C4)C3=O)CC2)cc1	ZINC000853756479	FD	On-Demand	Clean	SSTR1	41	34
COc1ccc(N2CCN(C(=O)CN3C(=O)[C@H]4CC[C@@H](C4)C3=O)CC2)cc1	ZINC000853756479	FD	On-Demand	Clean	NPBWR1	56	32
CCCCC[C@@H](C)NC(=O)CN1C(=O)[C@H]2CC[C@@H](C2)C1=O	ZINC000853756488	CD	On-Demand	Anodyne	LASR	57	38
CCCCC[C@@H](C)NC(=O)CN1C(=O)[C@H]2CC[C@@H](C2)C1=O	ZINC000853756488	CD	On-Demand	Anodyne	NOD1	46	34
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc2ccccc2c1	ZINC000853756490	DF	On-Demand	Anodyne	DRD4	15	41
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc2ccccc2c1	ZINC000853756490	DF	On-Demand	Anodyne	CCKBR	46	38
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)Nc1ccc2ccccc2c1	ZINC000853756490	DF	On-Demand	Anodyne	IMDH_CRYPV	41	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc3c(F)cccc3c2)CC1	ZINC000853756494	GE	On-Demand	Anodyne	P2RY12	120	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc3c(F)cccc3c2)CC1	ZINC000853756495	GE	On-Demand	Anodyne	P2RY12	120	38
O=C(c1cccc(OCc2ccc([N+](=O)[O-])c(F)c2)c1)N1CCCC1	ZINC000853756496	EH	On-Demand	Bother	ACR	17	42
O=C(c1cccc(OCc2ccc([N+](=O)[O-])c(F)c2)c1)N1CCCC1	ZINC000853756496	EH	On-Demand	Bother	NR1H2	15	40
O=C(c1cccc(OCC=C(Cl)Cl)c1)N1CCCC1	ZINC000853756499	DH	On-Demand	Anodyne	DRD4	40	32
O=C(c1cccc(OCC=C(Cl)Cl)c1)N1CCCC1	ZINC000853756499	DH	On-Demand	Anodyne	L3MBTL3	51	43
O=C(c1cccc(OCC=C(Cl)Cl)c1)N1CCCC1	ZINC000853756499	DH	On-Demand	Anodyne	HPGD	40	41
O=C(c1cccc(OCc2cnnn2-c2ccccc2)c1)N1CCCC1	ZINC000853756502	EG	On-Demand	Anodyne	CPT1A	56	35
O=C(c1cccc(OCc2cnnn2-c2ccccc2)c1)N1CCCC1	ZINC000853756502	EG	On-Demand	Anodyne	L3MBTL3	35	42
O=C(c1cccc(OCc2cnnn2-c2ccccc2)c1)N1CCCC1	ZINC000853756502	EG	On-Demand	Anodyne	HPGD	47	42
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000853756512	FF	On-Demand	Mild	HRH3	31	48
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000853756512	FF	On-Demand	Mild	PLA2G4B	40	41
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000853756512	FF	On-Demand	Mild	EPHX2	22	42
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000853756512	FF	On-Demand	Mild	MEN1	40	37
O=C(c1cccc(OCCCON2C(=O)c3ccccc3C2=O)c1)N1CCCC1	ZINC000853756542	GF	On-Demand	Anodyne	HRH3	19	47
C#CCOCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756544	CD	On-Demand	Mild	L3MBTL3	43	41
C#CCOCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756544	CD	On-Demand	Mild	HPGD	34	40
O=C(c1cccc(OCCCCCCO)c1)N1CCOCC1	ZINC000853756545	DE	On-Demand	Anodyne	HRH3	21	46
O=C(c1cccc(OCCCCCCO)c1)N1CCOCC1	ZINC000853756545	DE	On-Demand	Anodyne	PLA2G4B	53	44
O=C(c1cccc(OCCCCCCO)c1)N1CCOCC1	ZINC000853756545	DE	On-Demand	Anodyne	EPHX2	26	44
O=C(c1cccc(OCc2nc(Cl)ccc2Cl)c1)N1CCOCC1	ZINC000853756563	FG	On-Demand	Anodyne	NR1H4	46	34
O=C(c1cccc(OCc2nc(Cl)ccc2Cl)c1)N1CCOCC1	ZINC000853756563	FG	On-Demand	Anodyne	LRRK2	22	42
O=C(c1cccc(OCC2CCS(=O)(=O)CC2)c1)N1CCOCC1	ZINC000853756566	FD	On-Demand	Anodyne	ITGAL	22	41
O=C(c1cccc(OCC2CCS(=O)(=O)CC2)c1)N1CCOCC1	ZINC000853756566	FD	On-Demand	Anodyne	CHRNA10	53	37
O=C(c1cccc(OCCC2(O)CC2)c1)N1CCOCC1	ZINC000853756576	CD	On-Demand	Anodyne	EPHX2	26	43
NC(=O)c1cc(Cl)nnc1NCC1CCN(C2CCOCC2)CC1	ZINC000853756582	FD	On-Demand	Anodyne	CACNA1I	46	36
NC(=O)c1cc(Cl)nnc1NCC1CCN(C2CCOCC2)CC1	ZINC000853756582	FD	On-Demand	Anodyne	STAT6	52	32
c1ccc(-c2cn3nc(NCC4CCN(C5CCOCC5)CC4)sc3n2)cc1	ZINC000853756586	GH	On-Demand	Anodyne	VCP	45	36
O=C(c1cccc(OCc2ccc([N+](=O)[O-])c(F)c2)c1)N1CCOCC1	ZINC000853756589	FF	On-Demand	Bother	ACR	16	40
O=C(c1cccc(OCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c1)N1CCOCC1	ZINC000853756599	GF	On-Demand	Bother	ACR	18	41
O=C(c1cccc(OCc2ccc(F)cn2)c1)N1CCOCC1	ZINC000853756603	DE	On-Demand	Anodyne	ITGAL	20	41
COC(=O)c1nccnc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853756611	FG	On-Demand	Anodyne	PPIA	23	40
COC(=O)c1nccnc1NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853756611	FG	On-Demand	Anodyne	FLT1	15	42
O=C(c1cccc(OCC=C(Cl)Cl)c1)N1CCOCC1	ZINC000853756616	DF	On-Demand	Anodyne	EPHX2	17	46
O=C(c1cccc(OCCOc2cccc(F)c2)c1)N1CCOCC1	ZINC000853756632	EF	On-Demand	Anodyne	HRH3	21	44
O=C(c1cccc(OCCOc2cccc(F)c2)c1)N1CCOCC1	ZINC000853756632	EF	On-Demand	Anodyne	EPHX2	25	47
COc1ccc2c(NCC3CCN(C4CCOCC4)CC3)ccnc2c1	ZINC000853756633	FH	On-Demand	Anodyne	HRP1_PLAFA	97	42
COc1ccc2c(NCC3CCN(C4CCOCC4)CC3)ccnc2c1	ZINC000853756633	FH	On-Demand	Anodyne	HNMT	61	35
c1cc(N2CCCC2)nc(NCC2CCN(C3CCOCC3)CC2)n1	ZINC000853756636	EE	On-Demand	Anodyne	GRIN2B	16	41
C=C(Cl)COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756638	CE	On-Demand	Mild	DRD4	42	33
C=C(Cl)COc1cccc(C(=O)N2CCOCC2)c1	ZINC000853756638	CE	On-Demand	Mild	EPHX2	20	46
CCCCC[C@@H](C)NC(=O)Cn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756644	FF	On-Demand	Anodyne	CNR2	26	41
CCCCC[C@@H](C)NC(=O)Cn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756644	FF	On-Demand	Anodyne	PSMB5	15	41
CCCCC[C@@H](C)NC(=O)Cn1cc(C(=O)N(C)C)c2ccccc2c1=O	ZINC000853756644	FF	On-Demand	Anodyne	PSMB1	15	41
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCOCC1	ZINC000853756653	EF	On-Demand	Anodyne	ITGAL	15	43
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCOCC1	ZINC000853756653	EF	On-Demand	Anodyne	LRRK2	21	40
CC(=O)c1cc(NCc2cccc(NC(=O)OC(C)(C)C)c2)ccc1[N+](=O)[O-]	ZINC000853756663	GJ	On-Demand	Bother	TAAR1	21	43
CCn1c(=O)c(NCc2cccc(NC(=O)OC(C)(C)C)c2)nc2ccccc21	ZINC000853756665	GI	On-Demand	Anodyne	PYGM	21	43
Cc1ccc(COc2cccc(C(=O)N3CCCC3)c2)c(Cl)n1	ZINC000853756682	EH	On-Demand	Anodyne	DRD4	41	32
Cc1ccc(COc2cccc(C(=O)N3CCCC3)c2)c(Cl)n1	ZINC000853756682	EH	On-Demand	Anodyne	ADAM17	47	38
Cc1ccc(COc2cccc(C(=O)N3CCCC3)c2)c(Cl)n1	ZINC000853756682	EH	On-Demand	Anodyne	HPGD	47	40
C#CCNC(=O)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756683	CD	On-Demand	Mild	DRD4	44	34
C#CCNC(=O)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756683	CD	On-Demand	Mild	PREP	26	40
C#CCNC(=O)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756683	CD	On-Demand	Mild	L3MBTL3	35	40
C#CCNC(=O)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756683	CD	On-Demand	Mild	HPGD	39	41
O=C(COc1cccc(C(=O)N2CCCC2)c1)N1CCC2(CC1)OCCO2	ZINC000853756686	FD	On-Demand	Anodyne	CPT1A	86	36
O=C(COc1cccc(C(=O)N2CCCC2)c1)N1CCC2(CC1)OCCO2	ZINC000853756686	FD	On-Demand	Anodyne	CPT2	44	33
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2cccc(C(=O)N3CCCC3)c2)C1	ZINC000853756692	GH	On-Demand	Anodyne	GPR119	43	46
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2cccc(C(=O)N3CCCC3)c2)C1	ZINC000853756692	GH	On-Demand	Anodyne	L3MBTL3	61	41
CC(C)(C)OC(=O)N1CC[C@@H](CCOc2cccc(C(=O)N3CCCC3)c2)C1	ZINC000853756692	GH	On-Demand	Anodyne	HPGD	40	36
CC(C)(C)OC(=O)N1CC[C@H](CCOc2cccc(C(=O)N3CCCC3)c2)C1	ZINC000853756693	GH	On-Demand	Anodyne	GPR119	43	46
CC(C)(C)OC(=O)N1CC[C@H](CCOc2cccc(C(=O)N3CCCC3)c2)C1	ZINC000853756693	GH	On-Demand	Anodyne	L3MBTL3	61	41
CC(C)(C)OC(=O)N1CC[C@H](CCOc2cccc(C(=O)N3CCCC3)c2)C1	ZINC000853756693	GH	On-Demand	Anodyne	HPGD	40	36
Nc1nc(Cl)cc(NC[C@@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853756695	EG	On-Demand	Anodyne	HRH4	40	47
Nc1nc(Cl)cc(NC[C@@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853756695	EG	On-Demand	Anodyne	VCP	45	35
Nc1nc(Cl)cc(NC[C@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853756696	EG	On-Demand	Anodyne	HRH4	40	47
Nc1nc(Cl)cc(NC[C@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853756696	EG	On-Demand	Anodyne	VCP	45	35
O=C(NCC1Cc2ccccc2C1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853756702	DE	On-Demand	Anodyne	PREP	42	46
O=C(NCC1Cc2ccccc2C1)N1CCC[C@](O)(C2CC2)C1	ZINC000853756703	DE	On-Demand	Anodyne	PREP	42	46
O=C(c1cccc(OCC[C@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756709	EG	On-Demand	Anodyne	HRH3	22	46
O=C(c1cccc(OCC[C@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756709	EG	On-Demand	Anodyne	ABCB1	20	42
O=C(c1cccc(OCC[C@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756709	EG	On-Demand	Anodyne	L3MBTL3	40	40
O=C(c1cccc(OCC[C@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756709	EG	On-Demand	Anodyne	HPGD	45	41
O=C(c1cccc(OCC[C@@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756710	EG	On-Demand	Anodyne	HRH3	22	46
O=C(c1cccc(OCC[C@@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756710	EG	On-Demand	Anodyne	ABCB1	20	42
O=C(c1cccc(OCC[C@@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756710	EG	On-Demand	Anodyne	L3MBTL3	40	40
O=C(c1cccc(OCC[C@@H](O)c2ccccc2)c1)N1CCCC1	ZINC000853756710	EG	On-Demand	Anodyne	HPGD	45	41
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCCC1	ZINC000853756711	DH	On-Demand	Anodyne	CHRNA2	15	41
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCCC1	ZINC000853756711	DH	On-Demand	Anodyne	HRH3	20	41
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCCC1	ZINC000853756711	DH	On-Demand	Anodyne	CHRNA3	17	41
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCCC1	ZINC000853756711	DH	On-Demand	Anodyne	ACR	15	40
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCCC1	ZINC000853756711	DH	On-Demand	Anodyne	NR1H2	20	47
O=C(c1cccc(OCc2ccc(Cl)nc2)c1)N1CCCC1	ZINC000853756711	DH	On-Demand	Anodyne	HPGD	40	40
O=C(c1cccc(OCc2nc(Cl)ccc2Cl)c1)N1CCCC1	ZINC000853756718	FI	On-Demand	Anodyne	NR1H4	52	35
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NC[C@@H]2CCc3ccccc3C2)C1	ZINC000853756721	GF	On-Demand	Anodyne	PREP	30	42
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NC[C@@H]2CCc3ccccc3C2)C1	ZINC000853756722	GF	On-Demand	Anodyne	PREP	30	42
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NC[C@H]2CCc3ccccc3C2)C1	ZINC000853756723	GF	On-Demand	Anodyne	PREP	30	42
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NC[C@H]2CCc3ccccc3C2)C1	ZINC000853756724	GF	On-Demand	Anodyne	PREP	30	42
O=C(c1cccc(OCC2CCC3(CC2)OCCO3)c1)N1CCCC1	ZINC000853756739	EG	On-Demand	Anodyne	CHRNA10	52	39
O=C(c1cccc(OCC2CCC3(CC2)OCCO3)c1)N1CCCC1	ZINC000853756739	EG	On-Demand	Anodyne	C5AR1	15	40
O=C(c1cccc(OCC2CCC3(CC2)OCCO3)c1)N1CCCC1	ZINC000853756739	EG	On-Demand	Anodyne	L3MBTL3	57	42
CC[C@H](C)N(CC)C(=O)NCC1Cc2ccccc2C1	ZINC000853756755	CG	On-Demand	Anodyne	ADAM9	53	33
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)C1CCC1	ZINC000853756757	DG	On-Demand	Anodyne	DRD4	40	31
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)C1CCC1	ZINC000853756757	DG	On-Demand	Anodyne	PREP	28	40
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)C1CCC1	ZINC000853756757	DG	On-Demand	Anodyne	L3MBTL3	74	43
CO[C@@H](COc1cccc(C(=O)N2CCCC2)c1)C1CCC1	ZINC000853756757	DG	On-Demand	Anodyne	HPGD	48	44
CC[C@@H](C)c1ccc(NC(=O)CN2C(=O)[C@H]3CC[C@@H](C3)C2=O)cc1	ZINC000853756764	EF	On-Demand	Anodyne	SCN2A	19	46
O=C(NCC1Cc2ccccc2C1)N(CCN1CCOCC1)CC1CC1	ZINC000853756765	FE	On-Demand	Anodyne	HTR4	29	42
O=C(NCC1Cc2ccccc2C1)N(CCN1CCOCC1)CC1CC1	ZINC000853756765	FE	On-Demand	Anodyne	CASR	58	41
O=C(c1cccc(OCc2cccc(C(=O)C(F)(F)F)c2)c1)N1CCCC1	ZINC000853756767	GI	On-Demand	Anodyne	PREP	22	40
O=C(c1cccc(OCc2cccc(C(=O)C(F)(F)F)c2)c1)N1CCCC1	ZINC000853756767	GI	On-Demand	Anodyne	PARP1	15	45
O=C(c1cccc(OCc2cccc(C(=O)C(F)(F)F)c2)c1)N1CCCC1	ZINC000853756767	GI	On-Demand	Anodyne	NR1H2	17	45
O=C(c1cccc(OCCC2OCCCO2)c1)N1CCCC1	ZINC000853756776	DE	On-Demand	Anodyne	HRH3	28	48
O=C(c1cccc(OCCC2OCCCO2)c1)N1CCCC1	ZINC000853756776	DE	On-Demand	Anodyne	L3MBTL3	65	44
O=C(c1cccc(OCCC2OCCCO2)c1)N1CCCC1	ZINC000853756776	DE	On-Demand	Anodyne	HPGD	43	40
CC(C)(C)OC(=O)N1CCC(CCN2C(=O)[C@H]3CC[C@@H](C3)C2=O)CC1	ZINC000853756777	FF	On-Demand	Anodyne	GPR119	43	46
O=C(c1cccc(OCc2cnc(Cl)s2)c1)N1CCCC1	ZINC000853756778	DH	On-Demand	Anodyne	NR1H4	47	35
O=C(c1cccc(OCc2cnc(Cl)s2)c1)N1CCCC1	ZINC000853756778	DH	On-Demand	Anodyne	HPGD	47	42
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756779	FD	On-Demand	Anodyne	DRD4	43	33
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756779	FD	On-Demand	Anodyne	HRH3	29	47
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756779	FD	On-Demand	Anodyne	TRY2_BOVIN	51	35
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756779	FD	On-Demand	Anodyne	PLA2G4B	31	41
COCCS(=O)(=O)CCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756779	FD	On-Demand	Anodyne	HPGD	39	42
CCCCC[C@@H](C)NC(=O)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756781	EG	On-Demand	Anodyne	P2RY12	105	40
CCCCC[C@@H](C)NC(=O)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756781	EG	On-Demand	Anodyne	HRH3	19	42
CCCCC[C@@H](C)NC(=O)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756781	EG	On-Demand	Anodyne	PLA2G4B	54	45
Cn1nc(C(F)(F)F)c(COc2cccc(C(=O)N3CCCC3)c2)c1Cl	ZINC000853756783	GH	On-Demand	Anodyne	NR1H4	70	43
Cn1nc(C(F)(F)F)c(COc2cccc(C(=O)N3CCCC3)c2)c1Cl	ZINC000853756783	GH	On-Demand	Anodyne	NR1H2	19	44
Cn1nc(C(F)(F)F)c(COc2cccc(C(=O)N3CCCC3)c2)c1Cl	ZINC000853756783	GH	On-Demand	Anodyne	HPGD	48	41
N#Cc1cc(F)ccc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756792	DH	On-Demand	Mild	HRH3	25	41
N#Cc1cc(F)ccc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756792	DH	On-Demand	Mild	CHRNA10	47	37
Cn1cncc1CCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756794	CE	On-Demand	Anodyne	DRD4	41	32
Cn1cncc1CCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756794	CE	On-Demand	Anodyne	HRH3	25	46
Cn1cncc1CCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756794	CE	On-Demand	Anodyne	HPGD	48	42
O=C(c1cccc(OCCCCCCO)c1)N1CCCC1	ZINC000853756811	CF	On-Demand	Anodyne	HRH3	35	54
O=C(c1cccc(OCCCCCCO)c1)N1CCCC1	ZINC000853756811	CF	On-Demand	Anodyne	PLA2G4B	56	46
O=C(c1cccc(OCCCCCCO)c1)N1CCCC1	ZINC000853756811	CF	On-Demand	Anodyne	ACR	22	40
O=C(c1cccc(OCCCCCCO)c1)N1CCCC1	ZINC000853756811	CF	On-Demand	Anodyne	L3MBTL3	61	44
O=C(c1cccc(OCCCCCCO)c1)N1CCCC1	ZINC000853756811	CF	On-Demand	Anodyne	HPGD	41	42
C=C(Cl)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756816	CG	On-Demand	Mild	DRD4	44	34
C=C(Cl)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756816	CG	On-Demand	Mild	CPT1A	53	38
C=C(Cl)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756816	CG	On-Demand	Mild	CPT2	42	38
C=C(Cl)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756816	CG	On-Demand	Mild	PREP	26	41
C=C(Cl)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756816	CG	On-Demand	Mild	L3MBTL3	54	44
C=C(Cl)COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756816	CG	On-Demand	Mild	HPGD	41	42
N#Cc1ccc(OCCCN2C(=O)[C@H]3CC[C@@H](C3)C2=O)cc1	ZINC000853756823	CE	On-Demand	Mild	HRH3	47	51
N#Cc1ccc(OCCCN2C(=O)[C@H]3CC[C@@H](C3)C2=O)cc1	ZINC000853756823	CE	On-Demand	Mild	MEN1	45	42
O=C(c1cccc(OCc2noc(-c3cccs3)n2)c1)N1CCCC1	ZINC000853756825	FH	On-Demand	Anodyne	ETHR	30	41
C#CCCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756850	CF	On-Demand	Mild	HRH3	28	53
C#CCCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756850	CF	On-Demand	Mild	PREP	26	41
C#CCCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756850	CF	On-Demand	Mild	PLA2G4B	22	40
C#CCCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756850	CF	On-Demand	Mild	EPHX2	17	40
C#CCCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756850	CF	On-Demand	Mild	L3MBTL3	57	43
C#CCCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756850	CF	On-Demand	Mild	HPGD	40	41
O=C(c1cccc(OCC[C@@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000853756852	EH	On-Demand	Anodyne	L3MBTL3	57	42
O=C(c1cccc(OCC[C@@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000853756852	EH	On-Demand	Anodyne	HPGD	42	38
O=C(c1cccc(OCC[C@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000853756853	EH	On-Demand	Anodyne	L3MBTL3	57	42
O=C(c1cccc(OCC[C@H]2CC2(Cl)Cl)c1)N1CCCC1	ZINC000853756853	EH	On-Demand	Anodyne	HPGD	42	38
C[C@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756855	CE	On-Demand	Mild	HRH3	26	47
C[C@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756855	CE	On-Demand	Mild	PREP	25	41
C[C@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756855	CE	On-Demand	Mild	L3MBTL3	39	40
C[C@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756855	CE	On-Demand	Mild	HPGD	44	41
C[C@@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756856	CE	On-Demand	Mild	HRH3	26	47
C[C@@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756856	CE	On-Demand	Mild	PREP	25	41
C[C@@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756856	CE	On-Demand	Mild	L3MBTL3	39	40
C[C@@H](C#N)OCCOc1cccc(C(=O)N2CCCC2)c1	ZINC000853756856	CE	On-Demand	Mild	HPGD	44	41
O=C(c1cccc(OCC2CC(F)(F)C2)c1)N1CCCC1	ZINC000853756859	CG	On-Demand	Anodyne	EPHX2	15	40
O=C(c1cccc(OCC2CC(F)(F)C2)c1)N1CCCC1	ZINC000853756859	CG	On-Demand	Anodyne	CHRNA10	54	40
O=C(c1cccc(OCC2CC(F)(F)C2)c1)N1CCCC1	ZINC000853756859	CG	On-Demand	Anodyne	L3MBTL3	56	43
O=C(c1cccc(OCC2CC(F)(F)C2)c1)N1CCCC1	ZINC000853756859	CG	On-Demand	Anodyne	HPGD	45	39
O=C(c1cccc(OCc2cc(Br)no2)c1)N1CCCC1	ZINC000853756860	FG	On-Demand	Anodyne	CPT1A	42	35
O=C(c1cccc(OCc2cc(Br)no2)c1)N1CCCC1	ZINC000853756860	FG	On-Demand	Anodyne	NR1H4	42	36
O=C(c1cccc(OCc2cc(Br)no2)c1)N1CCCC1	ZINC000853756860	FG	On-Demand	Anodyne	HPGD	48	42
O=C(NCC1Cc2ccccc2C1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853756866	ED	On-Demand	Anodyne	SLC18A3	42	38
O=C(NCC1Cc2ccccc2C1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853756866	ED	On-Demand	Anodyne	L3MBTL3	57	36
O=C(NCC1Cc2ccccc2C1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853756867	ED	On-Demand	Anodyne	SLC18A3	42	38
O=C(NCC1Cc2ccccc2C1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853756867	ED	On-Demand	Anodyne	L3MBTL3	57	36
N#Cc1cc2c(n(CCC3CCOCC3)c1=O)CCN(Cc1ccccc1)C2	ZINC000853756878	GG	On-Demand	Mild	ACHE	46	43
N#Cc1cc2c(n(CC3OCCO3)c1=O)CCN(Cc1ccccc1)C2	ZINC000853756879	FD	On-Demand	Mild	SIGMAR1	45	36
CS(=O)(=O)CC1(CCNc2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853756898	GG	On-Demand	Anodyne	PKN2	17	40
COc1ccc2c(NCCC3(CS(C)(=O)=O)CC3)ccnc2c1	ZINC000853756899	EF	On-Demand	Anodyne	HRP1_PLAFA	122	46
COc1ccc2c(NCCC3(CS(C)(=O)=O)CC3)ccnc2c1	ZINC000853756899	EF	On-Demand	Anodyne	HNMT	61	39
COc1ccc2c(NCCC3(CS(C)(=O)=O)CC3)ccnc2c1	ZINC000853756899	EF	On-Demand	Anodyne	BOTA	33	40
COc1ccc(N2CCN(C(=O)Cn3ccc(C#N)cc3=O)CC2)cc1	ZINC000853756902	FD	On-Demand	Mild	CCR1	21	44
COC[C@@H](CCNc1ccnc2cc(OC)ccc12)OC	ZINC000853756917	CF	On-Demand	Anodyne	HRP1_PLAFA	116	44
COC[C@@H](CCNc1ccnc2cc(OC)ccc12)OC	ZINC000853756917	CF	On-Demand	Anodyne	HNMT	61	37
COC[C@@H](CCNc1ccnc2cc(OC)ccc12)OC	ZINC000853756917	CF	On-Demand	Anodyne	BOTA	17	43
N#Cc1ccn(CC(=O)NC2CCCCCCC2)c(=O)c1	ZINC000853756919	CD	On-Demand	Mild	EPHX2	19	40
N#Cc1ccn(CC(=O)Nc2ccc(N3CCOCC3)cc2)c(=O)c1	ZINC000853756951	ED	On-Demand	Mild	STAT6	50	30
COC[C@@H](CCNc1ccc([N+](=O)[O-])cc1C(C)=O)OC	ZINC000853756952	CE	On-Demand	Bother	CACNA1D	42	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3ccccn3)c2)CC1	ZINC000853756955	GF	On-Demand	Anodyne	P2RY12	209	45
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3ccccn3)c2)CC1	ZINC000853756955	GF	On-Demand	Anodyne	TRY2_BOVIN	41	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cccc(-c3ccccn3)c2)CC1	ZINC000853756955	GF	On-Demand	Anodyne	FAAH	18	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3ccccn3)c2)CC1	ZINC000853756956	GF	On-Demand	Anodyne	P2RY12	209	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3ccccn3)c2)CC1	ZINC000853756956	GF	On-Demand	Anodyne	TRY2_BOVIN	41	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cccc(-c3ccccn3)c2)CC1	ZINC000853756956	GF	On-Demand	Anodyne	FAAH	18	41
Cc1cnc(COc2cccc(C(=O)N3CCCC3)c2)s1	ZINC000853756977	DG	On-Demand	Anodyne	L3MBTL3	50	41
Cc1cnc(COc2cccc(C(=O)N3CCCC3)c2)s1	ZINC000853756977	DG	On-Demand	Anodyne	HPGD	48	42
Cc1cnc(COc2cccc(C(=O)N3CCCC3)c2)s1	ZINC000853756977	DG	On-Demand	Anodyne	MAP3K12	27	41
O=C(CN1C(=O)[C@H]2CC[C@@H](C2)C1=O)NC1CCCCCCC1	ZINC000853756996	DE	On-Demand	Anodyne	EPHX2	16	41
Cc1nonc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756999	CE	On-Demand	Anodyne	NR1H4	46	34
Cc1nonc1COc1cccc(C(=O)N2CCCC2)c1	ZINC000853756999	CE	On-Demand	Anodyne	HPGD	48	42
Cc1cc(F)ccc1N1CCC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853757000	GE	On-Demand	Anodyne	GPBAR1	19	40
Cc1cc(F)ccc1N1CCC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853757001	GE	On-Demand	Anodyne	GPBAR1	19	40
C#CCN1CCN(C(=O)COc2cccc(C(=O)N3CCCC3)c2)CC1	ZINC000853757004	FD	On-Demand	Mild	DRD4	40	31
C#CCN1CCN(C(=O)COc2cccc(C(=O)N3CCCC3)c2)CC1	ZINC000853757004	FD	On-Demand	Mild	HTR1D	15	41
C#CCN1CCN(C(=O)COc2cccc(C(=O)N3CCCC3)c2)CC1	ZINC000853757004	FD	On-Demand	Mild	HTR1B	18	41
C#CCN1CCN(C(=O)COc2cccc(C(=O)N3CCCC3)c2)CC1	ZINC000853757004	FD	On-Demand	Mild	CPT1A	69	38
O=C(c1cccc(OCc2cnn(-c3ccccc3)n2)c1)N1CCCC1	ZINC000853757007	EG	On-Demand	Anodyne	HPGD	50	44
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCCC1	ZINC000853757008	FH	On-Demand	Anodyne	NR1H3	15	46
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCCC1	ZINC000853757008	FH	On-Demand	Anodyne	SLC6A5	28	40
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCCC1	ZINC000853757008	FH	On-Demand	Anodyne	NR1H2	23	46
O=C(c1cccc(OCc2cncc(C(F)(F)F)c2)c1)N1CCCC1	ZINC000853757008	FH	On-Demand	Anodyne	HPGD	38	43
O=C(c1cccc(OCc2cccnc2Cl)c1)N1CCCC1	ZINC000853757010	DH	On-Demand	Anodyne	HPGD	40	40
O=C(c1cccc(OCc2ccc(Cl)c([N+](=O)[O-])c2)c1)N1CCCC1	ZINC000853757011	FI	On-Demand	Bother	ACR	19	42
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	HRH2	26	44
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	CCR3	19	44
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	CPT1A	112	39
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	CPT2	46	36
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	PREP	31	42
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	FAAH	29	43
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	EPHX2	46	55
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	MCHR1	17	48
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	L3MBTL3	76	45
O=C(COc1cccc(C(=O)N2CCCC2)c1)NC1CCCCCCC1	ZINC000853757014	FH	On-Demand	Anodyne	HPGD	45	41
O=C(c1cccc(OCc2ccc(Cl)nc2C(F)(F)F)c1)N1CCCC1	ZINC000853757017	GJ	On-Demand	Anodyne	NR1H4	24	49
O=C(c1cccc(OCc2ccc(Cl)nc2C(F)(F)F)c1)N1CCCC1	ZINC000853757017	GJ	On-Demand	Anodyne	NR1H2	19	45
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	HRH3	60	54
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	CPT1A	15	45
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	PREP	26	42
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	PLA2G4B	47	44
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	FASN	24	40
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	ACR	19	40
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	L3MBTL3	48	41
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	HPGD	37	40
N#Cc1ccc(OCCCOc2cccc(C(=O)N3CCCC3)c2)cc1	ZINC000853757022	FH	On-Demand	Mild	MEN1	44	40
Cc1ccc(OCCOc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000853757023	EF	On-Demand	Anodyne	HRH3	34	52
Cc1ccc(OCCOc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000853757023	EF	On-Demand	Anodyne	PLA2G4B	39	43
Cc1ccc(OCCOc2cccc(C(=O)N3CCOCC3)c2)cc1	ZINC000853757023	EF	On-Demand	Anodyne	EPHX2	24	43
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757026	FE	On-Demand	Mild	DRD4	42	32
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757026	FE	On-Demand	Mild	MTNR1A	15	51
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757026	FE	On-Demand	Mild	MTNR1B	17	51
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757026	FE	On-Demand	Mild	ACKR3	49	30
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757027	FE	On-Demand	Mild	DRD4	42	32
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757027	FE	On-Demand	Mild	MTNR1A	15	51
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757027	FE	On-Demand	Mild	MTNR1B	17	51
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2cccc(OC)c2)C1	ZINC000853757027	FE	On-Demand	Mild	ACKR3	49	30
O=C(NCC1Cc2ccccc2C1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853757037	EE	On-Demand	Anodyne	CPT1A	117	39
O=C(NCC1Cc2ccccc2C1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853757038	EE	On-Demand	Anodyne	CPT1A	117	39
O=C(c1cccc(OCCC2SCCS2)c1)N1CCCC1	ZINC000853757069	DG	On-Demand	Anodyne	HRH3	22	48
O=C(c1cccc(OCCC2SCCS2)c1)N1CCCC1	ZINC000853757069	DG	On-Demand	Anodyne	L3MBTL3	66	44
O=C(c1cccc(OCCC2SCCS2)c1)N1CCCC1	ZINC000853757069	DG	On-Demand	Anodyne	HPGD	41	40
COC(=O)Cn1cc(COc2cccc(C(=O)N3CCCC3)c2)nn1	ZINC000853757070	ED	On-Demand	Anodyne	DRD4	41	32
COC(=O)Cn1cc(COc2cccc(C(=O)N3CCCC3)c2)nn1	ZINC000853757070	ED	On-Demand	Anodyne	HPGD	33	42
Cc1ncc(COc2cccc(C(=O)N3CCCC3)c2)s1	ZINC000853757079	DG	On-Demand	Anodyne	HPGD	48	42
CN(C(=O)NCC1Cc2ccccc2C1)[C@H](CO)Cc1ccccc1	ZINC000853757085	EF	On-Demand	Anodyne	NPY5R	16	41
CN(C(=O)NCC1Cc2ccccc2C1)[C@@H](CO)Cc1ccccc1	ZINC000853757086	EF	On-Demand	Anodyne	NPY5R	16	41
O=C(NCC1Cc2ccccc2C1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853757087	FE	On-Demand	Anodyne	PREP	30	41
O=C(NCC1Cc2ccccc2C1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853757087	FE	On-Demand	Anodyne	L3MBTL3	88	42
O=C(NCC1Cc2ccccc2C1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853757088	FE	On-Demand	Anodyne	PREP	30	41
O=C(NCC1Cc2ccccc2C1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853757088	FE	On-Demand	Anodyne	L3MBTL3	88	42
O=C(c1cccc(OCCC2(O)CC2)c1)N1CCCC1	ZINC000853757089	CE	On-Demand	Anodyne	PLA2G4B	21	40
O=C(c1cccc(OCCC2(O)CC2)c1)N1CCCC1	ZINC000853757089	CE	On-Demand	Anodyne	EPHX2	20	40
O=C(c1cccc(OCCC2(O)CC2)c1)N1CCCC1	ZINC000853757089	CE	On-Demand	Anodyne	L3MBTL3	70	46
O=C(c1cccc(OCCC2(O)CC2)c1)N1CCCC1	ZINC000853757089	CE	On-Demand	Anodyne	HPGD	42	41
C#CCN1CCN(C(=O)COc2cccc(-c3ccccn3)c2)CC1	ZINC000853757175	ED	On-Demand	Mild	FABP4	44	35
C#CCN1CCN(C(=O)COc2cccc(-c3ccccn3)c2)CC1	ZINC000853757175	ED	On-Demand	Mild	CPT1A	96	41
CS(=O)(=O)CC1(CCNc2nccc(N3CCCC3)n2)CC1	ZINC000853757178	DD	On-Demand	Anodyne	MRGPRX1	41	35
C#CCCN(CCOC)C(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757181	FD	On-Demand	Mild	DRD4	28	41
C#CCCN(CCOC)C(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757182	FD	On-Demand	Mild	DRD4	28	41
CS(=O)(=O)CC1(CCNc2ccc([N+](=O)[O-])c3nonc23)CC1	ZINC000853757190	ED	On-Demand	Bother	GSTM2	111	42
CS(=O)(=O)CC1(CCNc2ccc([N+](=O)[O-])c3nonc23)CC1	ZINC000853757190	ED	On-Demand	Bother	GSTP1	69	42
O=C(COc1cccc(-c2ccccn2)c1)N1CCC2(CC1)OCCO2	ZINC000853757193	FE	On-Demand	Anodyne	FABP4	45	35
O=C(COc1cccc(-c2ccccn2)c1)N1CCC2(CC1)OCCO2	ZINC000853757193	FE	On-Demand	Anodyne	CPT1A	93	39
CC(C)(C)OC(=O)N1CCC(CCn2ccc(C#N)cc2=O)CC1	ZINC000853757206	EF	On-Demand	Mild	GPR119	52	47
O=C(NC(C1CCCC1)C1CCCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853757212	EH	On-Demand	Anodyne	CPT1A	59	34
O=C(NC(C1CCCC1)C1CCCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853757213	EH	On-Demand	Anodyne	CPT1A	59	34
COCC1(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCC1	ZINC000853757214	CF	On-Demand	Bother	CACNA1D	65	33
Cn1c(S)nnc1CCNC(=O)NCc1cccc(-n2cncn2)c1	ZINC000853757242	FC	On-Demand	Anodyne	CARM1	40	32
CC(C)(C)OC(=O)N1CC[C@@H](CCn2ccc(C#N)cc2=O)C1	ZINC000853757251	DE	On-Demand	Mild	GPR119	42	43
CC(C)(C)OC(=O)N1CC[C@H](CCn2ccc(C#N)cc2=O)C1	ZINC000853757252	DE	On-Demand	Mild	GPR119	42	43
COC[C@@H](CCNc1ccc([N+](=O)[O-])c2nonc12)OC	ZINC000853757259	CD	On-Demand	Bother	GSTM2	122	45
COC[C@@H](CCNc1ccc([N+](=O)[O-])c2nonc12)OC	ZINC000853757259	CD	On-Demand	Bother	GSTP1	76	45
O=S1(=O)CCC(COc2cccc(-c3ccccn3)c2)CC1	ZINC000853757293	DF	On-Demand	Anodyne	CHRNA10	51	32
CS(=O)(=O)CC1(CCNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])CC1	ZINC000853757316	EE	On-Demand	Bother	COLA	55	34
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757335	FC	On-Demand	Anodyne	HTR1A	30	46
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757335	FC	On-Demand	Anodyne	DRD2	22	44
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757335	FC	On-Demand	Anodyne	DRD4	36	46
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757335	FC	On-Demand	Anodyne	DRD3	23	44
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757335	FC	On-Demand	Anodyne	P2RX3	26	40
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757336	FC	On-Demand	Anodyne	HTR1A	30	46
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757336	FC	On-Demand	Anodyne	DRD2	22	44
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757336	FC	On-Demand	Anodyne	DRD4	36	46
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757336	FC	On-Demand	Anodyne	DRD3	23	44
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccn2)CC1	ZINC000853757336	FC	On-Demand	Anodyne	P2RX3	26	40
COC[C@@H](CCNc1nccc(N2CCCC2)n1)OC	ZINC000853757346	CD	On-Demand	Anodyne	SORD	61	38
COC[C@@H](CCNc1nccc(N2CCCC2)n1)OC	ZINC000853757346	CD	On-Demand	Anodyne	MRGPRX1	40	38
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000853757351	GC	On-Demand	Anodyne	DRD4	17	42
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000853757351	GC	On-Demand	Anodyne	PTPN2	44	38
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000853757351	GC	On-Demand	Anodyne	SIGMAR1	20	45
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000853757351	GC	On-Demand	Anodyne	PTPN1	35	40
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000853757351	GC	On-Demand	Anodyne	EPHX2	37	44
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)Cc2ccccc2)CC1	ZINC000853757351	GC	On-Demand	Anodyne	TGM2	33	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)n2ccc(C#N)cc2=O)CC1	ZINC000853757365	EC	On-Demand	Mild	P2RY12	59	39
CCOC(=O)N1CCN(C(=O)[C@H](C)n2ccc(C#N)cc2=O)CC1	ZINC000853757366	EC	On-Demand	Mild	P2RY12	59	39
CC(C)(C)OC(=O)N1CCC(Cn2ccc(C#N)cc2=O)CC1	ZINC000853757400	DE	On-Demand	Mild	GPR119	51	45
CC(C)(C)OC(=O)N1CCC(CCCn2ccc(C#N)cc2=O)CC1	ZINC000853757468	EG	On-Demand	Mild	GPR119	50	49
COC[C@@H](CCNc1nc(-c2cccnc2)nc2ccccc12)OC	ZINC000853757476	EG	On-Demand	Anodyne	PKN2	17	41
CO[C@]1(CO)CCCN(C(=O)NCC[S@@](=O)Cc2ccccc2)C1	ZINC000853757503	FD	On-Demand	Anodyne	SLC12A5	48	38
CO[C@]1(CO)CCCN(C(=O)NCC[S@](=O)Cc2ccccc2)C1	ZINC000853757504	FD	On-Demand	Anodyne	SLC12A5	48	38
CCN1CC[C@H](N(CC)C(=O)NCC[S@@](=O)Cc2ccccc2)C1	ZINC000853757513	FE	On-Demand	Anodyne	CCR5	54	54
CCN1CC[C@@H](N(CC)C(=O)NCC[S@@](=O)Cc2ccccc2)C1	ZINC000853757514	FE	On-Demand	Anodyne	CCR5	54	54
CCN1CC[C@@H](N(CC)C(=O)NCC[S@](=O)Cc2ccccc2)C1	ZINC000853757515	FE	On-Demand	Anodyne	CCR5	54	54
CCN1CC[C@H](N(CC)C(=O)NCC[S@](=O)Cc2ccccc2)C1	ZINC000853757516	FE	On-Demand	Anodyne	CCR5	54	54
O=C(NCC[S@](=O)Cc1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853757517	GD	On-Demand	Anodyne	L3MBTL3	90	39
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853757518	GD	On-Demand	Anodyne	L3MBTL3	90	39
O=C(NCC[S@](=O)Cc1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853757519	GD	On-Demand	Anodyne	L3MBTL3	90	39
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853757520	GD	On-Demand	Anodyne	L3MBTL3	90	39
O=C(NCC[S@](=O)Cc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853757525	FD	On-Demand	Anodyne	CPT1A	110	39
O=C(NCC[S@](=O)Cc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853757526	FD	On-Demand	Anodyne	CPT1A	110	39
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853757527	FD	On-Demand	Anodyne	CPT1A	110	39
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853757528	FD	On-Demand	Anodyne	CPT1A	110	39
O=C1[C@H](Oc2cc(CO)cc(C(F)(F)F)c2)CCCN1Cc1ccccc1	ZINC000853757581	GH	On-Demand	Anodyne	TACR1	47	41
O=C1[C@@H](Oc2cc(CO)cc(C(F)(F)F)c2)CCCN1Cc1ccccc1	ZINC000853757586	GH	On-Demand	Anodyne	TACR1	47	41
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](Cn2ccc(C#N)cc2=O)CC1	ZINC000853757589	EG	On-Demand	Mild	ACACB	15	40
CON(C)CCNC(=O)NCc1cccc(-n2cncn2)c1	ZINC000853757608	DC	On-Demand	Anodyne	CARM1	41	33
C[C@@H]1CCN(C(=O)N[C@@H]2CSc3ccccc32)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853757646	GF	On-Demand	Anodyne	RBP4	60	35
C[C@@H]1CCN(C(=O)N[C@H]2CSc3ccccc32)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853757647	GF	On-Demand	Anodyne	RBP4	60	35
N#Cc1ccc(CCNc2nccc(N3CCCC3)n2)cc1	ZINC000853757700	CF	On-Demand	Mild	GPBAR1	32	44
N#Cc1ccc(CCNc2nccc(N3CCCC3)n2)cc1	ZINC000853757700	CF	On-Demand	Mild	MRGPRX1	50	52
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853757713	GE	On-Demand	Anodyne	DRD4	27	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853757713	GE	On-Demand	Anodyne	P2RX3	26	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853757713	GE	On-Demand	Anodyne	EBP	26	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853757714	GE	On-Demand	Anodyne	DRD4	27	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853757714	GE	On-Demand	Anodyne	P2RX3	26	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853757714	GE	On-Demand	Anodyne	EBP	26	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853757715	GE	On-Demand	Anodyne	DRD4	27	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853757715	GE	On-Demand	Anodyne	P2RX3	26	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853757715	GE	On-Demand	Anodyne	EBP	26	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853757716	GE	On-Demand	Anodyne	DRD4	27	40
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853757716	GE	On-Demand	Anodyne	P2RX3	26	41
C[C@H](CN1CCN(c2ccccn2)CC1)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853757716	GE	On-Demand	Anodyne	EBP	26	41
N#Cc1ccn(CC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(=O)c1	ZINC000853757718	FC	On-Demand	Mild	SSTR1	49	45
CC(=O)NCc1ccc(CNc2nc(C)ccc2Cl)cc1	ZINC000853757788	DG	On-Demand	Anodyne	DNAE	51	31
Nc1nc(Cl)cc(Nc2cccc(CN3CCCS3(=O)=O)c2)n1	ZINC000853757823	FD	On-Demand	Anodyne	AGPAT2	40	36
Fc1cc(OCC2OCCO2)cnc1Cl	ZINC000853757830	BD	On-Demand	Anodyne	CHRNA3	41	34
CC(=O)NCc1ccc(CNc2nnc(C)cc2C(F)(F)F)cc1	ZINC000853757833	EG	On-Demand	Anodyne	NR1H3	17	40
CC(=O)NCc1ccc(CNc2nnc(C)cc2C(F)(F)F)cc1	ZINC000853757833	EG	On-Demand	Anodyne	NR1H2	29	40
COc1ccc(N2CCN(C(=O)COc3cnc4c(F)cccc4c3)CC2)cc1	ZINC000853757897	GG	On-Demand	Clean	HTR1A	16	47
COc1ccc(N2CCN(C(=O)COc3cnc4c(F)cccc4c3)CC2)cc1	ZINC000853757897	GG	On-Demand	Clean	HTR1D	19	46
COc1ccc(N2CCN(C(=O)COc3cnc4c(F)cccc4c3)CC2)cc1	ZINC000853757897	GG	On-Demand	Clean	HTR1B	20	46
COc1ccc(N2CCN(C(=O)COc3cnc4c(F)cccc4c3)CC2)cc1	ZINC000853757897	GG	On-Demand	Clean	CCKAR	35	46
COc1ccc(N2CCN(C(=O)COc3cnc4c(F)cccc4c3)CC2)cc1	ZINC000853757897	GG	On-Demand	Clean	SSTR1	44	35
Fc1cc(OCCCN2CCCCC2)cnc1Cl	ZINC000853757910	CG	On-Demand	Anodyne	LTA4H	36	43
Fc1cc(OCCCN2CCCCC2)cnc1Cl	ZINC000853757910	CG	On-Demand	Anodyne	HRH3	106	52
Fc1cc(OCCCN2CCCCC2)cnc1Cl	ZINC000853757910	CG	On-Demand	Anodyne	SIGMAR1	23	47
Fc1cc(OCCCN2CCCCC2)cnc1Cl	ZINC000853757910	CG	On-Demand	Anodyne	HNMT	82	44
Fc1cc(OCCCN2CCCCC2)cnc1Cl	ZINC000853757910	CG	On-Demand	Anodyne	PSMB1	43	39
O=C(NCCCOc1cnc(Cl)c(F)c1)C1CCCC1	ZINC000853757961	DF	On-Demand	Anodyne	TBK1	79	39
COC(=O)c1cnc(NCc2ccc(CNC(C)=O)cc2)cc1C(F)(F)F	ZINC000853757995	GG	On-Demand	Anodyne	BDKRB1	15	42
CC(=O)Nc1ccc(S(=O)(=O)CCCOc2cnc(Cl)c(F)c2)cc1	ZINC000853758014	GG	On-Demand	Anodyne	IDO1	31	42
O=C(NCC[S@@](=O)Cc1ccccc1)N(CCN1CCOCC1)CC1CC1	ZINC000853758076	GD	On-Demand	Anodyne	CASR	57	43
O=C(NCC[S@](=O)Cc1ccccc1)N(CCN1CCOCC1)CC1CC1	ZINC000853758077	GD	On-Demand	Anodyne	CASR	57	43
O=C(NCC[S@](=O)Cc1ccccc1)NCC(O)(C1CC1)C1CC1	ZINC000853758090	FD	On-Demand	Anodyne	CYP2J2	42	30
O=C(NCC[S@@](=O)Cc1ccccc1)NCC(O)(C1CC1)C1CC1	ZINC000853758091	FD	On-Demand	Anodyne	CYP2J2	42	30
COC(=O)c1cccc(NNC(=O)NCCCc2ccc(O)cc2)c1C	ZINC000853758144	FF	On-Demand	Reactive	SLC6A5	28	43
CCOc1cc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853758171	DF	On-Demand	Clean	PDE3A	33	40
CCOc1cc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853758171	DF	On-Demand	Clean	HRH4	36	43
CCOc1cc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853758171	DF	On-Demand	Clean	PDE3B	40	40
CCOc1cc(N[C@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853758172	DF	On-Demand	Clean	PDE3A	33	40
CCOc1cc(N[C@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853758172	DF	On-Demand	Clean	HRH4	36	43
CCOc1cc(N[C@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853758172	DF	On-Demand	Clean	PDE3B	40	40
COC[C@@H](NC(=O)NCCN(C)OC)c1cccc(C(F)(F)F)c1	ZINC000853758207	EE	On-Demand	Anodyne	PDS	42	36
COC[C@H](NC(=O)NCCN(C)OC)c1cccc(C(F)(F)F)c1	ZINC000853758208	EE	On-Demand	Anodyne	PDS	42	36
COC[C@@H](NC(=O)NCCC1SCCS1)c1cccc(C(F)(F)F)c1	ZINC000853758238	GH	On-Demand	Anodyne	PDS	40	34
COC[C@H](NC(=O)NCCC1SCCS1)c1cccc(C(F)(F)F)c1	ZINC000853758240	GH	On-Demand	Anodyne	PDS	40	34
CN(C(=O)NCC[S@@](=O)Cc1ccccc1)[C@H](CO)Cc1ccccc1	ZINC000853758292	FE	On-Demand	Anodyne	NPY5R	16	41
CN(C(=O)NCC[S@](=O)Cc1ccccc1)[C@@H](CO)Cc1ccccc1	ZINC000853758293	FE	On-Demand	Anodyne	NPY5R	16	41
CN(C(=O)NCC[S@@](=O)Cc1ccccc1)[C@@H](CO)Cc1ccccc1	ZINC000853758294	FE	On-Demand	Anodyne	NPY5R	16	41
CN(C(=O)NCC[S@](=O)Cc1ccccc1)[C@H](CO)Cc1ccccc1	ZINC000853758295	FE	On-Demand	Anodyne	NPY5R	16	41
COC[C@H](NC(=O)N[C@H]1C[C@H](O)c2ccccc21)c1cccc(C(F)(F)F)c1	ZINC000853758350	GH	On-Demand	Anodyne	PDS	40	34
COC[C@H](NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21)c1cccc(C(F)(F)F)c1	ZINC000853758351	GH	On-Demand	Anodyne	PDS	40	34
COC[C@H](NC(=O)N[C@H]1C[C@@H](O)c2ccccc21)c1cccc(C(F)(F)F)c1	ZINC000853758352	GH	On-Demand	Anodyne	PDS	40	34
COC[C@H](NC(=O)N[C@@H]1C[C@H](O)c2ccccc21)c1cccc(C(F)(F)F)c1	ZINC000853758353	GH	On-Demand	Anodyne	PDS	40	34
CC(=O)NCc1ccc(CNc2cc(Cl)nc(C)n2)cc1	ZINC000853758504	DF	On-Demand	Anodyne	DNAE	48	32
CC(=O)NCc1ccc(CNc2cc(Cl)nc(C)n2)cc1	ZINC000853758504	DF	On-Demand	Anodyne	SCD	21	40
O=C(NCCCc1nc[nH]n1)NCC[S@@](=O)Cc1ccccc1	ZINC000853758507	EC	On-Demand	Anodyne	HRH2	20	41
O=C(NCCCc1nc[nH]n1)NCC[S@](=O)Cc1ccccc1	ZINC000853758508	EC	On-Demand	Anodyne	HRH2	20	41
COC[C@H](NC(=O)N(C)CCN(C)C(=O)OC)c1cccc(C(F)(F)F)c1	ZINC000853758537	GF	On-Demand	Anodyne	PDS	40	35
COC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)c1cccc(C(F)(F)F)c1	ZINC000853758538	GF	On-Demand	Anodyne	PDS	40	35
COC[C@@H](NC(=O)NCCN(C)C(=O)OC)c1cccc(C(F)(F)F)c1	ZINC000853758541	GE	On-Demand	Anodyne	PDS	41	35
COC[C@H](NC(=O)NCCN(C)C(=O)OC)c1cccc(C(F)(F)F)c1	ZINC000853758542	GE	On-Demand	Anodyne	PDS	41	35
O=S1(=O)N(CCOc2cccc(F)c2)CCN1c1ccccc1	ZINC000853758600	EE	On-Demand	Anodyne	LTA4H	15	42
O=S1(=O)N(CCOc2cccc(F)c2)CCN1c1ccccc1	ZINC000853758600	EE	On-Demand	Anodyne	CHRNA10	51	43
COCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853758621	FE	On-Demand	Clean	DRD4	46	38
COCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853758621	FE	On-Demand	Clean	F10	15	43
COCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853758621	FE	On-Demand	Clean	MCHR1	19	49
COCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853758622	FE	On-Demand	Clean	DRD4	46	38
COCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853758622	FE	On-Demand	Clean	F10	15	43
COCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853758622	FE	On-Demand	Clean	MCHR1	19	49
O=C(NCCCc1ccc(O)cc1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758663	GH	On-Demand	Anodyne	ADRB2	48	39
O=C(NCCCc1ccc(O)cc1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758663	GH	On-Demand	Anodyne	ADRB1	39	44
O=C(NCCCc1ccc(O)cc1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758663	GH	On-Demand	Anodyne	ADRB3	47	40
O=C(NCCCc1ccc(O)cc1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758663	GH	On-Demand	Anodyne	SLC6A5	21	44
O=C(NCCCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758665	GH	On-Demand	Anodyne	ADRB2	48	39
O=C(NCCCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758665	GH	On-Demand	Anodyne	ADRB1	39	44
O=C(NCCCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758665	GH	On-Demand	Anodyne	ADRB3	47	40
O=C(NCCCc1ccc(O)cc1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853758665	GH	On-Demand	Anodyne	SLC6A5	21	44
Fc1cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cnc1Cl	ZINC000853758670	FH	On-Demand	Anodyne	DRD4	26	56
Fc1cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cnc1Cl	ZINC000853758670	FH	On-Demand	Anodyne	SIGMAR1	20	40
Fc1cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cnc1Cl	ZINC000853758670	FH	On-Demand	Anodyne	CHRNA3	41	35
Fc1cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cnc1Cl	ZINC000853758672	FH	On-Demand	Anodyne	DRD4	26	56
Fc1cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cnc1Cl	ZINC000853758672	FH	On-Demand	Anodyne	SIGMAR1	20	40
Fc1cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cnc1Cl	ZINC000853758672	FH	On-Demand	Anodyne	CHRNA3	41	35
O=C(NCCCc1ccc(O)cc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853758732	EF	On-Demand	Anodyne	SLC6A5	26	41
O=C(NCCCc1ccc(O)cc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853758734	EF	On-Demand	Anodyne	SLC6A5	26	41
O=C(NCCCc1ccc(O)cc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853758736	EF	On-Demand	Anodyne	SLC6A5	26	41
O=C(NCCCc1ccc(O)cc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853758738	EF	On-Demand	Anodyne	SLC6A5	26	41
COCCN(CCF)C(=O)NCCCc1ccc(O)cc1	ZINC000853758754	CD	On-Demand	Anodyne	GRIA1	44	32
COCCN(CCF)C(=O)NCCCc1ccc(O)cc1	ZINC000853758754	CD	On-Demand	Anodyne	SLC6A5	25	41
CC(=O)NCc1ccc(CNc2cc(C(F)(F)F)cc(Cl)n2)cc1	ZINC000853758755	FI	On-Demand	Anodyne	TACR1	17	44
CC(=O)NCc1ccc(CNc2cc(C(F)(F)F)cc(Cl)n2)cc1	ZINC000853758755	FI	On-Demand	Anodyne	SCD	25	42
COc1ccc(C(=O)N2CCC(NC(=O)NCc3ncccn3)CC2)cc1OC	ZINC000853758774	GD	On-Demand	Anodyne	SSTR5	56	36
COc1ccc(C(=O)N2CCC(NC(=O)NCc3ncccn3)CC2)cc1OC	ZINC000853758774	GD	On-Demand	Anodyne	EPHX2	43	46
COc1ccc(C(=O)N2CCC(NC(=O)NCc3ncccn3)CC2)cc1OC	ZINC000853758774	GD	On-Demand	Anodyne	L3MBTL3	51	34
CCOC(=O)N1CCN(C(=O)[C@H](C)Oc2cnc(Cl)c(F)c2)CC1	ZINC000853758777	FD	On-Demand	Anodyne	P2RY12	53	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)Oc2cnc(Cl)c(F)c2)CC1	ZINC000853758779	FD	On-Demand	Anodyne	P2RY12	53	36
COc1cccc(C2(NC(=O)NCC[S@@](=O)Cc3ccccc3)CCC2)c1	ZINC000853758793	GG	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(NC(=O)NCC[S@](=O)Cc3ccccc3)CCC2)c1	ZINC000853758795	GG	On-Demand	Anodyne	DRD4	42	32
COc1ccc(C(=O)N2CCC(NC(=O)NCCN(C)OC)CC2)cc1OC	ZINC000853758808	GD	On-Demand	Anodyne	SSTR5	43	36
COc1ccc(C(=O)N2CCC(NC(=O)NCCN(C)OC)CC2)cc1OC	ZINC000853758808	GD	On-Demand	Anodyne	EPHX2	35	42
COc1ccc(C(=O)N2CCC(NC(=O)NCCN(C)OC)CC2)cc1OC	ZINC000853758808	GD	On-Demand	Anodyne	MCHR1	16	45
COc1ccc(C(=O)N2CCC(NC(=O)NCCN(C)OC)CC2)cc1OC	ZINC000853758808	GD	On-Demand	Anodyne	L3MBTL3	51	33
COc1ccc(C(=O)N2CCC(NC(=O)NCCN(C)OC)CC2)cc1OC	ZINC000853758808	GD	On-Demand	Anodyne	ACKR3	43	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCCc1ccc(O)cc1	ZINC000853758819	GG	On-Demand	Anodyne	GRIA1	40	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCCc1ccc(O)cc1	ZINC000853758819	GG	On-Demand	Anodyne	GPR119	26	42
COC(=O)c1cncc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853758837	ED	On-Demand	Clean	NPBWR1	40	30
COC(=O)c1cncc(N[C@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853758838	ED	On-Demand	Clean	NPBWR1	40	30
COc1ccc(C(=O)N2CCC(NC(=O)N[C@H]3C=CCC3)CC2)cc1OC	ZINC000853758856	FE	On-Demand	Anodyne	EPHX2	43	44
COc1ccc(C(=O)N2CCC(NC(=O)N[C@H]3C=CCC3)CC2)cc1OC	ZINC000853758856	FE	On-Demand	Anodyne	L3MBTL3	60	35
COc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C=CCC3)CC2)cc1OC	ZINC000853758857	FE	On-Demand	Anodyne	EPHX2	43	44
COc1ccc(C(=O)N2CCC(NC(=O)N[C@@H]3C=CCC3)CC2)cc1OC	ZINC000853758857	FE	On-Demand	Anodyne	L3MBTL3	60	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)N2c3ccccc3N(C)S2(=O)=O)CC1	ZINC000853758916	GC	On-Demand	Anodyne	P2RY12	80	40
CCOC(=O)N1CCN(C(=O)[C@H](C)N2c3ccccc3N(C)S2(=O)=O)CC1	ZINC000853758917	GC	On-Demand	Anodyne	P2RY12	80	40
COc1ccc2c(NC[C@H](OC)[C@@H]3CCOC3)ccnc2c1	ZINC000853758939	DF	On-Demand	Anodyne	HRP1_PLAFA	95	41
COc1ccc2c(NC[C@H](OC)[C@@H]3CCOC3)ccnc2c1	ZINC000853758939	DF	On-Demand	Anodyne	HNMT	55	34
COc1ccc2c(NC[C@H](OC)[C@H]3CCOC3)ccnc2c1	ZINC000853758940	DF	On-Demand	Anodyne	HRP1_PLAFA	95	41
COc1ccc2c(NC[C@H](OC)[C@H]3CCOC3)ccnc2c1	ZINC000853758940	DF	On-Demand	Anodyne	HNMT	55	34
COc1ccc2c(NC[C@@H](OC)[C@@H]3CCOC3)ccnc2c1	ZINC000853758941	DF	On-Demand	Anodyne	HRP1_PLAFA	95	41
COc1ccc2c(NC[C@@H](OC)[C@@H]3CCOC3)ccnc2c1	ZINC000853758941	DF	On-Demand	Anodyne	HNMT	55	34
COc1ccc2c(NC[C@@H](OC)[C@H]3CCOC3)ccnc2c1	ZINC000853758942	DF	On-Demand	Anodyne	HRP1_PLAFA	95	41
COc1ccc2c(NC[C@@H](OC)[C@H]3CCOC3)ccnc2c1	ZINC000853758942	DF	On-Demand	Anodyne	HNMT	55	34
O=C(NCC[S@](=O)Cc1ccccc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853758968	GD	On-Demand	Anodyne	L3MBTL3	44	36
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853758969	GD	On-Demand	Anodyne	L3MBTL3	44	36
O=C(NCC[S@](=O)Cc1ccccc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853758970	GD	On-Demand	Anodyne	L3MBTL3	44	36
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853758971	GD	On-Demand	Anodyne	L3MBTL3	44	36
CC(=O)NCc1ccc(CNc2cc(C)nc(N)n2)cc1	ZINC000853758991	CD	On-Demand	Anodyne	TPH1	73	41
CC(=O)NCc1ccc(CNc2cc(C)nc(N)n2)cc1	ZINC000853758991	CD	On-Demand	Anodyne	DRTS_TRYCR	44	30
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853759039	FF	On-Demand	Clean	SSTR1	41	35
CNC(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853759040	FF	On-Demand	Clean	SSTR1	41	35
CCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759053	FF	On-Demand	Clean	DRD4	46	38
CCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759053	FF	On-Demand	Clean	SSTR5	36	40
CCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759053	FF	On-Demand	Clean	MCHR1	20	49
CCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759053	FF	On-Demand	Clean	AXL	22	41
CCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759053	FF	On-Demand	Clean	TYRO3	34	41
CCCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759053	FF	On-Demand	Clean	MERTK	39	41
CCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759054	FF	On-Demand	Clean	DRD4	46	38
CCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759054	FF	On-Demand	Clean	SSTR5	36	40
CCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759054	FF	On-Demand	Clean	MCHR1	20	49
CCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759054	FF	On-Demand	Clean	AXL	22	41
CCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759054	FF	On-Demand	Clean	TYRO3	34	41
CCCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759054	FF	On-Demand	Clean	MERTK	39	41
O=C(CN1CCN(c2ccccc2)S1(=O)=O)NC1CCCCCCC1	ZINC000853759077	FE	On-Demand	Anodyne	EPHX2	25	45
COCc1cc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853759088	DE	On-Demand	Clean	HRH4	32	42
COCc1cc(N[C@H]2CCN(c3ccc(OC)cc3)C2)ncn1	ZINC000853759089	DE	On-Demand	Clean	HRH4	32	42
O=C(NCC[S@](=O)Cc1ccccc1)N1CCCC[C@@H]1CC1CCC1	ZINC000853759167	FH	On-Demand	Anodyne	FKBP1A	24	41
O=C(NCC[S@](=O)Cc1ccccc1)N1CCCC[C@H]1CC1CCC1	ZINC000853759168	FH	On-Demand	Anodyne	FKBP1A	24	41
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCCC[C@@H]1CC1CCC1	ZINC000853759169	FH	On-Demand	Anodyne	FKBP1A	24	41
O=C(NCC[S@@](=O)Cc1ccccc1)N1CCCC[C@H]1CC1CCC1	ZINC000853759170	FH	On-Demand	Anodyne	FKBP1A	24	41
COC[C@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759191	GF	On-Demand	Anodyne	DRD4	40	31
COC[C@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759191	GF	On-Demand	Anodyne	MTNR1A	35	42
COC[C@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759191	GF	On-Demand	Anodyne	MTNR1B	35	42
COC[C@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759191	GF	On-Demand	Anodyne	PDS	52	39
COC[C@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759192	GF	On-Demand	Anodyne	DRD4	40	31
COC[C@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759192	GF	On-Demand	Anodyne	MTNR1A	35	42
COC[C@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759192	GF	On-Demand	Anodyne	MTNR1B	35	42
COC[C@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759192	GF	On-Demand	Anodyne	PDS	52	39
COC[C@@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759193	GF	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759193	GF	On-Demand	Anodyne	MTNR1A	35	42
COC[C@@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759193	GF	On-Demand	Anodyne	MTNR1B	35	42
COC[C@@H](NC(=O)NCC[S@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759193	GF	On-Demand	Anodyne	PDS	52	39
COC[C@@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759194	GF	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759194	GF	On-Demand	Anodyne	MTNR1A	35	42
COC[C@@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759194	GF	On-Demand	Anodyne	MTNR1B	35	42
COC[C@@H](NC(=O)NCC[S@@](=O)Cc1ccccc1)c1cccc(OC)c1	ZINC000853759194	GF	On-Demand	Anodyne	PDS	52	39
COc1cc(NCc2ccc(CNC(C)=O)cc2)c([N+](=O)[O-])cc1OC	ZINC000853759220	FF	On-Demand	Bother	MTNR1B	19	41
O=C(NCCCc1ccc(O)cc1)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853759250	FF	On-Demand	Anodyne	GRIA1	49	36
O=C(NCCCc1ccc(O)cc1)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853759251	FF	On-Demand	Anodyne	GRIA1	49	36
COC(=O)c1sc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1Cl	ZINC000853759266	FG	On-Demand	Clean	NPBWR1	43	32
COC(=O)c1sc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1Cl	ZINC000853759267	FG	On-Demand	Clean	NPBWR1	43	32
CCOc1cncc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853759330	DF	On-Demand	Clean	HRH4	32	42
CCOc1cncc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853759330	DF	On-Demand	Clean	CACNA2D2	52	34
CCOc1cncc(N[C@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853759331	DF	On-Demand	Clean	HRH4	32	42
CCOc1cncc(N[C@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853759331	DF	On-Demand	Clean	CACNA2D2	52	34
CC[C@H](C)N(CC)C(=O)NCC[S@@](=O)Cc1ccccc1	ZINC000853759355	DF	On-Demand	Anodyne	CAPN2	47	31
CC[C@H](C)N(CC)C(=O)NCC[S@@](=O)Cc1ccccc1	ZINC000853759355	DF	On-Demand	Anodyne	NPR	61	35
CC[C@H](C)N(CC)C(=O)NCC[S@](=O)Cc1ccccc1	ZINC000853759356	DF	On-Demand	Anodyne	CAPN2	47	31
CC[C@H](C)N(CC)C(=O)NCC[S@](=O)Cc1ccccc1	ZINC000853759356	DF	On-Demand	Anodyne	NPR	61	35
COC[C@@H](NC(=O)NCC1SCCS1)c1cccc(C(F)(F)F)c1	ZINC000853759428	GG	On-Demand	Anodyne	PDS	41	37
COC[C@H](NC(=O)NCC1SCCS1)c1cccc(C(F)(F)F)c1	ZINC000853759430	GG	On-Demand	Anodyne	PDS	41	37
COCCN(CCF)C(=O)N[C@@H](COC)c1cccc(C(F)(F)F)c1	ZINC000853759502	FG	On-Demand	Anodyne	PDS	40	34
CC(=O)NCc1ccc(CNc2ncc3c(n2)CCCC3)cc1	ZINC000853759517	DF	On-Demand	Anodyne	MAPK1	31	47
COC[C@@H](NC(=O)NCc1ncccn1)c1cccc(C(F)(F)F)c1	ZINC000853759536	FF	On-Demand	Anodyne	PDS	46	40
COC[C@H](NC(=O)NCc1ncccn1)c1cccc(C(F)(F)F)c1	ZINC000853759537	FF	On-Demand	Anodyne	PDS	46	40
N#Cc1ccc(OCCCN2CCN(c3ccccc3)S2(=O)=O)cc1	ZINC000853759571	FE	On-Demand	Mild	HRH3	27	49
N#Cc1ccc(OCCCN2CCN(c3ccccc3)S2(=O)=O)cc1	ZINC000853759571	FE	On-Demand	Mild	MEN1	44	44
CCNc1nccnc1N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853759590	DF	On-Demand	Clean	EHMT2	41	32
CCNc1nccnc1N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853759591	DF	On-Demand	Clean	EHMT2	41	32
CC(=O)NCc1ccc(CNc2nccc(N3CCCC3)n2)cc1	ZINC000853759656	EE	On-Demand	Anodyne	SORD	71	37
CC(=O)NCc1ccc(CNc2nccc(N3CCCC3)n2)cc1	ZINC000853759656	EE	On-Demand	Anodyne	MRGPRX1	45	39
O=C(NC(C1CCCC1)C1CCCC1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853759670	GH	On-Demand	Anodyne	L3MBTL3	51	40
O=C(NC(C1CCCC1)C1CCCC1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853759671	GH	On-Demand	Anodyne	L3MBTL3	51	40
C[C@@H](CCNC(=O)NCC[S@](=O)Cc1ccccc1)N(C)C	ZINC000853759687	ED	On-Demand	Anodyne	NPR	55	36
C[C@@H](CCNC(=O)NCC[S@@](=O)Cc1ccccc1)N(C)C	ZINC000853759690	ED	On-Demand	Anodyne	NPR	55	36
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	ESR1	72	38
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	ESR2	52	39
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	LTA4H	46	51
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	HRH3	64	49
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	SIGMAR1	17	43
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	HNMT	43	38
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	PSMB2	46	47
Fc1cc(OCCN2CCCCC2)cnc1Cl	ZINC000853759699	CF	On-Demand	Anodyne	PSMB1	50	47
O=C(NCC[S@](=O)Cc1ccccc1)N(CCC1CC1)CC1CC1	ZINC000853759709	EG	On-Demand	Anodyne	ACHE	21	43
O=C(NCC[S@@](=O)Cc1ccccc1)N(CCC1CC1)CC1CC1	ZINC000853759710	EG	On-Demand	Anodyne	ACHE	21	43
CC(=O)NCc1ccc(CNc2ncnc3c2c(Br)nn3C)cc1	ZINC000853759721	GE	On-Demand	Anodyne	ADORA3	37	41
C#CCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759736	FE	On-Demand	Mild	DRD4	42	33
C#CCNC(=O)c1ccc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759736	FE	On-Demand	Mild	MCHR1	15	48
C#CCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759738	FE	On-Demand	Mild	DRD4	42	33
C#CCNC(=O)c1ccc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759738	FE	On-Demand	Mild	MCHR1	15	48
COC[C@H](NC(=O)N[C@H]1C=CCC1)c1cccc(C(F)(F)F)c1	ZINC000853759785	EG	On-Demand	Anodyne	PDS	40	35
COC[C@H](NC(=O)N[C@@H]1C=CCC1)c1cccc(C(F)(F)F)c1	ZINC000853759786	EG	On-Demand	Anodyne	PDS	40	35
COC[C@@H](NC(=O)N[C@H]1C=CCC1)c1cccc(C(F)(F)F)c1	ZINC000853759787	EG	On-Demand	Anodyne	PDS	40	35
COC[C@@H](NC(=O)N[C@@H]1C=CCC1)c1cccc(C(F)(F)F)c1	ZINC000853759788	EG	On-Demand	Anodyne	PDS	40	35
COC(=O)c1cnc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759871	ED	On-Demand	Clean	MCHR1	15	47
COC(=O)c1cnc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759871	ED	On-Demand	Clean	NPBWR1	50	32
COC(=O)c1cnc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759872	ED	On-Demand	Clean	MCHR1	15	47
COC(=O)c1cnc(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc1	ZINC000853759872	ED	On-Demand	Clean	NPBWR1	50	32
Nc1nc(Cl)cc(N2CC[C@@H](Cn3ccnn3)C2)n1	ZINC000853759875	CC	On-Demand	Anodyne	HRH4	43	39
Nc1nc(Cl)cc(N2CC[C@H](Cn3ccnn3)C2)n1	ZINC000853759876	CC	On-Demand	Anodyne	HRH4	43	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccccc2F)CC1	ZINC000853759880	FF	On-Demand	Anodyne	P2RY12	120	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccccc2F)CC1	ZINC000853759881	FF	On-Demand	Anodyne	P2RY12	120	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(F)cc2)CC1	ZINC000853759942	FF	On-Demand	Anodyne	P2RY12	59	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(F)cc2)CC1	ZINC000853759943	FF	On-Demand	Anodyne	P2RY12	59	37
O=[N+]([O-])c1cccc(CSCCOC(F)F)c1	ZINC000853759961	CG	On-Demand	Bother	CACNA1D	41	32
CC(C)(C)OC(=O)N1CCC(CN2CCN(c3ccccc3)S2(=O)=O)CC1	ZINC000853759963	GF	On-Demand	Anodyne	CCR8	16	40
CC(C)(C)OC(=O)N1CCC(CN2CCN(c3ccccc3)S2(=O)=O)CC1	ZINC000853759963	GF	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1CCC(CN2CCN(c3ccccc3)S2(=O)=O)CC1	ZINC000853759963	GF	On-Demand	Anodyne	SFRP1	18	41
CCOC(=O)[C@]1(F)CN(c2ncnc3c2ncn3C2CC2)CC12CCC2	ZINC000853759982	FE	On-Demand	Anodyne	OXGR1	84	36
CCOC(=O)[C@@]1(F)CN(c2ncnc3c2ncn3C2CC2)CC12CCC2	ZINC000853759983	FE	On-Demand	Anodyne	OXGR1	84	36
O=C(NCc1ccccc1OC1CCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853760061	FH	On-Demand	Anodyne	SLC5A4	44	38
O=C(NCc1ccccc1OC1CCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853760062	FH	On-Demand	Anodyne	SLC5A4	44	38
O=C(NCc1ccccc1OC1CCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853760063	FH	On-Demand	Anodyne	SLC5A4	44	38
O=C(NCc1ccccc1OC1CCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853760064	FH	On-Demand	Anodyne	SLC5A4	44	38
N#CC[C@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853760179	CE	On-Demand	Mild	SORD	53	38
N#CC[C@@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853760180	CE	On-Demand	Mild	SORD	53	38
CN(C(=O)c1ccncc1)c1ccc(CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)cc1	ZINC000853760211	GE	On-Demand	Anodyne	NOS2	46	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(F)c(F)c2)CC1	ZINC000853760226	FF	On-Demand	Anodyne	P2RY12	73	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(F)c(F)c2)CC1	ZINC000853760227	FF	On-Demand	Anodyne	P2RY12	73	37
Cn1ncc2c(Nc3ccc(OCCS(C)(=O)=O)cc3)ncnc21	ZINC000853760238	ED	On-Demand	Anodyne	EGFR	15	45
Cn1ncc2c(Nc3ccc(OCCS(C)(=O)=O)cc3)ncnc21	ZINC000853760238	ED	On-Demand	Anodyne	ERBB2	17	45
Cc1nnc(Nc2ccc(OCCS(C)(=O)=O)cc2)nc1C	ZINC000853760262	DD	On-Demand	Anodyne	SRC	17	42
Cc1nnc(Nc2ccc(OCCS(C)(=O)=O)cc2)nc1C	ZINC000853760262	DD	On-Demand	Anodyne	YES1	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C)no2)CC1	ZINC000853760273	ED	On-Demand	Anodyne	P2RY12	62	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C)no2)CC1	ZINC000853760274	ED	On-Demand	Anodyne	P2RY12	62	36
COC(=O)Cc1ccnc(N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853760322	EE	On-Demand	Clean	HRH4	30	47
COC(=O)Cc1ccnc(N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853760322	EE	On-Demand	Clean	PRKD1	75	35
COC(=O)Cc1ccnc(N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853760322	EE	On-Demand	Clean	MCHR1	17	41
COC(=O)Cc1ccnc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853760323	EE	On-Demand	Clean	HRH4	30	47
COC(=O)Cc1ccnc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853760323	EE	On-Demand	Clean	PRKD1	75	35
COC(=O)Cc1ccnc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853760323	EE	On-Demand	Clean	MCHR1	17	41
O=[N+]([O-])c1ccc(N2CC[C@@H](Cn3ccnn3)C2)c2nonc12	ZINC000853760324	DD	On-Demand	Bother	GSTM2	80	40
O=[N+]([O-])c1ccc(N2CC[C@@H](Cn3ccnn3)C2)c2nonc12	ZINC000853760324	DD	On-Demand	Bother	GSTP1	40	40
O=[N+]([O-])c1ccc(N2CC[C@H](Cn3ccnn3)C2)c2nonc12	ZINC000853760325	DD	On-Demand	Bother	GSTM2	80	40
O=[N+]([O-])c1ccc(N2CC[C@H](Cn3ccnn3)C2)c2nonc12	ZINC000853760325	DD	On-Demand	Bother	GSTP1	40	40
N#CC[C@@H]1CCCN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)C1	ZINC000853760358	FG	On-Demand	Mild	HSD11B1	15	41
N#CC[C@H]1CCCN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)C1	ZINC000853760375	FG	On-Demand	Mild	HSD11B1	15	41
CCOC(=O)c1csc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853760380	EG	On-Demand	Clean	P2RY12	50	36
CCOC(=O)c1csc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853760380	EG	On-Demand	Clean	TRPC6	41	43
CCOC(=O)c1csc(N[C@@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853760380	EG	On-Demand	Clean	TRPC3	34	43
C#CCCN(CCOC)C(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C	ZINC000853760381	DD	On-Demand	Mild	ACE	19	40
CCOC(=O)c1csc(N[C@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853760382	EG	On-Demand	Clean	P2RY12	50	36
CCOC(=O)c1csc(N[C@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853760382	EG	On-Demand	Clean	TRPC6	41	43
CCOC(=O)c1csc(N[C@H]2CCN(c3ccc(OC)cc3)C2)n1	ZINC000853760382	EG	On-Demand	Clean	TRPC3	34	43
C#CCCN(CCOC)C(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000853760383	DD	On-Demand	Mild	ACE	19	40
C#CCCN(CCOC)C(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C	ZINC000853760385	DD	On-Demand	Mild	ACE	19	40
C#CCCN(CCOC)C(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C	ZINC000853760387	DD	On-Demand	Mild	ACE	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(F)c2)CC1	ZINC000853760429	FF	On-Demand	Anodyne	P2RY12	98	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(F)c2)CC1	ZINC000853760430	FF	On-Demand	Anodyne	P2RY12	98	39
CCn1c(=O)c(Nc2ccc(OCCS(C)(=O)=O)cc2)nc2ccccc21	ZINC000853760480	GF	On-Demand	Anodyne	PYGM	29	51
CCOc1nc(Nc2ccc(OCCS(C)(=O)=O)cc2)ncc1Cl	ZINC000853760512	FF	On-Demand	Anodyne	FGFR1	22	45
CCOc1nc(Nc2ccc(OCCS(C)(=O)=O)cc2)ncc1Cl	ZINC000853760512	FF	On-Demand	Anodyne	SRC	24	45
CCOc1nc(Nc2ccc(OCCS(C)(=O)=O)cc2)ncc1Cl	ZINC000853760512	FF	On-Demand	Anodyne	WEE1	18	41
COC(=O)/C=C\c1ccc(N[C@H](CO)C2CCC2)c([N+](=O)[O-])c1	ZINC000853760574	DE	On-Demand	Bother	NR1H4	44	36
COC(=O)/C=C\c1ccc(N[C@@H](CO)C2CCC2)c([N+](=O)[O-])c1	ZINC000853760577	DE	On-Demand	Bother	NR1H4	44	36
COc1ccc2c(N3CC[C@@H](Cn4ccnn4)C3)ccnc2c1	ZINC000853760671	DE	On-Demand	Anodyne	PDE3A	40	38
COc1ccc2c(N3CC[C@@H](Cn4ccnn4)C3)ccnc2c1	ZINC000853760671	DE	On-Demand	Anodyne	PDE3B	44	38
COc1ccc2c(N3CC[C@H](Cn4ccnn4)C3)ccnc2c1	ZINC000853760672	DE	On-Demand	Anodyne	PDE3A	40	38
COc1ccc2c(N3CC[C@H](Cn4ccnn4)C3)ccnc2c1	ZINC000853760672	DE	On-Demand	Anodyne	PDE3B	44	38
COC(=O)c1sc(N2CCC[C@H](CC#N)C2)nc1Cl	ZINC000853760705	CF	On-Demand	Mild	PARE	81	34
COC(=O)c1sc(N2CCC[C@@H](CC#N)C2)nc1Cl	ZINC000853760706	CF	On-Demand	Mild	PARE	81	34
CCOC(=O)[C@]1(F)CN(c2ncnc3ccc(F)cc23)CC12CCC2	ZINC000853760733	EG	On-Demand	Anodyne	PDGFRB	23	41
CCOC(=O)[C@@]1(F)CN(c2ncnc3ccc(F)cc23)CC12CCC2	ZINC000853760734	EG	On-Demand	Anodyne	PDGFRB	23	41
CCOc1cc(CCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853760797	GH	On-Demand	Anodyne	SSTR5	51	38
CCOc1cc(CCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853760797	GH	On-Demand	Anodyne	MTNR1A	19	43
CCOc1cc(CCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853760797	GH	On-Demand	Anodyne	MTNR1B	25	48
CCOc1cc(CCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853760798	GH	On-Demand	Anodyne	SSTR5	51	38
CCOc1cc(CCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853760798	GH	On-Demand	Anodyne	MTNR1A	19	43
CCOc1cc(CCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)ccc1OC	ZINC000853760798	GH	On-Demand	Anodyne	MTNR1B	25	48
CCOc1cc(CCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853760799	GH	On-Demand	Anodyne	SSTR5	51	38
CCOc1cc(CCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853760799	GH	On-Demand	Anodyne	MTNR1A	19	43
CCOc1cc(CCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853760799	GH	On-Demand	Anodyne	MTNR1B	25	48
CCOc1cc(CCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853760800	GH	On-Demand	Anodyne	SSTR5	51	38
CCOc1cc(CCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853760800	GH	On-Demand	Anodyne	MTNR1A	19	43
CCOc1cc(CCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)ccc1OC	ZINC000853760800	GH	On-Demand	Anodyne	MTNR1B	25	48
CCOc1cc(Nc2ccc(OCCS(C)(=O)=O)cc2)nc(C)n1	ZINC000853760804	FE	On-Demand	Anodyne	AGPAT2	51	37
NS(=O)(=O)c1ccc(NCC[S@@](=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853760808	GC	On-Demand	Bother	CA2	18	45
NS(=O)(=O)c1ccc(NCC[S@](=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853760809	GC	On-Demand	Bother	CA2	18	45
FC(F)OCCSCc1ccc(-n2cccn2)cc1	ZINC000853760812	CG	On-Demand	Anodyne	AMP1_PLAFQ	44	34
CCOC(=O)[C@@]1(F)CN(c2ccc([N+](=O)[O-])cc2C#N)CC12CCC2	ZINC000853760924	EF	On-Demand	Mild	CACNA1D	46	36
CCOC(=O)[C@]1(F)CN(c2ccc([N+](=O)[O-])cc2C#N)CC12CCC2	ZINC000853760925	EF	On-Demand	Mild	CACNA1D	46	36
Cc1cc(N2CC[C@H](Cn3ccnn3)C2)nc(N)n1	ZINC000853760949	CC	On-Demand	Anodyne	HRH4	45	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2ccccc2F)CC1	ZINC000853760990	GF	On-Demand	Anodyne	P2RY12	131	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2ccccc2F)CC1	ZINC000853760991	GF	On-Demand	Anodyne	P2RY12	131	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2ccc(F)cc2)CC1	ZINC000853761009	GF	On-Demand	Anodyne	P2RY12	76	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2ccc(F)cc2)CC1	ZINC000853761010	GF	On-Demand	Anodyne	P2RY12	76	39
CCOC(=O)[C@@]1(F)CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12CCC2	ZINC000853761019	FF	On-Demand	Bother	CACNA1D	57	34
CCOC(=O)[C@@]1(F)CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12CCC2	ZINC000853761019	FF	On-Demand	Bother	SLC27A4	41	30
CCOC(=O)[C@]1(F)CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12CCC2	ZINC000853761022	FF	On-Demand	Bother	CACNA1D	57	34
CCOC(=O)[C@]1(F)CN(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CC12CCC2	ZINC000853761022	FF	On-Demand	Bother	SLC27A4	41	30
CC(=O)c1ccc(NCC[S@@](=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853761061	EF	On-Demand	Bother	TAAR1	16	45
CC(=O)c1ccc(NCC[S@@](=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853761061	EF	On-Demand	Bother	AKR1C3	16	40
CC(=O)c1ccc(NCC[S@](=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853761063	EF	On-Demand	Bother	TAAR1	16	45
CC(=O)c1ccc(NCC[S@](=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853761063	EF	On-Demand	Bother	AKR1C3	16	40
OC[C@@H](Nc1nccc(N2CCCC2)n1)C1CCC1	ZINC000853761174	CD	On-Demand	Anodyne	SORD	76	40
OC[C@H](Nc1nccc(N2CCCC2)n1)C1CCC1	ZINC000853761175	CD	On-Demand	Anodyne	SORD	76	40
CN1CCN(C(=O)NCc2ccc(N(C)C(=O)c3ccncc3)cc2)CCC1=O	ZINC000853761188	GD	On-Demand	Anodyne	NAMPT	27	40
CCn1c(=O)c(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc2ccccc21	ZINC000853761220	FG	On-Demand	Clean	HRH1	30	48
CCn1c(=O)c(N[C@H]2CCN(c3ccc(OC)cc3)C2)nc2ccccc21	ZINC000853761220	FG	On-Demand	Clean	PDE6D	62	35
CCn1c(=O)c(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc2ccccc21	ZINC000853761223	FG	On-Demand	Clean	HRH1	30	48
CCn1c(=O)c(N[C@@H]2CCN(c3ccc(OC)cc3)C2)nc2ccccc21	ZINC000853761223	FG	On-Demand	Clean	PDE6D	62	35
Cc1cc(N2Cc3ccccc3[C@@H](C(=O)OC(C)(C)C)C2)nc(N)n1	ZINC000853761224	EF	On-Demand	Anodyne	HRH4	19	40
Cc1cc(N2Cc3ccccc3[C@H](C(=O)OC(C)(C)C)C2)nc(N)n1	ZINC000853761228	EF	On-Demand	Anodyne	HRH4	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(F)c2F)CC1	ZINC000853761267	FF	On-Demand	Anodyne	P2RY12	61	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(F)c2F)CC1	ZINC000853761270	FF	On-Demand	Anodyne	P2RY12	61	37
Cc1oncc1CSCc1cccc([N+](=O)[O-])c1	ZINC000853761451	CG	On-Demand	Bother	CACNA1D	44	32
COc1ccc2c(N3CCC[C@H](CC#N)C3)ccnc2c1	ZINC000853761459	CG	On-Demand	Mild	PDE3B	40	37
COc1ccc2c(N3CCC[C@@H](CC#N)C3)ccnc2c1	ZINC000853761461	CG	On-Demand	Mild	PDE3B	40	37
Cc1cc(C(F)(F)F)c(Nc2ccc(OCCS(C)(=O)=O)cc2)nn1	ZINC000853761479	GF	On-Demand	Anodyne	PTK2	40	33
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCCOc2ccccc2)CC1	ZINC000853761495	GF	On-Demand	Anodyne	P2RY12	202	46
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCCOc2ccccc2)CC1	ZINC000853761495	GF	On-Demand	Anodyne	PLA2G4B	74	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCCOc2ccccc2)CC1	ZINC000853761496	GF	On-Demand	Anodyne	P2RY12	202	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCCOc2ccccc2)CC1	ZINC000853761496	GF	On-Demand	Anodyne	PLA2G4B	74	34
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2ccccc2)CC1	ZINC000853761501	FG	On-Demand	Anodyne	CHRM1	22	50
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2ccccc2)CC1	ZINC000853761501	FG	On-Demand	Anodyne	GHRHR	40	32
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2ccccc2)CC1	ZINC000853761501	FG	On-Demand	Anodyne	P2RY12	208	45
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2ccccc2)CC1	ZINC000853761502	FG	On-Demand	Anodyne	CHRM1	22	50
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2ccccc2)CC1	ZINC000853761502	FG	On-Demand	Anodyne	GHRHR	40	32
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2ccccc2)CC1	ZINC000853761502	FG	On-Demand	Anodyne	P2RY12	208	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2ccccc2)CC1	ZINC000853761503	FG	On-Demand	Anodyne	CHRM1	22	50
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2ccccc2)CC1	ZINC000853761503	FG	On-Demand	Anodyne	GHRHR	40	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2ccccc2)CC1	ZINC000853761503	FG	On-Demand	Anodyne	P2RY12	208	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2ccccc2)CC1	ZINC000853761504	FG	On-Demand	Anodyne	CHRM1	22	50
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2ccccc2)CC1	ZINC000853761504	FG	On-Demand	Anodyne	GHRHR	40	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2ccccc2)CC1	ZINC000853761504	FG	On-Demand	Anodyne	P2RY12	208	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(C(N)=O)cc2)CC1	ZINC000853761517	GD	On-Demand	Anodyne	P2RY12	53	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(C(N)=O)cc2)CC1	ZINC000853761517	GD	On-Demand	Anodyne	TRY2_BOVIN	21	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(C(N)=O)cc2)CC1	ZINC000853761518	GD	On-Demand	Anodyne	P2RY12	53	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(C(N)=O)cc2)CC1	ZINC000853761518	GD	On-Demand	Anodyne	TRY2_BOVIN	21	40
CON(C)CCNC(=O)NCCCc1ccc(O)cc1	ZINC000853761599	CD	On-Demand	Anodyne	MTNR1A	20	42
CON(C)CCNC(=O)NCCCc1ccc(O)cc1	ZINC000853761599	CD	On-Demand	Anodyne	MTNR1B	19	42
CON(C)CCNC(=O)NCCCc1ccc(O)cc1	ZINC000853761599	CD	On-Demand	Anodyne	GRIA1	43	33
CON(C)CCNC(=O)NCCCc1ccc(O)cc1	ZINC000853761599	CD	On-Demand	Anodyne	SLC6A5	18	40
CCOC(=O)[C@@]1(F)CN(c2nc(C(F)(F)F)ccc2C#N)CC12CCC2	ZINC000853761613	FG	On-Demand	Mild	P2RY12	22	40
CCOC(=O)[C@]1(F)CN(c2nc(C(F)(F)F)ccc2C#N)CC12CCC2	ZINC000853761618	FG	On-Demand	Mild	P2RY12	22	40
C#CCCN(CCOC)C(=O)N[C@H](C)[C@H](OC)c1ccc(Cl)cc1	ZINC000853761625	FG	On-Demand	Mild	UTS2	41	33
C#CCCN(CCOC)C(=O)N[C@H](C)[C@@H](OC)c1ccc(Cl)cc1	ZINC000853761627	FG	On-Demand	Mild	UTS2	41	33
C#CCCN(CCOC)C(=O)N[C@@H](C)[C@@H](OC)c1ccc(Cl)cc1	ZINC000853761630	FG	On-Demand	Mild	UTS2	41	33
C#CCCN(CCOC)C(=O)N[C@@H](C)[C@H](OC)c1ccc(Cl)cc1	ZINC000853761633	FG	On-Demand	Mild	UTS2	41	33
Cc1cc(N2CCC[C@H](CC#N)C2)nc(N)n1	ZINC000853761638	BD	On-Demand	Mild	HRH4	51	41
CCCCC[C@@H](C)NC(=O)CN1CCN(c2ccccc2)S1(=O)=O	ZINC000853761649	FE	On-Demand	Anodyne	P2RY12	82	33
CCCCC[C@@H](C)NC(=O)CN1CCN(c2ccccc2)S1(=O)=O	ZINC000853761649	FE	On-Demand	Anodyne	NOD1	55	34
O=S(=O)(c1cc(F)ccc1N1CC[C@H](Cn2ccnn2)C1)C(F)(F)F	ZINC000853761663	GE	On-Demand	Anodyne	LIPG	39	41
O=S(=O)(c1cc(F)ccc1N1CC[C@@H](Cn2ccnn2)C1)C(F)(F)F	ZINC000853761665	GE	On-Demand	Anodyne	LIPG	39	41
N#CC[C@H]1CCCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853761738	CE	On-Demand	Mild	GSTM2	95	47
N#CC[C@H]1CCCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853761738	CE	On-Demand	Mild	GSTP1	53	47
N#CC[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853761740	CE	On-Demand	Mild	GSTM2	95	47
N#CC[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853761740	CE	On-Demand	Mild	GSTP1	53	47
CCOC(=O)[C@@]1(F)CN(c2ccnc(C(C)C)n2)CC12CCC2	ZINC000853761743	DF	On-Demand	Anodyne	SORD	93	36
CCOC(=O)[C@]1(F)CN(c2ccnc(C(C)C)n2)CC12CCC2	ZINC000853761745	DF	On-Demand	Anodyne	SORD	93	36
CCOC(=O)[C@@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761776	DE	On-Demand	Anodyne	AKT2	56	47
CCOC(=O)[C@@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761776	DE	On-Demand	Anodyne	AKT3	40	47
CCOC(=O)[C@@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761776	DE	On-Demand	Anodyne	ROCK2	15	47
CCOC(=O)[C@@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761776	DE	On-Demand	Anodyne	AKT1	35	47
CCOC(=O)[C@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761777	DE	On-Demand	Anodyne	AKT2	56	47
CCOC(=O)[C@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761777	DE	On-Demand	Anodyne	AKT3	40	47
CCOC(=O)[C@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761777	DE	On-Demand	Anodyne	ROCK2	15	47
CCOC(=O)[C@]1(F)CN(c2ncnc3[nH]ccc23)CC12CCC2	ZINC000853761777	DE	On-Demand	Anodyne	AKT1	35	47
COc1ccc(CCSCCC2SCCS2)cc1	ZINC000853761801	DI	On-Demand	Anodyne	SLC18A2	28	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(N)nc(N)n2)CC1	ZINC000853761813	FB	On-Demand	Anodyne	P2RY12	54	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(N)nc(N)n2)CC1	ZINC000853761814	FB	On-Demand	Anodyne	P2RY12	54	36
CO[C@@H](c1ccc(Cl)cc1)[C@@H](C)NC(=O)NCCN(C)OC	ZINC000853761852	EE	On-Demand	Anodyne	UTS2	45	36
CO[C@@H](c1ccc(Cl)cc1)[C@H](C)NC(=O)NCCN(C)OC	ZINC000853761855	EE	On-Demand	Anodyne	UTS2	45	36
CCOC(=O)[C@@]1(F)CN(c2ccc(C(=O)Nc3ccccc3)nn2)CC12CCC2	ZINC000853761968	GF	On-Demand	Anodyne	SCD1	48	43
CCOC(=O)[C@]1(F)CN(c2ccc(C(=O)Nc3ccccc3)nn2)CC12CCC2	ZINC000853761970	GF	On-Demand	Anodyne	SCD1	48	43
O=[N+]([O-])c1cccc(CSCCC2SCCS2)c1	ZINC000853762031	DI	On-Demand	Bother	CACNA1D	47	33
CCOC(=O)[C@@]1(F)CN(c2ccc([N+](=O)[O-])cn2)CC12CCC2	ZINC000853762084	DE	On-Demand	Bother	SLC27A4	47	31
CCOC(=O)[C@]1(F)CN(c2ccc([N+](=O)[O-])cn2)CC12CCC2	ZINC000853762086	DE	On-Demand	Bother	SLC27A4	47	31
COC(=O)c1sc(N2CC[C@@H](Cn3ccnn3)C2)nc1Cl	ZINC000853762087	ED	On-Demand	Anodyne	PARE	88	34
COC(=O)c1sc(N2CC[C@H](Cn3ccnn3)C2)nc1Cl	ZINC000853762091	ED	On-Demand	Anodyne	PARE	88	34
CC(C)(C)OC(=O)N1CC[C@@H](CCN2CCN(c3ccccc3)S2(=O)=O)C1	ZINC000853762109	GF	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1CC[C@H](CCN2CCN(c3ccccc3)S2(=O)=O)C1	ZINC000853762110	GF	On-Demand	Anodyne	GPR119	40	42
Cc1oncc1CSCc1ccc(F)cc1Cl	ZINC000853762183	CI	On-Demand	Anodyne	P2RX7	45	39
CCOC(=O)[C@@]1(F)CN(c2ncnc3ccsc23)CC12CCC2	ZINC000853762193	EF	On-Demand	Anodyne	SIRT3	58	31
CCOC(=O)[C@@]1(F)CN(c2ncnc3ccsc23)CC12CCC2	ZINC000853762193	EF	On-Demand	Anodyne	SIRT2	49	30
CCOC(=O)[C@@]1(F)CN(c2ncnc3ccsc23)CC12CCC2	ZINC000853762193	EF	On-Demand	Anodyne	SIRT1	49	30
CCOC(=O)[C@]1(F)CN(c2ncnc3ccsc23)CC12CCC2	ZINC000853762194	EF	On-Demand	Anodyne	SIRT3	58	31
CCOC(=O)[C@]1(F)CN(c2ncnc3ccsc23)CC12CCC2	ZINC000853762194	EF	On-Demand	Anodyne	SIRT2	49	30
CCOC(=O)[C@]1(F)CN(c2ncnc3ccsc23)CC12CCC2	ZINC000853762194	EF	On-Demand	Anodyne	SIRT1	49	30
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C(=O)OC)c(C)o2)CC1	ZINC000853762223	GE	On-Demand	Anodyne	P2RY12	73	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C(=O)OC)c(C)o2)CC1	ZINC000853762224	GE	On-Demand	Anodyne	P2RY12	73	35
CCOC(=O)[C@]1(F)CN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])CC12CCC2	ZINC000853762227	GE	On-Demand	Bother	TAAR1	17	40
CCOC(=O)[C@@]1(F)CN(c2ccc(C(=O)NC)cc2[N+](=O)[O-])CC12CCC2	ZINC000853762228	GE	On-Demand	Bother	TAAR1	17	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(OC)c(F)c2)CC1	ZINC000853762233	GF	On-Demand	Anodyne	P2RY12	52	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(OC)c(F)c2)CC1	ZINC000853762234	GF	On-Demand	Anodyne	P2RY12	52	35
N#CC[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1	ZINC000853762279	BF	On-Demand	Mild	SSTR1	38	44
N#CC[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2)C1	ZINC000853762280	BF	On-Demand	Mild	SSTR1	38	44
CCOC(=O)[C@]1(F)CN(c2ncnc3ccccc23)CC12CCC2	ZINC000853762328	EF	On-Demand	Anodyne	AKT2	17	42
CCOC(=O)[C@]1(F)CN(c2ncnc3ccccc23)CC12CCC2	ZINC000853762328	EF	On-Demand	Anodyne	AKT3	22	42
CCOC(=O)[C@]1(F)CN(c2ncnc3ccccc23)CC12CCC2	ZINC000853762328	EF	On-Demand	Anodyne	AKT1	16	42
CCOC(=O)[C@@]1(F)CN(c2ncnc3ccccc23)CC12CCC2	ZINC000853762329	EF	On-Demand	Anodyne	AKT2	17	42
CCOC(=O)[C@@]1(F)CN(c2ncnc3ccccc23)CC12CCC2	ZINC000853762329	EF	On-Demand	Anodyne	AKT3	22	42
CCOC(=O)[C@@]1(F)CN(c2ncnc3ccccc23)CC12CCC2	ZINC000853762329	EF	On-Demand	Anodyne	AKT1	16	42
N#CC[C@H]1CCCN(c2cc(Cl)nc(N)n2)C1	ZINC000853762334	CD	On-Demand	Mild	HRH4	46	41
N#CC[C@@H]1CCCN(c2cc(Cl)nc(N)n2)C1	ZINC000853762335	CD	On-Demand	Mild	HRH4	46	41
N#Cc1cnc2c(Cl)cccc2c1NCC[S@@](=O)CC(F)(F)F	ZINC000853762367	FG	On-Demand	Mild	MAP3K8	125	41
N#Cc1cnc2c(Cl)cccc2c1NCC[S@](=O)CC(F)(F)F	ZINC000853762368	FG	On-Demand	Mild	MAP3K8	125	41
CCCn1c(S[C@@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)nnc1-c1ccncc1	ZINC000853762430	II	On-Demand	Anodyne	PRNP	39	43
CCCn1c(S[C@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)nnc1-c1ccncc1	ZINC000853762431	II	On-Demand	Anodyne	PRNP	39	43
O=[S@@](CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853762505	GG	On-Demand	Anodyne	EGFR	83	45
O=[S@@](CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853762505	GG	On-Demand	Anodyne	CLK4	54	34
O=[S@@](CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853762505	GG	On-Demand	Anodyne	CD38	40	38
O=[S@](CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853762506	GG	On-Demand	Anodyne	EGFR	83	45
O=[S@](CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853762506	GG	On-Demand	Anodyne	CLK4	54	34
O=[S@](CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853762506	GG	On-Demand	Anodyne	CD38	40	38
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCCC2CC2)C1	ZINC000853762540	EF	On-Demand	Anodyne	EPHX2	18	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCCC2CC2)C1	ZINC000853762540	EF	On-Demand	Anodyne	GPR119	19	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCCC2CC2)C1	ZINC000853762541	EF	On-Demand	Anodyne	EPHX2	18	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCCC2CC2)C1	ZINC000853762541	EF	On-Demand	Anodyne	GPR119	19	41
O=[S@@](CCNc1nc2ccccc2s1)CC(F)(F)F	ZINC000853762587	DG	On-Demand	Anodyne	CSNK1D	24	42
O=[S@](CCNc1nc2ccccc2s1)CC(F)(F)F	ZINC000853762588	DG	On-Demand	Anodyne	CSNK1D	24	42
O=[S@](CCNc1ncnc2c1ncn2C1CC1)CC(F)(F)F	ZINC000853762633	ED	On-Demand	Anodyne	ADORA1	58	40
O=[S@](CCNc1ncnc2c1ncn2C1CC1)CC(F)(F)F	ZINC000853762633	ED	On-Demand	Anodyne	ADORA3	69	37
O=[S@@](CCNc1ncnc2c1ncn2C1CC1)CC(F)(F)F	ZINC000853762634	ED	On-Demand	Anodyne	ADORA1	58	40
O=[S@@](CCNc1ncnc2c1ncn2C1CC1)CC(F)(F)F	ZINC000853762634	ED	On-Demand	Anodyne	ADORA3	69	37
C#CCCN(CCOC)C(=O)NCCCCN1CCN(C)CC1	ZINC000853762665	DC	On-Demand	Mild	DRD3	50	39
CCOc1ccc(-c2nc(CSCc3cnoc3C)cs2)cc1OC	ZINC000853762691	GJ	On-Demand	Anodyne	DCK	36	48
CSCC[C@H](C)NC(=O)N[C@H](c1ccccc1)[C@H](C)O	ZINC000853762708	CF	On-Demand	Anodyne	MME	20	41
CSCC[C@H](C)NC(=O)N[C@H](c1ccccc1)[C@H](C)O	ZINC000853762708	CF	On-Demand	Anodyne	FPR1	40	39
CSCC[C@H](C)NC(=O)N[C@@H](c1ccccc1)[C@@H](C)O	ZINC000853762710	CF	On-Demand	Anodyne	MME	20	41
CSCC[C@H](C)NC(=O)N[C@@H](c1ccccc1)[C@@H](C)O	ZINC000853762710	CF	On-Demand	Anodyne	FPR1	40	39
CSCC[C@H](C)NC(=O)N[C@H](c1ccccc1)[C@@H](C)O	ZINC000853762712	CF	On-Demand	Anodyne	MME	20	41
CSCC[C@H](C)NC(=O)N[C@H](c1ccccc1)[C@@H](C)O	ZINC000853762712	CF	On-Demand	Anodyne	FPR1	40	39
CCn1c(=O)c(NCC[S@@](=O)CC(F)(F)F)nc2ccccc21	ZINC000853762713	EE	On-Demand	Anodyne	PYGM	21	43
CSCC[C@H](C)NC(=O)N[C@@H](c1ccccc1)[C@H](C)O	ZINC000853762714	CF	On-Demand	Anodyne	MME	20	41
CSCC[C@H](C)NC(=O)N[C@@H](c1ccccc1)[C@H](C)O	ZINC000853762714	CF	On-Demand	Anodyne	FPR1	40	39
CCn1c(=O)c(NCC[S@](=O)CC(F)(F)F)nc2ccccc21	ZINC000853762715	EE	On-Demand	Anodyne	PYGM	21	43
CSCC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762754	DE	On-Demand	Anodyne	ACE	25	45
CSCC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762754	DE	On-Demand	Anodyne	MME	73	45
CSCC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762754	DE	On-Demand	Anodyne	NPY5R	20	42
CSCC[C@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762754	DE	On-Demand	Anodyne	FPR1	42	43
CSCC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762756	DE	On-Demand	Anodyne	ACE	25	45
CSCC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762756	DE	On-Demand	Anodyne	MME	73	45
CSCC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762756	DE	On-Demand	Anodyne	NPY5R	20	42
CSCC[C@@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762756	DE	On-Demand	Anodyne	FPR1	42	43
CSCC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762758	DE	On-Demand	Anodyne	ACE	25	45
CSCC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762758	DE	On-Demand	Anodyne	MME	73	45
CSCC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762758	DE	On-Demand	Anodyne	NPY5R	20	42
CSCC[C@@H](C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853762758	DE	On-Demand	Anodyne	FPR1	42	43
CSCC[C@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762760	DE	On-Demand	Anodyne	ACE	25	45
CSCC[C@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762760	DE	On-Demand	Anodyne	MME	73	45
CSCC[C@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762760	DE	On-Demand	Anodyne	NPY5R	20	42
CSCC[C@H](C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853762760	DE	On-Demand	Anodyne	FPR1	42	43
CSCC[C@@H](C)NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853762869	FE	On-Demand	Anodyne	SIGMAR1	15	40
CSCC[C@@H](C)NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853762869	FE	On-Demand	Anodyne	MCHR1	23	42
CSCC[C@@H](C)NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853762871	FE	On-Demand	Anodyne	SIGMAR1	15	40
CSCC[C@@H](C)NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853762871	FE	On-Demand	Anodyne	MCHR1	23	42
CSCC[C@H](C)NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853762873	FE	On-Demand	Anodyne	SIGMAR1	15	40
CSCC[C@H](C)NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853762873	FE	On-Demand	Anodyne	MCHR1	23	42
CSCC[C@H](C)NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853762875	FE	On-Demand	Anodyne	SIGMAR1	15	40
CSCC[C@H](C)NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853762875	FE	On-Demand	Anodyne	MCHR1	23	42
O=[N+]([O-])c1ccc2ncnc(NCC[S@@](=O)CC(F)(F)F)c2c1	ZINC000853762882	EE	On-Demand	Bother	CLK4	44	34
O=[N+]([O-])c1ccc2ncnc(NCC[S@](=O)CC(F)(F)F)c2c1	ZINC000853762884	EE	On-Demand	Bother	CLK4	44	34
Cc1oncc1CSCc1nc(-c2ccccc2)oc1C	ZINC000853762892	DI	On-Demand	Anodyne	PPARG	52	41
Cc1oncc1CSCc1nc(-c2ccccc2)oc1C	ZINC000853762892	DI	On-Demand	Anodyne	PPARA	56	41
Cc1oncc1CSCc1nc(-c2ccccc2)oc1C	ZINC000853762892	DI	On-Demand	Anodyne	PDE8B	59	34
COc1ccccc1-c1nc(CSCCOC(F)F)cs1	ZINC000853762923	EI	On-Demand	Anodyne	DCK	15	40
CS(=O)(=O)c1ccc2ncnc(NCC[S@@](=O)CC(F)(F)F)c2c1	ZINC000853762960	GD	On-Demand	Anodyne	CD38	21	41
CS(=O)(=O)c1ccc2ncnc(NCC[S@](=O)CC(F)(F)F)c2c1	ZINC000853762962	GD	On-Demand	Anodyne	CD38	21	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCCC1CC1	ZINC000853763026	EF	On-Demand	Anodyne	GPR119	20	42
COC[C@H](C)CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853763041	DD	On-Demand	Reactive	CACNA1D	44	33
COC[C@@H](C)CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853763042	DD	On-Demand	Reactive	CACNA1D	44	33
CSCC[C@H](C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853763060	DF	On-Demand	Anodyne	EPHX2	22	46
CSCC[C@@H](C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853763061	DF	On-Demand	Anodyne	EPHX2	22	46
CSCC[C@@H](C)NC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853763080	CE	On-Demand	Anodyne	CPT1A	56	34
CSCC[C@@H](C)NC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853763082	CE	On-Demand	Anodyne	CPT1A	56	34
CSCC[C@H](C)NC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853763083	CE	On-Demand	Anodyne	CPT1A	56	34
CSCC[C@H](C)NC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853763084	CE	On-Demand	Anodyne	CPT1A	56	34
CON(C)CCNC(=O)NCCCCN1CCN(C)CC1	ZINC000853763112	DB	On-Demand	Anodyne	DRD3	55	39
CON(C)CCNC(=O)NCCCCN1CCN(C)CC1	ZINC000853763112	DB	On-Demand	Anodyne	PAOX	17	40
O=[S@](CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)CC(F)(F)F	ZINC000853763116	GG	On-Demand	Anodyne	ROS1	47	36
O=[S@@](CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1)CC(F)(F)F	ZINC000853763120	GG	On-Demand	Anodyne	ROS1	47	36
COc1cccc(C2(NC(=O)N[C@H](C)CCSC)CCC2)c1	ZINC000853763161	DH	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(C2(NC(=O)N[C@H](C)CCSC)CCC2)c1	ZINC000853763161	DH	On-Demand	Anodyne	MTNR1B	27	40
COc1cccc(C2(NC(=O)N[C@@H](C)CCSC)CCC2)c1	ZINC000853763162	DH	On-Demand	Anodyne	MTNR1A	23	40
COc1cccc(C2(NC(=O)N[C@@H](C)CCSC)CCC2)c1	ZINC000853763162	DH	On-Demand	Anodyne	MTNR1B	27	40
CCCC[C@@H](COC)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853763172	EF	On-Demand	Reactive	CACNA1D	57	34
CCCC[C@H](COC)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853763173	EF	On-Demand	Reactive	CACNA1D	57	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc3ccccc3s2)CC1	ZINC000853763178	GG	On-Demand	Anodyne	P2RY12	182	41
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc3ccccc3s2)CC1	ZINC000853763179	GG	On-Demand	Anodyne	P2RY12	182	41
Cc1nc(NCC[S@@](=O)CC(F)(F)F)cc(-c2cccnc2)n1	ZINC000853763202	EF	On-Demand	Anodyne	ROS1	52	37
Cc1nc(NCC[S@](=O)CC(F)(F)F)cc(-c2cccnc2)n1	ZINC000853763203	EF	On-Demand	Anodyne	ROS1	52	37
O=C(NCCCC1CC1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853763210	CF	On-Demand	Reactive	TBXA2R	20	41
CSCC[C@H](C)NC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853763333	ED	On-Demand	Anodyne	CASR	50	39
CSCC[C@@H](C)NC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853763334	ED	On-Demand	Anodyne	CASR	50	39
O=[S@@](CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853763378	DE	On-Demand	Anodyne	CLK4	55	37
O=[S@@](CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853763378	DE	On-Demand	Anodyne	CD38	40	38
O=[S@](CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853763379	DE	On-Demand	Anodyne	CLK4	55	37
O=[S@](CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853763379	DE	On-Demand	Anodyne	CD38	40	38
CCOc1ccc(-c2nc(CSCCOC(F)F)cs2)cc1OC	ZINC000853763458	GJ	On-Demand	Anodyne	DCK	47	54
CCOc1ccc(-c2nc(CSCCOC(F)F)cs2)cc1OC	ZINC000853763458	GJ	On-Demand	Anodyne	PPARD	15	41
CC(C)(C)N1CC[C@H](Nc2nc3c(F)cccc3o2)C1	ZINC000853763520	CG	On-Demand	Anodyne	SSTR5	38	40
CC(C)(C)N1CC[C@@H](Nc2nc3c(F)cccc3o2)C1	ZINC000853763521	CG	On-Demand	Anodyne	SSTR5	38	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@@H]2CCCCO2)CC1	ZINC000853763542	ED	On-Demand	Anodyne	P2RY12	87	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@@H]2CCCCO2)CC1	ZINC000853763543	ED	On-Demand	Anodyne	P2RY12	87	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@H]2CCCCO2)CC1	ZINC000853763544	ED	On-Demand	Anodyne	P2RY12	87	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@H]2CCCCO2)CC1	ZINC000853763545	ED	On-Demand	Anodyne	P2RY12	87	38
CC(C)c1ccc2ncnc(NCC[S@@](=O)CC(F)(F)F)c2c1	ZINC000853763575	EG	On-Demand	Anodyne	CLK4	44	33
CC(C)c1ccc2ncnc(NCC[S@](=O)CC(F)(F)F)c2c1	ZINC000853763576	EG	On-Demand	Anodyne	CLK4	44	33
CSC[C@@H](C)NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1	ZINC000853763665	ED	On-Demand	Anodyne	MAPK1	40	37
CC(=O)c1cccc(NC(=O)CSCc2cnoc2C)c1	ZINC000853763685	DG	On-Demand	Anodyne	KCNK3	46	33
CSCC[C@@H](C)NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000853763686	EG	On-Demand	Anodyne	ACE	44	37
CSCC[C@@H](C)NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000853763686	EG	On-Demand	Anodyne	MME	17	40
CSCC[C@H](C)NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000853763687	EG	On-Demand	Anodyne	ACE	44	37
CSCC[C@H](C)NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000853763687	EG	On-Demand	Anodyne	MME	17	40
CSCC[C@@H](C)NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000853763688	EG	On-Demand	Anodyne	ACE	44	37
CSCC[C@@H](C)NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000853763688	EG	On-Demand	Anodyne	MME	17	40
CSCC[C@H](C)NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000853763689	EG	On-Demand	Anodyne	ACE	44	37
CSCC[C@H](C)NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000853763689	EG	On-Demand	Anodyne	MME	17	40
Cc1oc(-c2ccccc2)nc1CSCCOC(F)F	ZINC000853763736	CI	On-Demand	Anodyne	PPARG	79	44
Cc1oc(-c2ccccc2)nc1CSCCOC(F)F	ZINC000853763736	CI	On-Demand	Anodyne	PPARA	84	47
Cc1oc(-c2ccccc2)nc1CSCCOC(F)F	ZINC000853763736	CI	On-Demand	Anodyne	PDE8B	50	32
CSCC[C@@H](C)NC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853763737	DG	On-Demand	Mild	IMDH_CRYPV	46	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(=O)n(C)c(=O)n2C)CC1	ZINC000853763800	GC	On-Demand	Anodyne	P2RY12	92	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(=O)n(C)c(=O)n2C)CC1	ZINC000853763801	GC	On-Demand	Anodyne	P2RY12	92	34
CSCC[C@H](C)NC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853763848	DG	On-Demand	Mild	IMDH_CRYPV	46	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C)on2)CC1	ZINC000853763867	ED	On-Demand	Anodyne	P2RY12	77	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C)on2)CC1	ZINC000853763869	ED	On-Demand	Anodyne	P2RY12	77	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2ccccc2OC)CC1	ZINC000853764007	GE	On-Demand	Anodyne	P2RY12	187	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2ccccc2OC)CC1	ZINC000853764008	GE	On-Demand	Anodyne	P2RY12	187	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(F)ccc2F)CC1	ZINC000853764032	FF	On-Demand	Anodyne	P2RY12	58	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(F)ccc2F)CC1	ZINC000853764032	FF	On-Demand	Anodyne	DPP4	22	44
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(F)ccc2F)CC1	ZINC000853764033	FF	On-Demand	Anodyne	P2RY12	58	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(F)ccc2F)CC1	ZINC000853764033	FF	On-Demand	Anodyne	DPP4	22	44
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000853764035	CD	On-Demand	Anodyne	MME	62	35
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000853764035	CD	On-Demand	Anodyne	TIMP3	52	36
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000853764035	CD	On-Demand	Anodyne	CAPNS1	46	32
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000853764036	CD	On-Demand	Anodyne	MME	62	35
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000853764036	CD	On-Demand	Anodyne	TIMP3	52	36
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000853764036	CD	On-Demand	Anodyne	CAPNS1	46	32
COC(=O)c1sc(N2CCC(c3ccco3)CC2)nc1Cl	ZINC000853764046	EH	On-Demand	Anodyne	PARE	68	33
CON(C)CCNC(=O)NCCCN1CCC[C@@H](C(N)=O)C1	ZINC000853764054	DB	On-Demand	Anodyne	SLC6A1	99	39
CON(C)CCNC(=O)NCCCN1CCC[C@H](C(N)=O)C1	ZINC000853764055	DB	On-Demand	Anodyne	SLC6A1	99	39
C#CCNC(=O)c1ccc(N2CCC(c3ccco3)CC2)nc1	ZINC000853764060	DE	On-Demand	Mild	HPGDS	30	42
COC[C@H](NC(=O)N[C@H](C)CCSC)c1cccc(OC)c1	ZINC000853764094	EF	On-Demand	Anodyne	MTNR1A	28	45
COC[C@H](NC(=O)N[C@H](C)CCSC)c1cccc(OC)c1	ZINC000853764094	EF	On-Demand	Anodyne	MTNR1B	30	45
COC[C@@H](NC(=O)N[C@H](C)CCSC)c1cccc(OC)c1	ZINC000853764095	EF	On-Demand	Anodyne	MTNR1A	28	45
COC[C@@H](NC(=O)N[C@H](C)CCSC)c1cccc(OC)c1	ZINC000853764095	EF	On-Demand	Anodyne	MTNR1B	30	45
COC[C@@H](NC(=O)N[C@@H](C)CCSC)c1cccc(OC)c1	ZINC000853764096	EF	On-Demand	Anodyne	MTNR1A	28	45
COC[C@@H](NC(=O)N[C@@H](C)CCSC)c1cccc(OC)c1	ZINC000853764096	EF	On-Demand	Anodyne	MTNR1B	30	45
COC[C@H](NC(=O)N[C@@H](C)CCSC)c1cccc(OC)c1	ZINC000853764097	EF	On-Demand	Anodyne	MTNR1A	28	45
COC[C@H](NC(=O)N[C@@H](C)CCSC)c1cccc(OC)c1	ZINC000853764097	EF	On-Demand	Anodyne	MTNR1B	30	45
C[C@H](SCCC1SCCS1)c1nc(-c2cccs2)no1	ZINC000853764199	EJ	On-Demand	Anodyne	ETHR	29	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2cccc(C#N)c2)CC1	ZINC000853764205	GE	On-Demand	Mild	P2RY12	131	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2cccc(C#N)c2)CC1	ZINC000853764206	GE	On-Demand	Mild	P2RY12	131	38
Fc1cccc(OCCSCCC2SCCS2)c1	ZINC000853764222	DI	On-Demand	Anodyne	CHRNA10	28	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2noc(C(C)(C)C)n2)CC1	ZINC000853764246	GE	On-Demand	Anodyne	P2RY12	45	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2noc(C(C)(C)C)n2)CC1	ZINC000853764247	GE	On-Demand	Anodyne	P2RY12	45	36
COC[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853764266	GE	On-Demand	Bother	BCL2L1	61	33
COC[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853764266	GE	On-Demand	Bother	BCL2	42	33
COC[C@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853764267	GE	On-Demand	Bother	BCL2L1	61	33
COC[C@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853764267	GE	On-Demand	Bother	BCL2	42	33
Cn1c(S)nnc1CCNC(=O)N[C@@H](Cc1ccccc1)C1CC1	ZINC000853764276	ED	On-Demand	Anodyne	MME	44	36
Cn1c(S)nnc1CCNC(=O)N[C@H](Cc1ccccc1)C1CC1	ZINC000853764277	ED	On-Demand	Anodyne	MME	44	36
NC(=O)[C@@H]1CCCN(CCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853764281	FD	On-Demand	Anodyne	SLC6A1	140	43
NC(=O)[C@@H]1CCCN(CCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853764282	FD	On-Demand	Anodyne	SLC6A1	140	43
NC(=O)[C@@H]1CCCN(CCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853764283	FD	On-Demand	Anodyne	SLC6A1	140	43
NC(=O)[C@@H]1CCCN(CCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853764284	FD	On-Demand	Anodyne	SLC6A1	140	43
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)N[C@H]2CC=CCC2)O1	ZINC000853764304	FD	On-Demand	Reactive	DRD4	20	42
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)N[C@H]2CC=CCC2)O1	ZINC000853764304	FD	On-Demand	Reactive	SIGMAR1	20	40
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)N[C@@H]2CC=CCC2)O1	ZINC000853764305	FD	On-Demand	Reactive	DRD4	20	42
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)N[C@@H]2CC=CCC2)O1	ZINC000853764305	FD	On-Demand	Reactive	SIGMAR1	20	40
CS(=O)(=O)N1CC[C@@H](CSCCOc2cccc(F)c2)C1	ZINC000853764422	EE	On-Demand	Anodyne	CHRNA10	33	41
CS(=O)(=O)N1CC[C@H](CSCCOc2cccc(F)c2)C1	ZINC000853764423	EE	On-Demand	Anodyne	CHRNA10	33	41
c1coc(C2CCN(c3nccc(N4CCCC4)n3)CC2)c1	ZINC000853764426	CG	On-Demand	Anodyne	SORD	61	39
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853764432	FD	On-Demand	Reactive	CACNA1H	15	40
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853764432	FD	On-Demand	Reactive	SLC6A1	115	40
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853764432	FD	On-Demand	Reactive	CCR3	35	42
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853764433	FD	On-Demand	Reactive	CACNA1H	15	40
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853764433	FD	On-Demand	Reactive	SLC6A1	115	40
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853764433	FD	On-Demand	Reactive	CCR3	35	42
O=C(NCCNc1nccc(N2CCCC2)n1)c1ccc(Br)cn1	ZINC000853764439	GE	On-Demand	Anodyne	MRGPRX1	44	38
Cc1oc(-c2ccccc2)nc1CSCCC1SCCS1	ZINC000853764519	EK	On-Demand	Anodyne	PPARG	61	41
Cc1oc(-c2ccccc2)nc1CSCCC1SCCS1	ZINC000853764519	EK	On-Demand	Anodyne	PPARA	66	41
Cc1oc(-c2ccccc2)nc1CSCCC1SCCS1	ZINC000853764519	EK	On-Demand	Anodyne	PDE8B	60	35
O=C(N[C@@H]1CC=CCC1)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853764527	GG	On-Demand	Anodyne	EPHX2	22	41
O=C(N[C@H]1CC=CCC1)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853764528	GG	On-Demand	Anodyne	EPHX2	22	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)C2CC2)C1	ZINC000853764548	GG	On-Demand	Anodyne	ACE	53	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H](Cc2ccccc2)C2CC2)C1	ZINC000853764550	GG	On-Demand	Anodyne	ACE	53	36
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)C2CC2)C1	ZINC000853764553	GG	On-Demand	Anodyne	ACE	53	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H](Cc2ccccc2)C2CC2)C1	ZINC000853764555	GG	On-Demand	Anodyne	ACE	53	36
C[C@H](O)CCSCCOc1cccc(F)c1	ZINC000853764557	BF	On-Demand	Anodyne	CHRNA10	28	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2cccc(F)c2)CC1	ZINC000853764565	GF	On-Demand	Anodyne	P2RY12	119	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2cccc(F)c2)CC1	ZINC000853764567	GF	On-Demand	Anodyne	P2RY12	119	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764585	GD	On-Demand	Anodyne	PLG	27	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764585	GD	On-Demand	Anodyne	P2RY12	96	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764585	GD	On-Demand	Anodyne	TRY2_BOVIN	101	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764585	GD	On-Demand	Anodyne	ST14	90	47
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764588	GD	On-Demand	Anodyne	PLG	27	47
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764588	GD	On-Demand	Anodyne	P2RY12	96	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764588	GD	On-Demand	Anodyne	TRY2_BOVIN	101	47
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(N)=O)c2)CC1	ZINC000853764588	GD	On-Demand	Anodyne	ST14	90	47
CSCC[C@H](C)NC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853764623	EF	On-Demand	Anodyne	SLC6A3	19	43
CSCC[C@@H](C)NC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853764624	EF	On-Demand	Anodyne	SLC6A3	19	43
CC(=O)c1cccc(NC(=O)CSCCOC(F)F)c1	ZINC000853764629	DF	On-Demand	Anodyne	KCNK3	81	33
CC(=O)c1cccc(NC(=O)CSCCOC(F)F)c1	ZINC000853764629	DF	On-Demand	Anodyne	KCNK9	51	33
CCOc1ccc(-c2nc(CSCCOC(F)F)cs2)cc1	ZINC000853764644	EJ	On-Demand	Anodyne	DCK	16	44
COC(=O)c1cccc(NNC(=O)NCCCCN2CCN(C)CC2)c1C	ZINC000853764659	GD	On-Demand	Reactive	HTR1A	46	41
COC(=O)c1cccc(NNC(=O)NCCCCN2CCN(C)CC2)c1C	ZINC000853764659	GD	On-Demand	Reactive	DRD2	48	43
COC(=O)c1cccc(NNC(=O)NCCCCN2CCN(C)CC2)c1C	ZINC000853764659	GD	On-Demand	Reactive	DRD4	41	32
COC(=O)c1cccc(NNC(=O)NCCCCN2CCN(C)CC2)c1C	ZINC000853764659	GD	On-Demand	Reactive	ADRA1D	44	41
COC(=O)c1cccc(NNC(=O)NCCCCN2CCN(C)CC2)c1C	ZINC000853764659	GD	On-Demand	Reactive	ADRA1A	57	41
COC(=O)c1cccc(NNC(=O)NCCCCN2CCN(C)CC2)c1C	ZINC000853764659	GD	On-Demand	Reactive	DRD3	80	43
CSC[C@@H](C)NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853764670	EG	On-Demand	Reactive	CSNK1D	43	44
CC(=O)c1cccc(NC(=O)CSCCC2SCCS2)c1	ZINC000853764681	EH	On-Demand	Anodyne	KCNK3	50	33
N#Cc1cccc(OCCSCCOC(F)F)c1	ZINC000853764688	CF	On-Demand	Mild	CHRNA10	16	42
COC[C@H](C)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853764696	EF	On-Demand	Reactive	CSNK1D	44	51
COC[C@@H](C)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853764697	EF	On-Demand	Reactive	CSNK1D	44	51
NC(=O)c1cccc(CSCCOC(F)F)c1	ZINC000853764712	CE	On-Demand	Anodyne	CACNA2D1	22	42
Fc1cccc(OCCSCCOC(F)F)c1	ZINC000853764719	CG	On-Demand	Anodyne	CHRNA10	28	40
CCCCSCCOC(F)F	ZINC000853764734	AF	On-Demand	Anodyne	EST1_PIG	43	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2csc(C(C)(C)C)n2)CC1	ZINC000853764744	GG	On-Demand	Anodyne	P2RY12	75	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2csc(C(C)(C)C)n2)CC1	ZINC000853764745	GG	On-Demand	Anodyne	P2RY12	75	38
Fc1cccc(OCCSCc2cc(C3CC3)no2)c1	ZINC000853764778	CI	On-Demand	Anodyne	CHRNA10	29	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2csc(CC)n2)CC1	ZINC000853764782	FF	On-Demand	Anodyne	P2RY12	58	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2csc(CC)n2)CC1	ZINC000853764783	FF	On-Demand	Anodyne	P2RY12	58	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2noc(C)n2)CC1	ZINC000853764803	ED	On-Demand	Anodyne	P2RY12	42	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2noc(C)n2)CC1	ZINC000853764804	ED	On-Demand	Anodyne	P2RY12	42	34
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N[C@H](Cc1ccccc1)C1CC1	ZINC000853764813	EG	On-Demand	Anodyne	MME	54	37
O=C(N[C@@H](Cc1ccccc1)C1CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853764815	EG	On-Demand	Anodyne	MME	54	37
O=C(N[C@@H](Cc1ccccc1)C1CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853764816	EG	On-Demand	Anodyne	MME	54	37
O=[N+]([O-])c1cccc(OCCSCCOC(F)F)c1	ZINC000853764852	CF	On-Demand	Bother	ACR	18	43
Cn1c(S)nnc1CCNC(=O)NCCCN1CCC[C@@H](C(N)=O)C1	ZINC000853764858	FB	On-Demand	Anodyne	SLC6A1	62	33
Cn1c(S)nnc1CCNC(=O)NCCCN1CCC[C@H](C(N)=O)C1	ZINC000853764859	FB	On-Demand	Anodyne	SLC6A1	62	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(CC(C)C)no2)CC1	ZINC000853764861	GE	On-Demand	Anodyne	P2RY12	40	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(CC(C)C)no2)CC1	ZINC000853764862	GE	On-Demand	Anodyne	P2RY12	40	34
C#CCCN(CCOC)C(=O)NCCCN1CCC[C@H](C(N)=O)C1	ZINC000853764879	EC	On-Demand	Mild	SLC6A1	56	37
C#CCCN(CCOC)C(=O)NCCCN1CCC[C@@H](C(N)=O)C1	ZINC000853764880	EC	On-Demand	Mild	SLC6A1	56	37
COC(=O)c1cnc(N2CCC(c3ccco3)CC2)cc1C(F)(F)F	ZINC000853764899	FH	On-Demand	Anodyne	RBP4	45	39
CCN1CC[C@H](SCCOc2cccc(F)c2)C1=O	ZINC000853764924	CF	On-Demand	Anodyne	CHRNA10	48	44
CCOC(=O)N1CCN(C(=O)[C@H](C)SCC)CC1	ZINC000853764939	CD	On-Demand	Anodyne	CHRNA3	18	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCC)CC1	ZINC000853764940	CD	On-Demand	Anodyne	CHRNA3	18	43
COC(=O)c1cccc(NNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)c1C	ZINC000853764948	GC	On-Demand	Reactive	SLC6A1	146	40
COC(=O)c1cccc(NNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)c1C	ZINC000853764948	GC	On-Demand	Reactive	NPY1R	15	41
COC(=O)c1cccc(NNC(=O)NCCCN2CCC[C@H](C(N)=O)C2)c1C	ZINC000853764948	GC	On-Demand	Reactive	CCR3	29	42
COC(=O)c1cccc(NNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c1C	ZINC000853764949	GC	On-Demand	Reactive	SLC6A1	146	40
COC(=O)c1cccc(NNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c1C	ZINC000853764949	GC	On-Demand	Reactive	NPY1R	15	41
COC(=O)c1cccc(NNC(=O)NCCCN2CCC[C@@H](C(N)=O)C2)c1C	ZINC000853764949	GC	On-Demand	Reactive	CCR3	29	42
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853764959	GC	On-Demand	Reactive	SLC6A1	84	34
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853764959	GC	On-Demand	Reactive	CCR3	23	42
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853764960	GC	On-Demand	Reactive	SLC6A1	84	34
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853764960	GC	On-Demand	Reactive	CCR3	23	42
NC(=O)[C@@H]1CCCN(CCCNC(=O)NNc2cccc3c2OC(F)(F)O3)C1	ZINC000853764965	GD	On-Demand	Reactive	SLC6A1	99	37
NC(=O)[C@H]1CCCN(CCCNC(=O)NNc2cccc3c2OC(F)(F)O3)C1	ZINC000853764966	GD	On-Demand	Reactive	SLC6A1	99	37
O=[N+]([O-])c1cccc(OCCSCCC2SCCS2)c1	ZINC000853764987	EH	On-Demand	Bother	ACR	16	40
COC[C@H](CSCCOc1cccc(F)c1)OC	ZINC000853765018	CF	On-Demand	Anodyne	PDS	28	41
COC[C@@H](CSCCOc1cccc(F)c1)OC	ZINC000853765019	CF	On-Demand	Anodyne	PDS	28	41
N#Cc1cccc(OCCSCCC2SCCS2)c1	ZINC000853765035	DH	On-Demand	Mild	CHRNA10	17	43
O=C(c1cccc(CSCCC2SCCS2)c1)N1CCCCC1	ZINC000853765076	FJ	On-Demand	Anodyne	L3MBTL3	41	41
Fc1cccc(OCCSCCO[C@@H]2CC2(F)F)c1	ZINC000853765091	CG	On-Demand	Anodyne	CHRNA10	29	41
Fc1cccc(OCCSCCO[C@H]2CC2(F)F)c1	ZINC000853765092	CG	On-Demand	Anodyne	CHRNA10	29	41
CON(C)CCNC(=O)N[C@H]1CCC[C@@H]1Cc1ccccc1	ZINC000853765287	DE	On-Demand	Anodyne	CCR3	22	42
CON(C)CCNC(=O)N[C@H]1CCC[C@H]1Cc1ccccc1	ZINC000853765288	DE	On-Demand	Anodyne	CCR3	22	42
CON(C)CCNC(=O)N[C@@H]1CCC[C@@H]1Cc1ccccc1	ZINC000853765289	DE	On-Demand	Anodyne	CCR3	22	42
CON(C)CCNC(=O)N[C@@H]1CCC[C@H]1Cc1ccccc1	ZINC000853765290	DE	On-Demand	Anodyne	CCR3	22	42
CC[C@@H](O)CNC(=O)NCCc1ccc(NC(=O)OC)cc1	ZINC000853765302	DD	On-Demand	Anodyne	ADRB2	23	44
CC[C@@H](O)CNC(=O)NCCc1ccc(NC(=O)OC)cc1	ZINC000853765302	DD	On-Demand	Anodyne	ADRB1	48	44
CC[C@@H](O)CNC(=O)NCCc1ccc(NC(=O)OC)cc1	ZINC000853765302	DD	On-Demand	Anodyne	ADRB3	42	44
CC(=O)NCCCSCC1=NS(=O)(=O)c2ccccc21	ZINC000853765421	DD	On-Demand	Anodyne	KCNA3	17	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc3c(c2)OCCO3)CC1	ZINC000853765436	GE	On-Demand	Anodyne	P2RY12	58	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc3c(c2)OCCO3)CC1	ZINC000853765437	GE	On-Demand	Anodyne	P2RY12	58	36
N#Cc1ccccc1OCCSCCOC(F)F	ZINC000853765487	CF	On-Demand	Mild	ADRB1	43	33
Cc1nc(NC[C@@H]2CCCO2)c2cnn(-c3ccccc3)c2n1	ZINC000853765542	DF	On-Demand	Anodyne	TNK2	67	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(CCOC)no2)CC1	ZINC000853765566	GD	On-Demand	Anodyne	P2RY12	66	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(CCOC)no2)CC1	ZINC000853765567	GD	On-Demand	Anodyne	P2RY12	66	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(NC(C)=O)c2)CC1	ZINC000853765571	GF	On-Demand	Anodyne	P2RY12	118	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(NC(C)=O)c2)CC1	ZINC000853765571	GF	On-Demand	Anodyne	TRY2_BOVIN	44	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(NC(C)=O)c2)CC1	ZINC000853765571	GF	On-Demand	Anodyne	ST14	44	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(NC(C)=O)c2)CC1	ZINC000853765572	GF	On-Demand	Anodyne	P2RY12	118	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(NC(C)=O)c2)CC1	ZINC000853765572	GF	On-Demand	Anodyne	TRY2_BOVIN	44	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(NC(C)=O)c2)CC1	ZINC000853765572	GF	On-Demand	Anodyne	ST14	44	45
Cc1oncc1CSCc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000853765676	EI	On-Demand	Anodyne	TGFBR1	15	46
Cc1oncc1CSCc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000853765676	EI	On-Demand	Anodyne	CLK4	53	39
CCN1CC[C@H](N(CC)C(=O)NCCc2ccc(NC(=O)OC)cc2)C1	ZINC000853765715	FF	On-Demand	Anodyne	CCR5	22	44
CCN1CC[C@@H](N(CC)C(=O)NCCc2ccc(NC(=O)OC)cc2)C1	ZINC000853765717	FF	On-Demand	Anodyne	CCR5	22	44
Nc1nc(Cl)cc(N2CCC(c3ccco3)CC2)n1	ZINC000853765801	CF	On-Demand	Anodyne	HRH4	46	37
FC(F)OCCSCc1csc(-c2ccc3c(c2)OCO3)n1	ZINC000853765845	EI	On-Demand	Anodyne	CLK4	42	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(F)cc2C#N)CC1	ZINC000853765862	GF	On-Demand	Mild	P2RY12	51	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(F)cc2C#N)CC1	ZINC000853765864	GF	On-Demand	Mild	P2RY12	51	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc3c2OCCO3)CC1	ZINC000853765903	GE	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc3c2OCCO3)CC1	ZINC000853765905	GE	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(-c3ccco3)on2)CC1	ZINC000853765984	GF	On-Demand	Anodyne	P2RY12	74	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(-c3ccco3)on2)CC1	ZINC000853765985	GF	On-Demand	Anodyne	P2RY12	74	36
Cc1oncc1CSCc1cccc(C(=O)NCC(C)C)c1	ZINC000853766018	DH	On-Demand	Anodyne	F3	63	34
O=[N+]([O-])c1ccc(N2CCC(c3ccco3)CC2)cc1	ZINC000853766083	CH	On-Demand	Bother	SSTR1	39	41
O=[N+]([O-])c1ccc(N2CCC(c3ccco3)CC2)c2nonc12	ZINC000853766374	DG	On-Demand	Bother	GSTM2	108	41
O=[N+]([O-])c1ccc(N2CCC(c3ccco3)CC2)c2nonc12	ZINC000853766374	DG	On-Demand	Bother	GSTP1	65	41
N#Cc1ccccc1OCCSCCC1SCCS1	ZINC000853766402	DH	On-Demand	Mild	ADRB1	41	31
CS(=O)(=O)c1ccc(OCCCSCC=C(Cl)Cl)cc1	ZINC000853766447	FH	On-Demand	Anodyne	LOX1.1	46	33
CS(=O)(=O)c1ccc(OCCCSCC=C(Cl)Cl)cc1	ZINC000853766447	FH	On-Demand	Anodyne	O49150_SOLTU	50	34
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CCN(CC2CC2)C1	ZINC000853766501	FG	On-Demand	Reactive	CCR3	15	41
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@H]1CCN(CC2CC2)C1	ZINC000853766502	FG	On-Demand	Reactive	CCR3	15	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@H]2OCCc3ccccc32)CC1	ZINC000853766583	GF	On-Demand	Anodyne	P2RY12	115	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@H]2OCCc3ccccc32)CC1	ZINC000853766584	GF	On-Demand	Anodyne	P2RY12	115	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@@H]2OCCc3ccccc32)CC1	ZINC000853766585	GF	On-Demand	Anodyne	P2RY12	115	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@@H]2OCCc3ccccc32)CC1	ZINC000853766586	GF	On-Demand	Anodyne	P2RY12	115	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccn(C(C)C)n2)CC1	ZINC000853766701	FE	On-Demand	Anodyne	P2RY12	79	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccn(C(C)C)n2)CC1	ZINC000853766702	FE	On-Demand	Anodyne	P2RY12	79	36
CNC(=O)Cc1nc(CSCc2cc(Cl)ccc2OCC#N)cs1	ZINC000853766710	GG	On-Demand	Mild	PTGER1	34	44
CON(C)CCNC(=O)NCCCCCN1CCCCC1	ZINC000853766789	DD	On-Demand	Anodyne	DRD3	41	38
CON(C)CCNC(=O)NCCCCCN1CCCCC1	ZINC000853766789	DD	On-Demand	Anodyne	HRH3	21	43
CON(C)CCNC(=O)NCCCCCN1CCCCC1	ZINC000853766789	DD	On-Demand	Anodyne	HNMT	42	33
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766974	GD	On-Demand	Anodyne	PLG	20	45
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766974	GD	On-Demand	Anodyne	P2RY12	167	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766974	GD	On-Demand	Anodyne	TRY2_BOVIN	98	45
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766974	GD	On-Demand	Anodyne	ST14	72	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766975	GD	On-Demand	Anodyne	PLG	20	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766975	GD	On-Demand	Anodyne	P2RY12	167	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766975	GD	On-Demand	Anodyne	TRY2_BOVIN	98	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(=O)NC)c2)CC1	ZINC000853766975	GD	On-Demand	Anodyne	ST14	72	45
Cc1oncc1CSCCOc1cccc(S(C)(=O)=O)c1	ZINC000853767049	EF	On-Demand	Anodyne	NR1H3	53	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccn(C)c(=O)c2)CC1	ZINC000853767131	FD	On-Demand	Anodyne	P2RY12	92	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccn(C)c(=O)c2)CC1	ZINC000853767132	FD	On-Demand	Anodyne	P2RY12	92	38
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2ccc(C#N)cc2)CC1	ZINC000853767139	GG	On-Demand	Mild	P2RY12	61	37
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2ccc(C#N)cc2)CC1	ZINC000853767140	GG	On-Demand	Mild	P2RY12	61	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2ccc(C#N)cc2)CC1	ZINC000853767141	GG	On-Demand	Mild	P2RY12	61	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2ccc(C#N)cc2)CC1	ZINC000853767142	GG	On-Demand	Mild	P2RY12	61	37
Cc1nn(C)c(Cl)c1CSCc1ccc(F)cc1[N+](=O)[O-]	ZINC000853767158	EH	On-Demand	Bother	P2RX7	17	41
Cc1oncc1CSCCOc1ccc2c(C)cc(=O)oc2c1	ZINC000853767196	EH	On-Demand	Anodyne	MAOA	73	48
Cc1oncc1CSCCOc1ccc2c(C)cc(=O)oc2c1	ZINC000853767196	EH	On-Demand	Anodyne	MAOB	53	52
COC[C@@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853767213	EF	On-Demand	Anodyne	ALDH2	49	31
COC[C@@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853767213	EF	On-Demand	Anodyne	MAOA	65	47
COC[C@@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853767213	EF	On-Demand	Anodyne	MAOB	56	56
COC[C@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853767214	EF	On-Demand	Anodyne	ALDH2	49	31
COC[C@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853767214	EF	On-Demand	Anodyne	MAOA	65	47
COC[C@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)OC	ZINC000853767214	EF	On-Demand	Anodyne	MAOB	56	56
CS(=O)(=O)c1cccc(OCCSCCOC(F)F)c1	ZINC000853767238	EE	On-Demand	Anodyne	NR1H3	57	36
O=C(Nc1ccc2c(c1)CN(c1ncccc1C(F)(F)F)C2)C(F)(F)F	ZINC000853767239	GI	On-Demand	Anodyne	TRPV1	52	53
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCC2CCC2)CC1	ZINC000853767257	DE	On-Demand	Anodyne	P2RY12	54	33
CCOC(=O)N1CCN(C(=O)[C@H](C)SCC2CCC2)CC1	ZINC000853767258	DE	On-Demand	Anodyne	P2RY12	54	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2noc(C(C)C)n2)CC1	ZINC000853767319	FE	On-Demand	Anodyne	P2RY12	46	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2noc(C(C)C)n2)CC1	ZINC000853767320	FE	On-Demand	Anodyne	P2RY12	46	35
O=C(NCCO)c1ccc(N2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)nn1	ZINC000853767355	GD	On-Demand	Anodyne	SCD1	47	41
O=C(NCCO)c1ccc(N2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)nn1	ZINC000853767355	GD	On-Demand	Anodyne	SCD	38	41
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCN(CC2CC2)C1	ZINC000853767440	EF	On-Demand	Reactive	CCR3	36	41
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCN(CC2CC2)C1	ZINC000853767440	EF	On-Demand	Reactive	CACNA1I	44	35
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCN(CC2CC2)C1	ZINC000853767442	EF	On-Demand	Reactive	CCR3	36	41
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCN(CC2CC2)C1	ZINC000853767442	EF	On-Demand	Reactive	CACNA1I	44	35
O=C(Nc1ccc2c(c1)CN(c1cc(N3CCOCC3)ncn1)C2)C(F)(F)F	ZINC000853767478	GE	On-Demand	Anodyne	MTOR	56	38
N#C[C@@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767483	DE	On-Demand	Mild	AKT2	56	47
N#C[C@@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767483	DE	On-Demand	Mild	AKT3	32	43
N#C[C@@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767483	DE	On-Demand	Mild	ROCK2	15	43
N#C[C@@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767483	DE	On-Demand	Mild	AKT1	25	45
N#C[C@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767484	DE	On-Demand	Mild	AKT2	56	47
N#C[C@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767484	DE	On-Demand	Mild	AKT3	32	43
N#C[C@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767484	DE	On-Demand	Mild	ROCK2	15	43
N#C[C@]1(c2ccccn2)CCCN(c2ncnc3[nH]ccc23)C1	ZINC000853767484	DE	On-Demand	Mild	AKT1	25	45
O=C(NCCCCCN1CCCCC1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853767580	FG	On-Demand	Reactive	HRH2	24	42
O=C(NCCCCCN1CCCCC1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853767580	FG	On-Demand	Reactive	TBXA2R	17	42
O=C(NCCCCCN1CCCCC1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853767580	FG	On-Demand	Reactive	CCR3	16	44
O=C(NCCCCCN1CCCCC1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853767580	FG	On-Demand	Reactive	CHRNA7	15	45
O=C(NCCCCCN1CCCCC1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853767580	FG	On-Demand	Reactive	HNMT	41	34
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	DRD2	34	43
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	HRH2	24	40
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	ADRA1A	16	40
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	DRD3	61	43
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	HRH3	24	42
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	CCR3	22	41
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	CHRNA7	19	52
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853767755	EG	On-Demand	Anodyne	HNMT	61	39
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	DRD2	34	43
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	HRH2	24	40
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	ADRA1A	16	40
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	DRD3	61	43
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	HRH3	24	42
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	CCR3	22	41
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	CHRNA7	19	52
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853767756	EG	On-Demand	Anodyne	HNMT	61	39
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	DRD2	34	43
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	HRH2	24	40
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	ADRA1A	16	40
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	DRD3	61	43
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	HRH3	24	42
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	CCR3	22	41
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	CHRNA7	19	52
O=C(NCCCCCN1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853767757	EG	On-Demand	Anodyne	HNMT	61	39
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	DRD2	34	43
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	HRH2	24	40
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	ADRA1A	16	40
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	DRD3	61	43
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	HRH3	24	42
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	CCR3	22	41
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	CHRNA7	19	52
O=C(NCCCCCN1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853767758	EG	On-Demand	Anodyne	HNMT	61	39
O=C(NC1CC1)c1ccc(N2Cc3ccc(NC(=O)C(F)(F)F)cc3C2)nc1	ZINC000853767981	GF	On-Demand	Anodyne	HPGDS	37	48
CO[C@@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)[C@@H]1CCOC1	ZINC000853768018	FG	On-Demand	Anodyne	MAOA	60	43
CO[C@@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)[C@@H]1CCOC1	ZINC000853768018	FG	On-Demand	Anodyne	MAOB	40	46
CO[C@@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)[C@H]1CCOC1	ZINC000853768020	FG	On-Demand	Anodyne	MAOA	60	43
CO[C@@H](CSCCOc1ccc2c(C)cc(=O)oc2c1)[C@H]1CCOC1	ZINC000853768020	FG	On-Demand	Anodyne	MAOB	40	46
Cc1nocc1CSCCOc1ccc2c(C)cc(=O)oc2c1	ZINC000853768066	EH	On-Demand	Anodyne	MAOA	74	48
Cc1nocc1CSCCOc1ccc2c(C)cc(=O)oc2c1	ZINC000853768066	EH	On-Demand	Anodyne	MAOB	52	52
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(C(=O)NC)cc2)CC1	ZINC000853768090	GD	On-Demand	Anodyne	P2RY12	120	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(C(=O)NC)cc2)CC1	ZINC000853768092	GD	On-Demand	Anodyne	P2RY12	120	38
Cc1nnc(N2CC[C@@H](C(=O)OC(C)(C)C)[C@H](NC(=O)C(F)(F)F)C2)s1	ZINC000853768122	GE	On-Demand	Anodyne	PARE	85	36
Cc1nnc(N2CC[C@H](C(=O)OC(C)(C)C)[C@@H](NC(=O)C(F)(F)F)C2)s1	ZINC000853768123	GE	On-Demand	Anodyne	PARE	85	36
Cc1nnc(N2CC[C@H](C(=O)OC(C)(C)C)[C@H](NC(=O)C(F)(F)F)C2)s1	ZINC000853768124	GE	On-Demand	Anodyne	PARE	85	36
Cc1nnc(N2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](NC(=O)C(F)(F)F)C2)s1	ZINC000853768125	GE	On-Demand	Anodyne	PARE	85	36
N#C[C@@]1(c2ccccn2)CCCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000853768142	GI	On-Demand	Mild	METAP1	15	42
N#C[C@]1(c2ccccn2)CCCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000853768145	GI	On-Demand	Mild	METAP1	15	42
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(CC2CC2)C1	ZINC000853768225	DD	On-Demand	Anodyne	DRD4	22	42
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(CC2CC2)C1	ZINC000853768225	DD	On-Demand	Anodyne	SIGMAR1	21	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccon2)CC1	ZINC000853768226	ED	On-Demand	Anodyne	P2RY12	60	36
O=C(N[C@@H]1CCN(CC2CC2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853768227	DD	On-Demand	Anodyne	DRD4	22	42
O=C(N[C@@H]1CCN(CC2CC2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853768227	DD	On-Demand	Anodyne	SIGMAR1	21	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccon2)CC1	ZINC000853768228	ED	On-Demand	Anodyne	P2RY12	60	36
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(CC2CC2)C1	ZINC000853768229	DD	On-Demand	Anodyne	DRD4	22	42
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(CC2CC2)C1	ZINC000853768229	DD	On-Demand	Anodyne	SIGMAR1	21	40
O=C(N[C@@H]1CCN(CC2CC2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853768231	DD	On-Demand	Anodyne	DRD4	22	42
O=C(N[C@@H]1CCN(CC2CC2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853768231	DD	On-Demand	Anodyne	SIGMAR1	21	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCCCCOC)CC1	ZINC000853768314	EE	On-Demand	Anodyne	P2RY12	99	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCCCCOC)CC1	ZINC000853768315	EE	On-Demand	Anodyne	P2RY12	99	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cnc(C)s2)CC1	ZINC000853768323	FE	On-Demand	Anodyne	P2RY12	43	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cnc(C)s2)CC1	ZINC000853768324	FE	On-Demand	Anodyne	P2RY12	43	34
Cc1cc(N2CC[C@@]3(C)[C@@H](C2)C3(Br)Br)nc(N)n1	ZINC000853768385	GF	On-Demand	Anodyne	HRH4	44	38
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853768387	GE	On-Demand	Anodyne	HRH2	31	43
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853768387	GE	On-Demand	Anodyne	MTNR1A	66	46
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853768387	GE	On-Demand	Anodyne	MTNR1B	58	46
COc1c(C)ncnc1N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853768420	FF	On-Demand	Anodyne	PDGFRB	51	39
O=C(Nc1ccc2c(c1)CN(c1nccc(N3CCOCC3)n1)C2)C(F)(F)F	ZINC000853768436	GE	On-Demand	Anodyne	PIK3CA	28	40
O=C(Nc1ccc2c(c1)CN(c1nccc(N3CCOCC3)n1)C2)C(F)(F)F	ZINC000853768436	GE	On-Demand	Anodyne	MTOR	43	40
O=C(Nc1ccc2c(c1)CN(c1nccc(N3CCOCC3)n1)C2)C(F)(F)F	ZINC000853768436	GE	On-Demand	Anodyne	PIK3CG	22	40
O=C(Nc1ccc2c(c1)CN(c1nccc(N3CCOCC3)n1)C2)C(F)(F)F	ZINC000853768436	GE	On-Demand	Anodyne	DGAT1	17	40
Cn1ncc(C#N)c1N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853768541	EE	On-Demand	Mild	CSNK2A1	43	34
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853768545	FD	On-Demand	Anodyne	DRD4	41	32
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853768545	FD	On-Demand	Anodyne	HRH2	31	44
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853768545	FD	On-Demand	Anodyne	MTNR1A	83	50
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853768545	FD	On-Demand	Anodyne	MTNR1B	74	50
COc1cccc(OCCCNC(=O)NCCN(C)OC)c1	ZINC000853768571	DD	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCCNC(=O)NCCN(C)OC)c1	ZINC000853768571	DD	On-Demand	Anodyne	HRH2	31	48
COc1cccc(OCCCNC(=O)NCCN(C)OC)c1	ZINC000853768571	DD	On-Demand	Anodyne	MTNR1A	101	60
COc1cccc(OCCCNC(=O)NCCN(C)OC)c1	ZINC000853768571	DD	On-Demand	Anodyne	MTNR1B	89	60
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2csc(COC)n2)CC1	ZINC000853768588	GE	On-Demand	Anodyne	P2RY12	48	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2csc(COC)n2)CC1	ZINC000853768589	GE	On-Demand	Anodyne	P2RY12	48	34
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853768629	GE	On-Demand	Anodyne	HRH2	27	42
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853768629	GE	On-Demand	Anodyne	MTNR1A	66	47
COc1cccc(OCCCNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853768629	GE	On-Demand	Anodyne	MTNR1B	59	47
O=C1[C@@H]2CN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853768706	GE	On-Demand	Bother	F2RL3	45	33
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)COC)CC1	ZINC000853768732	DD	On-Demand	Anodyne	CHRNA3	17	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)COC)CC1	ZINC000853768733	DD	On-Demand	Anodyne	CHRNA3	17	41
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)COC)CC1	ZINC000853768734	DD	On-Demand	Anodyne	CHRNA3	17	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)COC)CC1	ZINC000853768735	DD	On-Demand	Anodyne	CHRNA3	17	41
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccc(F)cc1F	ZINC000853768779	FG	On-Demand	Anodyne	CACNA1H	27	40
COc1c(C)ncnc1N1CC[C@@]2(C)[C@@H](C1)C2(Br)Br	ZINC000853768782	GG	On-Demand	Anodyne	PDE3A	40	35
COc1c(C)ncnc1N1CC[C@@]2(C)[C@@H](C1)C2(Br)Br	ZINC000853768782	GG	On-Demand	Anodyne	PDE3B	44	35
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768837	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768837	FF	On-Demand	Anodyne	HRH2	36	46
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768837	FF	On-Demand	Anodyne	MTNR1A	62	52
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768837	FF	On-Demand	Anodyne	MTNR1B	58	52
COc1cccc(OCCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768838	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768838	FF	On-Demand	Anodyne	HRH2	36	46
COc1cccc(OCCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768838	FF	On-Demand	Anodyne	MTNR1A	62	52
COc1cccc(OCCCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853768838	FF	On-Demand	Anodyne	MTNR1B	58	52
COc1cccc(OCCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768839	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768839	FF	On-Demand	Anodyne	HRH2	36	46
COc1cccc(OCCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768839	FF	On-Demand	Anodyne	MTNR1A	62	52
COc1cccc(OCCCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768839	FF	On-Demand	Anodyne	MTNR1B	58	52
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768840	FF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768840	FF	On-Demand	Anodyne	HRH2	36	46
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768840	FF	On-Demand	Anodyne	MTNR1A	62	52
COc1cccc(OCCCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853768840	FF	On-Demand	Anodyne	MTNR1B	58	52
O=C(Nc1ccc2c(c1)CN(c1ccnc(N3CCOCC3)n1)C2)C(F)(F)F	ZINC000853768860	GE	On-Demand	Anodyne	PIK3CA	33	42
O=C(Nc1ccc2c(c1)CN(c1ccnc(N3CCOCC3)n1)C2)C(F)(F)F	ZINC000853768860	GE	On-Demand	Anodyne	MTOR	46	42
O=C(Nc1ccc2c(c1)CN(c1ccnc(N3CCOCC3)n1)C2)C(F)(F)F	ZINC000853768860	GE	On-Demand	Anodyne	PIK3CG	26	42
O=C(Nc1ccc2c(c1)CN(c1ncc(C(F)(F)F)s1)C2)C(F)(F)F	ZINC000853768903	GI	On-Demand	Anodyne	MLYCD	65	38
COc1cc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c([N+](=O)[O-])cc1OC	ZINC000853768927	GF	On-Demand	Clean	DRD4	15	40
Fc1ncnc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1Br	ZINC000853769071	GE	On-Demand	Anodyne	ADK	15	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C)n(C)n2)CC1	ZINC000853769101	FD	On-Demand	Anodyne	P2RY12	62	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C)n(C)n2)CC1	ZINC000853769102	FD	On-Demand	Anodyne	P2RY12	62	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCCNS(=O)(=O)CC)CC1	ZINC000853769127	GC	On-Demand	Anodyne	P2RY12	43	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCCNS(=O)(=O)CC)CC1	ZINC000853769128	GC	On-Demand	Anodyne	P2RY12	43	36
FC(F)OCCSCCc1ccccc1	ZINC000853769169	BG	On-Demand	Anodyne	CES1	15	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H]2CCCNC2=O)CC1	ZINC000853769177	EC	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H]2CCCNC2=O)CC1	ZINC000853769178	EC	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H]2CCCNC2=O)CC1	ZINC000853769179	EC	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H]2CCCNC2=O)CC1	ZINC000853769180	EC	On-Demand	Anodyne	P2RY12	47	36
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853769186	FE	On-Demand	Bother	GSTM2	110	40
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853769186	FE	On-Demand	Bother	GSTP1	68	38
COCc1cc([N+](=O)[O-])ccc1N1C[C@@H](C(F)(F)F)C[C@@H](C(=O)OC)C1	ZINC000853769211	GF	On-Demand	Bother	CACNA1D	49	34
c1ccc(CCSCCC2SCCS2)cc1	ZINC000853769218	CI	On-Demand	Anodyne	SLC18A2	44	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(COC)c2)CC1	ZINC000853769221	GF	On-Demand	Anodyne	P2RY12	101	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(COC)c2)CC1	ZINC000853769221	GF	On-Demand	Anodyne	TRY2_BOVIN	42	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(COC)c2)CC1	ZINC000853769222	GF	On-Demand	Anodyne	P2RY12	101	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(COC)c2)CC1	ZINC000853769222	GF	On-Demand	Anodyne	TRY2_BOVIN	42	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nccc(C)n2)CC1	ZINC000853769251	FD	On-Demand	Anodyne	P2RY12	103	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nccc(C)n2)CC1	ZINC000853769252	FD	On-Demand	Anodyne	P2RY12	103	37
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(c2ccc(C(C)=O)cc2[N+](=O)[O-])C1	ZINC000853769258	FF	On-Demand	Bother	TAAR1	25	43
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2cccc(OC)c2)CC1	ZINC000853769260	GE	On-Demand	Anodyne	P2RY12	133	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2cccc(OC)c2)CC1	ZINC000853769260	GE	On-Demand	Anodyne	MTNR1A	22	43
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2cccc(OC)c2)CC1	ZINC000853769260	GE	On-Demand	Anodyne	MTNR1B	30	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2cccc(OC)c2)CC1	ZINC000853769261	GE	On-Demand	Anodyne	P2RY12	133	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2cccc(OC)c2)CC1	ZINC000853769261	GE	On-Demand	Anodyne	MTNR1A	22	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2cccc(OC)c2)CC1	ZINC000853769261	GE	On-Demand	Anodyne	MTNR1B	30	43
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2ccccc2)CC1	ZINC000853769268	FF	On-Demand	Anodyne	CHRM1	17	46
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2ccccc2)CC1	ZINC000853769268	FF	On-Demand	Anodyne	ACE	40	41
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2ccccc2)CC1	ZINC000853769268	FF	On-Demand	Anodyne	GHRHR	61	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2ccccc2)CC1	ZINC000853769268	FF	On-Demand	Anodyne	P2RY12	190	41
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2ccccc2)CC1	ZINC000853769268	FF	On-Demand	Anodyne	CCR8	16	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2ccccc2)CC1	ZINC000853769269	FF	On-Demand	Anodyne	CHRM1	17	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2ccccc2)CC1	ZINC000853769269	FF	On-Demand	Anodyne	ACE	40	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2ccccc2)CC1	ZINC000853769269	FF	On-Demand	Anodyne	GHRHR	61	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2ccccc2)CC1	ZINC000853769269	FF	On-Demand	Anodyne	P2RY12	190	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2ccccc2)CC1	ZINC000853769269	FF	On-Demand	Anodyne	CCR8	16	40
CS(=O)(=O)c1ccccc1C(=O)OCC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000853769273	HE	On-Demand	Anodyne	DGAT1	40	39
COc1cccc(OCCSCCOC(F)F)c1	ZINC000853769309	CG	On-Demand	Anodyne	MTNR1B	15	44
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000853769310	FG	On-Demand	Bother	WDR5	34	40
N#Cc1cccc(OCCCSCCC2SCCS2)c1	ZINC000853769350	EI	On-Demand	Mild	CHRNA10	16	43
CC(C)n1ccc(CNC(=O)NNc2nc3ccc(Cl)cc3s2)n1	ZINC000853769366	FH	On-Demand	Reactive	CSNK1D	37	45
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccn(C(CC)CC)n2)CC1	ZINC000853769368	GG	On-Demand	Anodyne	P2RY12	53	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccn(C(CC)CC)n2)CC1	ZINC000853769369	GG	On-Demand	Anodyne	P2RY12	53	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2csc(C3CC3)n2)CC1	ZINC000853769377	GF	On-Demand	Anodyne	P2RY12	59	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2csc(C3CC3)n2)CC1	ZINC000853769378	GF	On-Demand	Anodyne	P2RY12	59	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(OC)c(C#N)c2)CC1	ZINC000853769383	GE	On-Demand	Mild	P2RY12	50	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(OC)c(C#N)c2)CC1	ZINC000853769384	GE	On-Demand	Mild	P2RY12	50	38
Cc1cc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)nc(N)n1	ZINC000853769397	ED	On-Demand	Anodyne	HRH4	30	45
O=[N+]([O-])c1ccc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c2nonc12	ZINC000853769402	GE	On-Demand	Bother	GSTM2	94	42
O=[N+]([O-])c1ccc(N2C[C@@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c2nonc12	ZINC000853769402	GE	On-Demand	Bother	GSTP1	58	42
c1ccc(CN2CCO[C@@H]3CN(c4ncnc5c4CCC5)C[C@@H]32)cc1	ZINC000853769414	EE	On-Demand	Anodyne	ADK	15	43
COc1ccc(-c2noc([C@@H](C)SCCOC(F)F)n2)cc1	ZINC000853769479	EH	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc(-c2noc([C@H](C)SCCOC(F)F)n2)cc1	ZINC000853769480	EH	On-Demand	Anodyne	LUCI_PHOPE	21	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc3nsnc23)CC1	ZINC000853769482	GF	On-Demand	Anodyne	P2RY12	56	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc3nsnc23)CC1	ZINC000853769483	GF	On-Demand	Anodyne	P2RY12	56	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nccs2)CC1	ZINC000853769493	EE	On-Demand	Anodyne	P2RY12	56	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nccs2)CC1	ZINC000853769494	EE	On-Demand	Anodyne	P2RY12	56	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(O)cc(CC)n2)CC1	ZINC000853769540	GD	On-Demand	Anodyne	P2RY12	137	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(O)cc(CC)n2)CC1	ZINC000853769541	GD	On-Demand	Anodyne	P2RY12	137	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(C)c(C)s2)CC1	ZINC000853769550	FF	On-Demand	Anodyne	P2RY12	58	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(C)c(C)s2)CC1	ZINC000853769551	FF	On-Demand	Anodyne	P2RY12	58	36
C[C@@H](CCO)NC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1	ZINC000853769605	GF	On-Demand	Anodyne	EPHX2	20	40
C[C@@H](CCO)NC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1	ZINC000853769605	GF	On-Demand	Anodyne	GPR119	30	44
C[C@H](CCO)NC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1	ZINC000853769606	GF	On-Demand	Anodyne	EPHX2	20	40
C[C@H](CCO)NC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1	ZINC000853769606	GF	On-Demand	Anodyne	GPR119	30	44
Cc1cc(N2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)nc(N)n1	ZINC000853769668	EC	On-Demand	Anodyne	HRH4	30	44
COCc1cc([N+](=O)[O-])ccc1N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853769721	GE	On-Demand	Bother	F2RL3	40	39
C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)c2ncnn21	ZINC000853769767	DD	On-Demand	Bother	GSTM2	95	37
C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)c2ncnn21	ZINC000853769767	DD	On-Demand	Bother	GSTP1	55	37
C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)c2ncnn21	ZINC000853769768	DD	On-Demand	Bother	GSTM2	95	37
C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)c2ncnn21	ZINC000853769768	DD	On-Demand	Bother	GSTP1	55	37
O=C1[C@@H]2CN(c3ccc([N+](=O)[O-])cc3F)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853769783	FE	On-Demand	Bother	F2RL3	44	32
C[C@H](CCO)NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853769821	CD	On-Demand	Anodyne	ANPEP	17	43
C[C@@H](CCO)NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853769822	CD	On-Demand	Anodyne	ANPEP	17	43
C[C@H](O)CCSCc1cccc(SC(=O)N(C)C)c1	ZINC000853769905	CG	On-Demand	Anodyne	CACNA2D1	26	42
O=C1[C@@H]2CN(c3cc(Cl)ccc3[N+](=O)[O-])C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853769975	GF	On-Demand	Bother	ALDH1A1	26	43
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(C)cs2)CC1	ZINC000853769994	FE	On-Demand	Anodyne	P2RY12	64	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(C)cs2)CC1	ZINC000853769995	FE	On-Demand	Anodyne	P2RY12	64	36
CS(=O)(=O)c1ccccc1C(=O)OCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853770044	ID	On-Demand	Anodyne	CCR8	47	37
CS(=O)(=O)c1ccccc1C(=O)OCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853770044	ID	On-Demand	Anodyne	L3MBTL3	56	40
CS(=O)(=O)c1ccccc1C(=O)OCC(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853770044	ID	On-Demand	Anodyne	TMPRSS11D	52	32
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ncc(C)s2)CC1	ZINC000853770075	FE	On-Demand	Anodyne	P2RY12	51	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ncc(C)s2)CC1	ZINC000853770076	FE	On-Demand	Anodyne	P2RY12	51	34
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCC[C@@H](C(N)=O)C3)C2)cc1	ZINC000853770106	FD	On-Demand	Clean	EPHX2	15	40
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCC[C@@H](C(N)=O)C3)C2)cc1	ZINC000853770107	FD	On-Demand	Clean	EPHX2	15	40
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCC[C@H](C(N)=O)C3)C2)cc1	ZINC000853770108	FD	On-Demand	Clean	EPHX2	15	40
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCC[C@H](C(N)=O)C3)C2)cc1	ZINC000853770109	FD	On-Demand	Clean	EPHX2	15	40
C#CCNC(=O)c1ccc(N2C[C@@H](C(F)(F)F)[C@H](S(C)(=O)=O)C2)nc1	ZINC000853770111	GC	On-Demand	Mild	HPGDS	15	41
C[C@H](O)CCSCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853770198	DI	On-Demand	Anodyne	CACNA2D1	20	41
C[C@H](O)CCSCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853770198	DI	On-Demand	Anodyne	FPR1	46	38
Nc1nc(Cl)cc(N2C[C@H]3C(=O)N(Cc4ccccc4)C(=O)[C@H]3C2)n1	ZINC000853770202	FD	On-Demand	Anodyne	HRH4	21	47
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(C(C)(C)C)cs2)CC1	ZINC000853770237	GG	On-Demand	Anodyne	P2RY12	42	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(C(C)(C)C)cs2)CC1	ZINC000853770239	GG	On-Demand	Anodyne	P2RY12	42	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(OC)n2)CC1	ZINC000853770245	FE	On-Demand	Anodyne	P2RY12	130	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(OC)n2)CC1	ZINC000853770245	FE	On-Demand	Anodyne	ALS	45	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(OC)n2)CC1	ZINC000853770248	FE	On-Demand	Anodyne	P2RY12	130	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(OC)n2)CC1	ZINC000853770248	FE	On-Demand	Anodyne	ALS	45	34
COC(=O)c1sc(N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)nc1Cl	ZINC000853770272	GD	On-Demand	Anodyne	PARE	40	33
Cc1cc(N2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)nc(N)n1	ZINC000853770283	DC	On-Demand	Anodyne	HRH4	41	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nnc(C)s2)CC1	ZINC000853770316	FD	On-Demand	Anodyne	P2RY12	44	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nnc(C)s2)CC1	ZINC000853770317	FD	On-Demand	Anodyne	P2RY12	44	35
N#Cc1sccc1N1CCN(c2ccc([N+](=O)[O-])c3nonc23)CC1	ZINC000853770351	FE	On-Demand	Mild	GSTM2	108	38
N#Cc1sccc1N1CCN(c2ccc([N+](=O)[O-])c3nonc23)CC1	ZINC000853770351	FE	On-Demand	Mild	GSTP1	66	38
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@@H](O)C[C@H]3C2)c2nonc12	ZINC000853770353	DD	On-Demand	Bother	GSTM2	116	42
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@@H](O)C[C@H]3C2)c2nonc12	ZINC000853770353	DD	On-Demand	Bother	GSTP1	71	42
COCCN(CCF)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853770364	FE	On-Demand	Anodyne	GRIN2B	40	35
COCCN(CCF)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853770364	FE	On-Demand	Anodyne	CACNA1I	56	34
COCCN(CCF)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853770364	FE	On-Demand	Anodyne	L3MBTL3	45	32
COCCN(CCF)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853770364	FE	On-Demand	Anodyne	ACKR3	65	35
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@@H](O)C[C@H]3C2)c(S(=O)(=O)N2CCCC2)c1	ZINC000853770402	GD	On-Demand	Bother	SSTR1	20	40
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	CHRM2	15	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	DRD2	18	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	DRD4	40	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	ACHE	32	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	CHRM3	19	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	SIGMAR1	37	46
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	CCR3	34	47
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	UTS2R	21	40
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	MCHR1	30	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853770414	IE	On-Demand	Anodyne	BIRC2	42	44
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	CHRM2	15	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	DRD2	18	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	DRD4	40	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	ACHE	32	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	CHRM3	19	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	SIGMAR1	37	46
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	CCR3	34	47
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	UTS2R	21	40
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	MCHR1	30	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853770416	IE	On-Demand	Anodyne	BIRC2	42	44
C#CCCN(CCOC)C(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853770420	FE	On-Demand	Mild	L3MBTL3	51	32
CS(=O)(=O)c1ccccc1C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000853770481	JD	On-Demand	Anodyne	NAMPT	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)CCOC)CC1	ZINC000853770510	ED	On-Demand	Anodyne	P2RY12	56	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)CCOC)CC1	ZINC000853770510	ED	On-Demand	Anodyne	CHRNA3	25	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)CCOC)CC1	ZINC000853770510	ED	On-Demand	Anodyne	CHRNA4	17	46
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)CCOC)CC1	ZINC000853770512	ED	On-Demand	Anodyne	P2RY12	56	37
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)CCOC)CC1	ZINC000853770512	ED	On-Demand	Anodyne	CHRNA3	25	46
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)CCOC)CC1	ZINC000853770512	ED	On-Demand	Anodyne	CHRNA4	17	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)CCOC)CC1	ZINC000853770514	ED	On-Demand	Anodyne	P2RY12	56	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)CCOC)CC1	ZINC000853770514	ED	On-Demand	Anodyne	CHRNA3	25	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)CCOC)CC1	ZINC000853770514	ED	On-Demand	Anodyne	CHRNA4	17	46
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)CCOC)CC1	ZINC000853770515	ED	On-Demand	Anodyne	P2RY12	56	37
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)CCOC)CC1	ZINC000853770515	ED	On-Demand	Anodyne	CHRNA3	25	46
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)CCOC)CC1	ZINC000853770515	ED	On-Demand	Anodyne	CHRNA4	17	46
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccn(C3CCCC3)n2)CC1	ZINC000853770531	GF	On-Demand	Anodyne	P2RY12	72	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccn(C3CCCC3)n2)CC1	ZINC000853770532	GF	On-Demand	Anodyne	P2RY12	72	35
C[C@H](O)CCSCc1ccc(SC(=O)N(C)C)cc1	ZINC000853770580	CG	On-Demand	Anodyne	CACNA2D1	23	41
O=C1[C@@H]2CN(c3nccc(N4CCCC4)n3)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853770584	GD	On-Demand	Anodyne	SORD	41	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccnn2C)CC1	ZINC000853770597	ED	On-Demand	Anodyne	P2RY12	108	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccnn2C)CC1	ZINC000853770599	ED	On-Demand	Anodyne	P2RY12	108	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(F)cc2F)CC1	ZINC000853770618	FF	On-Demand	Anodyne	P2RY12	95	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(F)cc2F)CC1	ZINC000853770619	FF	On-Demand	Anodyne	P2RY12	95	36
COC[C@@H](CSCc1cccc(NC(=O)OC(C)(C)C)c1)OC	ZINC000853770620	EH	On-Demand	Anodyne	PDS	53	35
COC[C@H](CSCc1cccc(NC(=O)OC(C)(C)C)c1)OC	ZINC000853770629	EH	On-Demand	Anodyne	PDS	53	35
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2S(C)(=O)=O)c1	ZINC000853770635	HE	On-Demand	Anodyne	KCNK3	81	39
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2S(C)(=O)=O)c1	ZINC000853770635	HE	On-Demand	Anodyne	KCNK9	63	39
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2S(C)(=O)=O)c1	ZINC000853770636	HE	On-Demand	Anodyne	KCNK3	81	39
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2S(C)(=O)=O)c1	ZINC000853770636	HE	On-Demand	Anodyne	KCNK9	63	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(CF)cc2)CC1	ZINC000853770665	FG	On-Demand	Anodyne	P2RY12	62	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(CF)cc2)CC1	ZINC000853770667	FG	On-Demand	Anodyne	P2RY12	62	38
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2ccsc2C#N)CC1	ZINC000853770694	FE	On-Demand	Mild	WDR5	38	42
N#Cc1cc([N+](=O)[O-])ccc1N1C[C@H]2CC[C@@H](O)C[C@H]2C1	ZINC000853770709	CE	On-Demand	Mild	SSTR1	15	41
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2nc3ccccc3o2)CC1	ZINC000853770714	GG	On-Demand	Anodyne	P2RY12	166	38
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2nc3ccccc3o2)CC1	ZINC000853770715	GG	On-Demand	Anodyne	P2RY12	166	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2nc3ccccc3o2)CC1	ZINC000853770717	GG	On-Demand	Anodyne	P2RY12	166	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2nc3ccccc3o2)CC1	ZINC000853770719	GG	On-Demand	Anodyne	P2RY12	166	38
C[C@H](O)CCSCc1ccc(CF)cc1	ZINC000853770731	BG	On-Demand	Anodyne	CACNA2D1	22	40
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)c3ccccc3S(C)(=O)=O)CC2)cc1	ZINC000853770825	JD	On-Demand	Anodyne	TGM2	58	36
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)c3ccccc3S(C)(=O)=O)CC2)cc1	ZINC000853770825	JD	On-Demand	Anodyne	F13A1	59	36
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)c3ccccc3S(C)(=O)=O)CC2)cc1	ZINC000853770826	JD	On-Demand	Anodyne	TGM2	58	36
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)c3ccccc3S(C)(=O)=O)CC2)cc1	ZINC000853770826	JD	On-Demand	Anodyne	F13A1	59	36
O=C1[C@@H]2CN(c3ccc([N+](=O)[O-])cc3)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853770935	FE	On-Demand	Bother	KCNJ1	20	40
O=C1[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853770970	GD	On-Demand	Bother	GSTM2	112	47
O=C1[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853770970	GD	On-Demand	Bother	GSTP1	71	47
O=C1CCC2=C(CCN(C(=O)NCC3CCN(C(=O)c4ccccc4)CC3)C2)N1	ZINC000853771038	GE	On-Demand	Anodyne	GRIN2B	40	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(O)c(F)c1	ZINC000853771046	GF	On-Demand	Anodyne	GPR119	34	40
N#Cc1sccc1N1CCN(c2cc(Cl)nc(N)n2)CC1	ZINC000853771062	DD	On-Demand	Mild	HRH4	39	44
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCCc2ccsc2)CC1	ZINC000853771063	FG	On-Demand	Anodyne	P2RY12	67	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCCc2ccsc2)CC1	ZINC000853771064	FG	On-Demand	Anodyne	P2RY12	67	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(CO)cc2)CC1	ZINC000853771092	FE	On-Demand	Anodyne	P2RY12	58	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(CO)cc2)CC1	ZINC000853771093	FE	On-Demand	Anodyne	P2RY12	58	38
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853771105	GG	On-Demand	Anodyne	GRIN2B	45	35
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853771105	GG	On-Demand	Anodyne	EPHX2	26	59
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853771105	GG	On-Demand	Anodyne	CACNA1I	56	36
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853771105	GG	On-Demand	Anodyne	L3MBTL3	54	33
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853771106	GG	On-Demand	Anodyne	GRIN2B	45	35
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853771106	GG	On-Demand	Anodyne	EPHX2	26	59
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853771106	GG	On-Demand	Anodyne	CACNA1I	56	36
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853771106	GG	On-Demand	Anodyne	L3MBTL3	54	33
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853771107	GG	On-Demand	Anodyne	GRIN2B	45	35
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853771107	GG	On-Demand	Anodyne	EPHX2	26	59
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853771107	GG	On-Demand	Anodyne	CACNA1I	56	36
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853771107	GG	On-Demand	Anodyne	L3MBTL3	54	33
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853771108	GG	On-Demand	Anodyne	GRIN2B	45	35
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853771108	GG	On-Demand	Anodyne	EPHX2	26	59
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853771108	GG	On-Demand	Anodyne	CACNA1I	56	36
O=C(NCC1CCN(C(=O)c2ccccc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853771108	GG	On-Demand	Anodyne	L3MBTL3	54	33
O=C(NCc1ccc(O)c(F)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853771151	DD	On-Demand	Anodyne	NPSR1	26	41
O=C(NCc1ccc(O)c(F)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853771153	DD	On-Demand	Anodyne	NPSR1	26	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOCCOC)CC1	ZINC000853771156	ED	On-Demand	Anodyne	P2RY12	42	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOCCOC)CC1	ZINC000853771158	ED	On-Demand	Anodyne	P2RY12	42	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccccn2)CC1	ZINC000853771208	EE	On-Demand	Anodyne	P2RY12	172	39
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccccn2)CC1	ZINC000853771212	EE	On-Demand	Anodyne	P2RY12	172	39
O=C(NCc1ccc(N=c2cc[nH]cc2)cc1)NC1CCC1	ZINC000853771215	CF	On-Demand	Anodyne	EPHX2	16	47
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccccc1S(C)(=O)=O	ZINC000853771309	JH	On-Demand	Anodyne	CPT1A	43	30
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccccc1S(C)(=O)=O	ZINC000853771309	JH	On-Demand	Anodyne	KCNK3	112	44
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccccc1S(C)(=O)=O	ZINC000853771309	JH	On-Demand	Anodyne	KCNK9	78	38
C[C@H](CCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853771317	EF	On-Demand	Anodyne	ANPEP	16	42
C[C@H](CCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853771317	EF	On-Demand	Anodyne	FPR1	47	34
C[C@@H](CCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853771319	EF	On-Demand	Anodyne	ANPEP	16	42
C[C@@H](CCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853771319	EF	On-Demand	Anodyne	FPR1	47	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(C)cc(O)n2)CC1	ZINC000853771350	FD	On-Demand	Anodyne	P2RY12	103	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(C)cc(O)n2)CC1	ZINC000853771353	FD	On-Demand	Anodyne	P2RY12	103	38
CON(C)CCNC(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853771403	ED	On-Demand	Anodyne	GRIN2B	51	34
CON(C)CCNC(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853771403	ED	On-Demand	Anodyne	EPHX2	16	56
CON(C)CCNC(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853771403	ED	On-Demand	Anodyne	CACNA1I	56	36
CON(C)CCNC(=O)NCC1CCN(C(=O)c2ccccc2)CC1	ZINC000853771403	ED	On-Demand	Anodyne	L3MBTL3	61	36
N#Cc1sccc1N1CCN(c2nccc(N3CCCC3)n2)CC1	ZINC000853771404	EE	On-Demand	Mild	SORD	41	37
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	CHRM2	19	42
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	CHRM1	17	42
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	DRD2	22	50
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	DRD4	45	49
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	ACHE	45	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	HTR4	42	40
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	CHRM3	22	42
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	LTA4H	19	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	SIGMAR1	47	51
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	SSTR5	66	40
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	CCR3	34	51
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	MCHR1	48	47
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	CACNA1G	22	41
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853771414	IE	On-Demand	Anodyne	CCR8	36	41
COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)CCO)C2)cc1	ZINC000853771571	DD	On-Demand	Clean	MTNR1A	16	48
COc1ccc(N2CC[C@H](NC(=O)N[C@H](C)CCO)C2)cc1	ZINC000853771571	DD	On-Demand	Clean	MTNR1B	18	48
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)CCO)C2)cc1	ZINC000853771573	DD	On-Demand	Clean	MTNR1A	16	48
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](C)CCO)C2)cc1	ZINC000853771573	DD	On-Demand	Clean	MTNR1B	18	48
O=C(NCCS(=O)(=O)CC(F)(F)F)NCc1ccc(O)c(F)c1	ZINC000853771590	FD	On-Demand	Anodyne	TRPV1	17	46
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853771622	JD	On-Demand	Anodyne	CA2	42	43
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccccc1S(C)(=O)=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853771623	JD	On-Demand	Anodyne	CA2	42	43
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853771624	JD	On-Demand	Anodyne	CA2	42	43
N#Cc1sccc1N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853771663	EF	On-Demand	Mild	SLC6A9	19	48
N#Cc1sccc1N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853771663	EF	On-Demand	Mild	WDR5	35	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc3c(c2)COC3)CC1	ZINC000853771675	GF	On-Demand	Anodyne	P2RY12	45	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc3c(c2)COC3)CC1	ZINC000853771676	GF	On-Demand	Anodyne	P2RY12	45	36
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853771688	IF	On-Demand	Anodyne	KIT	27	48
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853771688	IF	On-Demand	Anodyne	BRAF	23	48
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(OCC)n2)CC1	ZINC000853771741	GE	On-Demand	Anodyne	P2RY12	134	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(OCC)n2)CC1	ZINC000853771742	GE	On-Demand	Anodyne	P2RY12	134	39
C[C@H](OC(=O)c1ccccc1S(C)(=O)=O)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853771762	IE	On-Demand	Anodyne	SLC6A9	23	41
O=[N+]([O-])c1ccc(NCc2cccnc2N2CCCC2)c2nonc12	ZINC000853771802	EF	On-Demand	Bother	GSTM2	110	41
O=[N+]([O-])c1ccc(NCc2cccnc2N2CCCC2)c2nonc12	ZINC000853771802	EF	On-Demand	Bother	GSTP1	69	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCCOC)CC1	ZINC000853771816	DD	On-Demand	Anodyne	P2RY12	79	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCCOC)CC1	ZINC000853771817	DD	On-Demand	Anodyne	P2RY12	79	38
CCC(=O)c1ccc(N2CC(CCOC)C2)c([N+](=O)[O-])c1	ZINC000853771823	CF	On-Demand	Bother	TAAR1	20	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2cnccn2)CC1	ZINC000853771885	FD	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2cnccn2)CC1	ZINC000853771886	FD	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2cnccn2)CC1	ZINC000853771887	FD	On-Demand	Anodyne	P2RY12	42	35
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2cnccn2)CC1	ZINC000853771888	FD	On-Demand	Anodyne	P2RY12	42	35
FC(F)(F)c1nc(NCc2cccnc2N2CCCC2)c2ccccc2n1	ZINC000853771908	FI	On-Demand	Anodyne	METAP1	17	41
FC(F)(F)c1nc(NCc2cccnc2N2CCCC2)c2ccccc2n1	ZINC000853771908	FI	On-Demand	Anodyne	HNMT	52	31
O=S(=O)(c1ccccc1NCc1cccnc1N1CCCC1)C(F)F	ZINC000853771909	FG	On-Demand	Anodyne	KCNQ2	45	36
CCc1nc2ccccc2n1CCNC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853771928	FE	On-Demand	Anodyne	SMO	37	43
c1cnc(N2CCCC2)c(CNc2nccc(N3CCCC3)n2)c1	ZINC000853771955	DF	On-Demand	Anodyne	SORD	47	40
c1cnc(N2CCCC2)c(CNc2nccc(N3CCCC3)n2)c1	ZINC000853771955	DF	On-Demand	Anodyne	SCN10A	15	41
c1cnc(N2CCCC2)c(CNc2nccc(N3CCCC3)n2)c1	ZINC000853771955	DF	On-Demand	Anodyne	MRGPRX1	41	37
COC(=O)c1sc(N[C@@H]2Cc3ccccc3N(C)C2=O)nc1Cl	ZINC000853772038	FF	On-Demand	Anodyne	PYGL	37	51
COC(=O)c1sc(N[C@@H]2Cc3ccccc3N(C)C2=O)nc1Cl	ZINC000853772038	FF	On-Demand	Anodyne	PYGM	30	46
COC(=O)c1sc(N[C@H]2Cc3ccccc3N(C)C2=O)nc1Cl	ZINC000853772041	FF	On-Demand	Anodyne	PYGL	37	51
COC(=O)c1sc(N[C@H]2Cc3ccccc3N(C)C2=O)nc1Cl	ZINC000853772041	FF	On-Demand	Anodyne	PYGM	30	46
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ncccn2)CC1	ZINC000853772048	ED	On-Demand	Anodyne	P2RY12	109	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ncccn2)CC1	ZINC000853772050	ED	On-Demand	Anodyne	P2RY12	109	38
Fc1cnc(NCc2cccnc2N2CCCC2)cn1	ZINC000853772055	CE	On-Demand	Anodyne	SCN10A	15	40
O=S(=O)(c1ccc(NCc2cccnc2N2CCCC2)cc1)C(F)(F)F	ZINC000853772070	GH	On-Demand	Anodyne	TRPV1	37	52
O=S(=O)(c1ccc(NCc2cccnc2N2CCCC2)cc1)C(F)(F)F	ZINC000853772070	GH	On-Demand	Anodyne	NAMPT	42	36
C[C@H](SCC=C(Cl)Cl)c1ccc(S(C)(=O)=O)cc1	ZINC000853772086	EI	On-Demand	Anodyne	LOX1.1	43	42
C[C@H](SCC=C(Cl)Cl)c1ccc(S(C)(=O)=O)cc1	ZINC000853772086	EI	On-Demand	Anodyne	O49150_SOLTU	52	42
FC(F)(F)c1ccc(NCc2cccnc2N2CCCC2)nc1Cl	ZINC000853772120	FI	On-Demand	Anodyne	TRPV1	36	43
FC(F)(F)c1ccc(NCc2cccnc2N2CCCC2)nc1Cl	ZINC000853772120	FI	On-Demand	Anodyne	SCN10A	18	41
Fc1cccc(NCc2cccnc2N2CCCC2)n1	ZINC000853772122	CF	On-Demand	Anodyne	SCN10A	15	40
C#C[C@H](NC(=O)NCCn1c(CC)nc2ccccc21)C1CCOCC1	ZINC000853772136	FE	On-Demand	Mild	PDE6D	51	36
C#C[C@@H](NC(=O)NCCn1c(CC)nc2ccccc21)C1CCOCC1	ZINC000853772137	FE	On-Demand	Mild	PDE6D	51	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2cccs2)CC1	ZINC000853772149	FF	On-Demand	Anodyne	P2RY12	55	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2cccs2)CC1	ZINC000853772150	FF	On-Demand	Anodyne	P2RY12	55	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(F)F)c2)CC1	ZINC000853772180	GH	On-Demand	Anodyne	P2RY12	134	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(F)F)c2)CC1	ZINC000853772180	GH	On-Demand	Anodyne	TRY2_BOVIN	33	41
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(F)F)c2)CC1	ZINC000853772181	GH	On-Demand	Anodyne	P2RY12	134	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(F)F)c2)CC1	ZINC000853772181	GH	On-Demand	Anodyne	TRY2_BOVIN	33	41
CO[C@]1(CO)CCCN(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)C1	ZINC000853772189	GF	On-Demand	Mild	CTSV	41	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccnc(C)n2)CC1	ZINC000853772201	FD	On-Demand	Anodyne	P2RY12	104	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccnc(C)n2)CC1	ZINC000853772202	FD	On-Demand	Anodyne	P2RY12	104	37
N#Cc1ccc(-c2cccc(CNC(=O)N3CCCC[C@H]3c3nc[nH]n3)c2)s1	ZINC000853772214	GH	On-Demand	Mild	CPT1A	91	44
N#Cc1ccc(-c2cccc(CNC(=O)N3CCCC[C@@H]3c3nc[nH]n3)c2)s1	ZINC000853772215	GH	On-Demand	Mild	CPT1A	91	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(=O)OC)n2)CC1	ZINC000853772216	GD	On-Demand	Anodyne	P2RY12	192	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(=O)OC)n2)CC1	ZINC000853772217	GD	On-Demand	Anodyne	P2RY12	192	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(F)cc(F)c2)CC1	ZINC000853772256	FF	On-Demand	Anodyne	P2RY12	88	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(F)cc(F)c2)CC1	ZINC000853772257	FF	On-Demand	Anodyne	P2RY12	88	36
CC(C)(CO)[C@H](NC(=O)NCc1cccc(-c2ccc(C#N)s2)c1)C1CC1	ZINC000853772323	GH	On-Demand	Mild	CTSV	44	36
COC(=O)c1cccc(NCc2cccnc2N2CCCC2)n1	ZINC000853772332	DE	On-Demand	Anodyne	SCN2A	17	42
COC(=O)c1cccc(NCc2cccnc2N2CCCC2)n1	ZINC000853772332	DE	On-Demand	Anodyne	BDKRB1	19	40
COC(=O)c1cccc(NCc2cccnc2N2CCCC2)n1	ZINC000853772332	DE	On-Demand	Anodyne	SCN10A	19	46
COC(=O)/C=C\c1ccc(NCc2cccnc2N2CCCC2)c([N+](=O)[O-])c1	ZINC000853772371	GG	On-Demand	Bother	NR1H4	42	37
Fc1cccc2c(NCc3cccnc3N3CCCC3)ccnc12	ZINC000853772397	DH	On-Demand	Anodyne	HNMT	58	38
C#CCNC(=O)c1ccc(NCc2cccnc2N2CCCC2)nc1	ZINC000853772459	EE	On-Demand	Mild	SCN2A	20	49
C#CCNC(=O)c1ccc(NCc2cccnc2N2CCCC2)nc1	ZINC000853772459	EE	On-Demand	Mild	SCN10A	27	49
Nc1nc(Cl)cc(NCc2cccnc2N2CCCC2)n1	ZINC000853772461	DE	On-Demand	Anodyne	HRH4	22	50
Nc1nc(Cl)cc(NCc2cccnc2N2CCCC2)n1	ZINC000853772461	DE	On-Demand	Anodyne	SCN2A	19	46
Nc1nc(Cl)cc(NCc2cccnc2N2CCCC2)n1	ZINC000853772461	DE	On-Demand	Anodyne	SCN10A	19	46
CON(C)CCNC(=O)NCCc1cc2ccccc2o1	ZINC000853772463	CD	On-Demand	Anodyne	MTNR1A	48	41
CON(C)CCNC(=O)NCCc1cc2ccccc2o1	ZINC000853772463	CD	On-Demand	Anodyne	MTNR1B	33	41
CC(=O)c1c(F)cccc1NCc1cccnc1N1CCCC1	ZINC000853772505	DH	On-Demand	Anodyne	KCNQ2	65	37
CC(=O)c1c(F)cccc1NCc1cccnc1N1CCCC1	ZINC000853772505	DH	On-Demand	Anodyne	SCN2A	17	42
CC(=O)c1c(F)cccc1NCc1cccnc1N1CCCC1	ZINC000853772505	DH	On-Demand	Anodyne	SCN10A	20	42
N#Cc1c(Cl)nsc1NCc1cccnc1N1CCCC1	ZINC000853772530	DG	On-Demand	Mild	SCN2A	17	42
N#Cc1c(Cl)nsc1NCc1cccnc1N1CCCC1	ZINC000853772530	DG	On-Demand	Mild	SCN10A	18	42
COC(=O)[C@@H]1CCN(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)C[C@@H]1C	ZINC000853772565	GH	On-Demand	Mild	CTSV	40	32
CCN1CC[C@@H](N(CC)C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)C1	ZINC000853772572	GH	On-Demand	Mild	CCR5	21	48
CCN1CC[C@H](N(CC)C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)C1	ZINC000853772573	GH	On-Demand	Mild	CCR5	21	48
CCc1nc2ccccc2n1CCNC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853772575	GE	On-Demand	Anodyne	SMO	37	40
COC(=O)c1sc(NCc2cccnc2N2CCCC2)nc1Cl	ZINC000853772589	FG	On-Demand	Anodyne	SCN2A	17	42
COC(=O)c1sc(NCc2cccnc2N2CCCC2)nc1Cl	ZINC000853772589	FG	On-Demand	Anodyne	SCN10A	22	44
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ncc(Cl)s2)CC1	ZINC000853772611	GF	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ncc(Cl)s2)CC1	ZINC000853772612	GF	On-Demand	Anodyne	P2RY12	43	35
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2cccc(C#N)c2)CC1	ZINC000853772623	GG	On-Demand	Mild	P2RY12	170	37
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2cccc(C#N)c2)CC1	ZINC000853772624	GG	On-Demand	Mild	P2RY12	170	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2cccc(C#N)c2)CC1	ZINC000853772625	GG	On-Demand	Mild	P2RY12	170	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2cccc(C#N)c2)CC1	ZINC000853772626	GG	On-Demand	Mild	P2RY12	170	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(C(F)F)cc2)CC1	ZINC000853772665	GH	On-Demand	Anodyne	P2RY12	40	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(C(F)F)cc2)CC1	ZINC000853772666	GH	On-Demand	Anodyne	P2RY12	40	36
Fc1nc(F)c(F)c(NCc2cccnc2N2CCCC2)c1F	ZINC000853772685	EG	On-Demand	Anodyne	SCN10A	15	41
CC(=O)c1ccc(C#N)cc1NCc1cccnc1N1CCCC1	ZINC000853772711	DG	On-Demand	Mild	SCN10A	15	40
CC[C@@H](O)CNC(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000853772723	EF	On-Demand	Mild	CTSV	40	32
FC(F)OCCSCc1ccc(-n2ccnc2)cc1	ZINC000853772741	CG	On-Demand	Anodyne	CYP2C19	19	46
CON(C)CCNC(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000853772762	EF	On-Demand	Mild	HSD17B2	36	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCC2CCCC2)CC1	ZINC000853772774	EF	On-Demand	Anodyne	P2RY12	50	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCC2CCCC2)CC1	ZINC000853772775	EF	On-Demand	Anodyne	P2RY12	50	34
Cc1cc(C(F)(F)F)c(NCc2cccnc2N2CCCC2)nn1	ZINC000853772788	EG	On-Demand	Anodyne	PTK2	52	33
c1ccc(-c2cn3nc(NCc4cccnc4N4CCCC4)sc3n2)cc1	ZINC000853772846	GI	On-Demand	Anodyne	SCN10A	15	44
CCc1nc2ccccc2n1CCNC(=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853772875	FD	On-Demand	Anodyne	FPR2	22	40
CCc1nc2ccccc2n1CCNC(=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853772876	FD	On-Demand	Anodyne	FPR2	22	40
CN1C[C@H](CNC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)CC1=O	ZINC000853772895	FF	On-Demand	Mild	CTSV	40	31
CN1C[C@@H](CNC(=O)NCc2cccc(-c3ccc(C#N)s3)c2)CC1=O	ZINC000853772896	FF	On-Demand	Mild	CTSV	40	31
O=[N+]([O-])c1cc(F)c(Cl)cc1NCc1cccnc1N1CCCC1	ZINC000853772921	FH	On-Demand	Bother	SCN2A	17	42
O=[N+]([O-])c1cc(F)c(Cl)cc1NCc1cccnc1N1CCCC1	ZINC000853772921	FH	On-Demand	Bother	SCN10A	15	42
Cc1cc(-n2ccnc2)ccc1CSCCOC(F)F	ZINC000853772937	CH	On-Demand	Anodyne	CYP2C19	16	41
Fc1cc(NCc2cccnc2N2CCCC2)ncn1	ZINC000853772941	CE	On-Demand	Anodyne	SCN10A	15	40
C=CCN(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)[C@@H](C)COC	ZINC000853772949	FI	On-Demand	Mild	CTSV	41	33
C=CCN(C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)[C@H](C)COC	ZINC000853772950	FI	On-Demand	Mild	CTSV	41	33
FC(F)(F)c1cc(Cl)nc(NCc2cccnc2N2CCCC2)c1	ZINC000853772964	FI	On-Demand	Anodyne	TRPV1	38	44
FC(F)(F)c1cc(Cl)nc(NCc2cccnc2N2CCCC2)c1	ZINC000853772964	FI	On-Demand	Anodyne	SCN10A	15	41
NC(=O)c1cc(Cl)nnc1NCc1cccnc1N1CCCC1	ZINC000853772969	ED	On-Demand	Anodyne	SCN2A	19	46
NC(=O)c1cc(Cl)nnc1NCc1cccnc1N1CCCC1	ZINC000853772969	ED	On-Demand	Anodyne	SCN10A	20	46
NC(=O)c1cc(Cl)nnc1NCc1cccnc1N1CCCC1	ZINC000853772969	ED	On-Demand	Anodyne	STAT6	81	41
c1cnc(N2CCCC2)c(CNc2ncc3c(n2)CCCC3)c1	ZINC000853772989	DF	On-Demand	Anodyne	SCN10A	15	40
COC(=O)c1cnc(NCc2cccnc2N2CCCC2)cc1C(F)(F)F	ZINC000853773010	GG	On-Demand	Anodyne	TRPV1	38	42
COC(=O)c1cnc(NCc2cccnc2N2CCCC2)cc1C(F)(F)F	ZINC000853773010	GG	On-Demand	Anodyne	BDKRB1	27	41
COC(=O)c1cnc(NCc2cccnc2N2CCCC2)cc1C(F)(F)F	ZINC000853773010	GG	On-Demand	Anodyne	SCN10A	29	41
COC(=O)c1cnc(NCc2cccnc2N2CCCC2)cc1C(F)(F)F	ZINC000853773010	GG	On-Demand	Anodyne	RBP4	16	40
C#Cc1cnc(NCc2cccnc2N2CCCC2)nc1	ZINC000853773099	CE	On-Demand	Mild	SCN10A	15	43
O=[N+]([O-])c1ccc(Cl)cc1NCc1cccnc1N1CCCC1	ZINC000853773233	EH	On-Demand	Bother	SCN2A	19	46
O=[N+]([O-])c1ccc(Cl)cc1NCc1cccnc1N1CCCC1	ZINC000853773233	EH	On-Demand	Bother	SCN10A	17	46
N#Cc1sc(NCc2cccnc2N2CCCC2)nc1Cl	ZINC000853773238	DG	On-Demand	Mild	SCN10A	15	40
COCCc1nsc(N[C@@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853773328	DD	On-Demand	Anodyne	PYGL	28	42
COCCc1nsc(N[C@@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853773328	DD	On-Demand	Anodyne	PYGM	27	42
COCCc1nsc(N[C@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853773329	DD	On-Demand	Anodyne	PYGL	28	42
COCCc1nsc(N[C@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853773329	DD	On-Demand	Anodyne	PYGM	27	42
CON(C)CCNC(=O)NCC1(c2cccc(Cl)c2)CC1	ZINC000853773360	DE	On-Demand	Anodyne	KCNA3	43	37
CCN1CC[C@H](S[C@H]2CCc3cc(Cl)ccc32)C1=O	ZINC000853773462	CH	On-Demand	Anodyne	SRD5A1	15	43
CCN1CC[C@H](S[C@@H]2CCc3cc(Cl)ccc32)C1=O	ZINC000853773463	CH	On-Demand	Anodyne	SRD5A1	15	43
Cc1nc(N[C@@H]2Cc3ccccc3N(C)C2=O)c2cnn(C)c2n1	ZINC000853773524	DD	On-Demand	Anodyne	PYGL	15	40
Cc1nc(N[C@@H]2Cc3ccccc3N(C)C2=O)c2cnn(C)c2n1	ZINC000853773524	DD	On-Demand	Anodyne	PYGM	26	40
Cc1nc(N[C@H]2Cc3ccccc3N(C)C2=O)c2cnn(C)c2n1	ZINC000853773525	DD	On-Demand	Anodyne	PYGL	15	40
Cc1nc(N[C@H]2Cc3ccccc3N(C)C2=O)c2cnn(C)c2n1	ZINC000853773525	DD	On-Demand	Anodyne	PYGM	26	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCCCOC)CC1	ZINC000853773566	ED	On-Demand	Anodyne	P2RY12	100	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCCCOC)CC1	ZINC000853773567	ED	On-Demand	Anodyne	P2RY12	100	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cnc(OC)nc2C)CC1	ZINC000853773652	GD	On-Demand	Anodyne	P2RY12	50	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cnc(OC)nc2C)CC1	ZINC000853773653	GD	On-Demand	Anodyne	P2RY12	50	35
CON(C)CCNC(=O)NCC1(c2cccc(F)c2)CC1	ZINC000853773699	CD	On-Demand	Anodyne	KCNA3	46	39
CON(C)CCNC(=O)NCC1(c2cccc(F)c2)CC1	ZINC000853773699	CD	On-Demand	Anodyne	SOAT1	15	45
CN(CC(=O)N(C)C1CCCCC1)c1nccc(N2CCCC2)n1	ZINC000853773744	EE	On-Demand	Anodyne	SORD	83	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@@H](OC)c2ccccc2)CC1	ZINC000853773840	GF	On-Demand	Anodyne	P2RY12	190	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@@H](OC)c2ccccc2)CC1	ZINC000853773841	GF	On-Demand	Anodyne	P2RY12	190	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@H](OC)c2ccccc2)CC1	ZINC000853773842	GF	On-Demand	Anodyne	P2RY12	190	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@H](OC)c2ccccc2)CC1	ZINC000853773843	GF	On-Demand	Anodyne	P2RY12	190	40
C#CCCN(CCOC)C(=O)NCC1(c2cccc(F)c2)CC1	ZINC000853773978	DF	On-Demand	Mild	KCNA3	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@@H](C)c2cnc(C)cn2)CC1	ZINC000853774033	FE	On-Demand	Anodyne	P2RY12	59	38
CCOC(=O)N1CCN(C(=O)[C@H](C)S[C@H](C)c2cnc(C)cn2)CC1	ZINC000853774034	FE	On-Demand	Anodyne	P2RY12	59	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@@H](C)c2cnc(C)cn2)CC1	ZINC000853774035	FE	On-Demand	Anodyne	P2RY12	59	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)S[C@H](C)c2cnc(C)cn2)CC1	ZINC000853774036	FE	On-Demand	Anodyne	P2RY12	59	38
CC(C)(C)OC(=O)NC1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853774085	GG	On-Demand	Anodyne	NAAA	20	40
CC(C)(C)OC(=O)NC1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853774086	GG	On-Demand	Anodyne	NAAA	20	40
CC(C)(C)OC(=O)NC1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853774087	GG	On-Demand	Anodyne	NAAA	20	40
CC(C)(C)OC(=O)NC1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853774088	GG	On-Demand	Anodyne	NAAA	20	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccnc(OC)n2)CC1	ZINC000853774108	FD	On-Demand	Anodyne	P2RY12	79	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccnc(OC)n2)CC1	ZINC000853774109	FD	On-Demand	Anodyne	P2RY12	79	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(OC)nn2)CC1	ZINC000853774226	FD	On-Demand	Anodyne	P2RY12	61	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(OC)nn2)CC1	ZINC000853774227	FD	On-Demand	Anodyne	P2RY12	61	36
CN(C)C(=O)c1cc(=N[C@H]2Cc3ccccc3N(C)C2=O)cc[nH]1	ZINC000853774235	DD	On-Demand	Anodyne	PYGL	29	43
CN(C)C(=O)c1cc(=N[C@H]2Cc3ccccc3N(C)C2=O)cc[nH]1	ZINC000853774235	DD	On-Demand	Anodyne	PYGM	27	43
CN(C)C(=O)c1cc(=N[C@@H]2Cc3ccccc3N(C)C2=O)cc[nH]1	ZINC000853774236	DD	On-Demand	Anodyne	PYGL	29	43
CN(C)C(=O)c1cc(=N[C@@H]2Cc3ccccc3N(C)C2=O)cc[nH]1	ZINC000853774236	DD	On-Demand	Anodyne	PYGM	27	43
O=C(NCC1(c2cccc(F)c2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853774276	EG	On-Demand	Anodyne	KCNA3	43	38
O=C(NCC1(c2cccc(F)c2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853774277	EG	On-Demand	Anodyne	KCNA3	43	38
O=C(NCC1(c2cccc(F)c2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853774278	EG	On-Demand	Anodyne	KCNA3	43	38
O=C(NCC1(c2cccc(F)c2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853774279	EG	On-Demand	Anodyne	KCNA3	43	38
C#CCSCCNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853774390	DE	On-Demand	Mild	IMDH_CRYPV	40	31
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccc(COC)cc2)CC1	ZINC000853774479	GF	On-Demand	Anodyne	P2RY12	56	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccc(COC)cc2)CC1	ZINC000853774481	GF	On-Demand	Anodyne	P2RY12	56	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C(C)(C)C)on2)CC1	ZINC000853774511	GF	On-Demand	Anodyne	P2RY12	60	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C(C)(C)C)on2)CC1	ZINC000853774512	GF	On-Demand	Anodyne	P2RY12	60	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2c(C)cc(C)nc2OC)CC1	ZINC000853774545	GF	On-Demand	Anodyne	P2RY12	81	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2c(C)cc(C)nc2OC)CC1	ZINC000853774546	GF	On-Demand	Anodyne	P2RY12	81	37
COC(=O)c1cnc(N[C@@H]2Cc3ccccc3N(C)C2=O)cc1C(F)(F)F	ZINC000853774595	GF	On-Demand	Anodyne	PYGL	25	41
COC(=O)c1cnc(N[C@@H]2Cc3ccccc3N(C)C2=O)cc1C(F)(F)F	ZINC000853774595	GF	On-Demand	Anodyne	PYGM	26	41
COC(=O)c1cnc(N[C@H]2Cc3ccccc3N(C)C2=O)cc1C(F)(F)F	ZINC000853774596	GF	On-Demand	Anodyne	PYGL	25	41
COC(=O)c1cnc(N[C@H]2Cc3ccccc3N(C)C2=O)cc1C(F)(F)F	ZINC000853774596	GF	On-Demand	Anodyne	PYGM	26	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C)ncn2)CC1	ZINC000853774735	FD	On-Demand	Anodyne	P2RY12	67	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C)ncn2)CC1	ZINC000853774737	FD	On-Demand	Anodyne	P2RY12	67	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2scnc2C)CC1	ZINC000853774925	FE	On-Demand	Anodyne	P2RY12	57	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2scnc2C)CC1	ZINC000853774927	FE	On-Demand	Anodyne	P2RY12	57	34
C#CCSCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853774934	DE	On-Demand	Mild	MTNR1A	28	45
C#CCSCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853774934	DE	On-Demand	Mild	MTNR1B	28	45
C#CCSCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853774938	DE	On-Demand	Mild	MTNR1A	28	45
C#CCSCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853774938	DE	On-Demand	Mild	MTNR1B	28	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2noc(CCOC)n2)CC1	ZINC000853775020	GD	On-Demand	Anodyne	P2RY12	58	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2noc(CCOC)n2)CC1	ZINC000853775023	GD	On-Demand	Anodyne	P2RY12	58	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@H](Cc2ccccc2)OC)CC1	ZINC000853775259	GF	On-Demand	Anodyne	GHRHR	42	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@H](Cc2ccccc2)OC)CC1	ZINC000853775259	GF	On-Demand	Anodyne	P2RY12	162	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@H](Cc2ccccc2)OC)CC1	ZINC000853775259	GF	On-Demand	Anodyne	CYSP_TRYCR	37	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@@H](Cc2ccccc2)OC)CC1	ZINC000853775261	GF	On-Demand	Anodyne	GHRHR	42	31
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@@H](Cc2ccccc2)OC)CC1	ZINC000853775261	GF	On-Demand	Anodyne	P2RY12	162	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@@H](Cc2ccccc2)OC)CC1	ZINC000853775261	GF	On-Demand	Anodyne	CYSP_TRYCR	37	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@@H](Cc2ccccc2)OC)CC1	ZINC000853775263	GF	On-Demand	Anodyne	GHRHR	42	31
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@@H](Cc2ccccc2)OC)CC1	ZINC000853775263	GF	On-Demand	Anodyne	P2RY12	162	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)SC[C@@H](Cc2ccccc2)OC)CC1	ZINC000853775263	GF	On-Demand	Anodyne	CYSP_TRYCR	37	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@H](Cc2ccccc2)OC)CC1	ZINC000853775265	GF	On-Demand	Anodyne	GHRHR	42	31
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@H](Cc2ccccc2)OC)CC1	ZINC000853775265	GF	On-Demand	Anodyne	P2RY12	162	38
CCOC(=O)N1CCN(C(=O)[C@H](C)SC[C@H](Cc2ccccc2)OC)CC1	ZINC000853775265	GF	On-Demand	Anodyne	CYSP_TRYCR	37	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(C)=O)c2)CC1	ZINC000853775327	GF	On-Demand	Anodyne	P2RY12	96	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(C)=O)c2)CC1	ZINC000853775327	GF	On-Demand	Anodyne	TRY2_BOVIN	94	45
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cccc(C(C)=O)c2)CC1	ZINC000853775327	GF	On-Demand	Anodyne	ST14	64	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(C)=O)c2)CC1	ZINC000853775328	GF	On-Demand	Anodyne	P2RY12	96	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(C)=O)c2)CC1	ZINC000853775328	GF	On-Demand	Anodyne	TRY2_BOVIN	94	45
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cccc(C(C)=O)c2)CC1	ZINC000853775328	GF	On-Demand	Anodyne	ST14	64	45
Cc1cc(N2CCc3ccccc3C(C)(C)C2)nc(N)n1	ZINC000853775374	CF	On-Demand	Anodyne	HRH4	34	50
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cnn(C)n2)CC1	ZINC000853775442	EC	On-Demand	Anodyne	P2RY12	47	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cnn(C)n2)CC1	ZINC000853775444	EC	On-Demand	Anodyne	P2RY12	47	34
CC(=O)c1cccc(CSCCOC(F)F)c1	ZINC000853775524	CG	On-Demand	Anodyne	CACNA2D1	18	40
C#CCSCCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853775699	ED	On-Demand	Mild	L3MBTL3	42	36
C#CCSCCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853775700	ED	On-Demand	Mild	L3MBTL3	42	36
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC(O)(CO)CC1	ZINC000853775740	ED	On-Demand	Clean	NAMPT	18	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(C#N)cs2)CC1	ZINC000853775761	FD	On-Demand	Mild	P2RY12	41	34
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(C#N)cs2)CC1	ZINC000853775762	FD	On-Demand	Mild	P2RY12	41	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2ccnc(OC)c2)CC1	ZINC000853775770	FE	On-Demand	Anodyne	P2RY12	82	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2ccnc(OC)c2)CC1	ZINC000853775771	FE	On-Demand	Anodyne	P2RY12	82	36
COC[C@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(OC)c1	ZINC000853775872	GG	On-Demand	Clean	DRD4	45	37
COC[C@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(OC)c1	ZINC000853775872	GG	On-Demand	Clean	PDS	43	39
COC[C@@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(OC)c1	ZINC000853775873	GG	On-Demand	Clean	DRD4	45	37
COC[C@@H](NC(=O)NCc1ccc(N2CC=CC2)cc1)c1cccc(OC)c1	ZINC000853775873	GG	On-Demand	Clean	PDS	43	39
O=C(NCc1ccc(N2CC=CC2)cc1)N(CCN1CCOCC1)CC1CC1	ZINC000853775904	GE	On-Demand	Clean	CASR	56	40
CO[C@]1(CO)CCCN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1	ZINC000853775915	ED	On-Demand	Clean	SLC12A5	43	33
O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853775994	FG	On-Demand	Clean	EPHX2	28	52
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853776020	GE	On-Demand	Clean	HRH3	15	58
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853776020	GE	On-Demand	Clean	STAT6	42	34
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853776020	GE	On-Demand	Clean	L3MBTL3	115	46
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853776020	GE	On-Demand	Clean	NAMPT	27	42
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853776021	GE	On-Demand	Clean	HRH3	15	58
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853776021	GE	On-Demand	Clean	STAT6	42	34
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853776021	GE	On-Demand	Clean	L3MBTL3	115	46
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853776021	GE	On-Demand	Clean	NAMPT	27	42
Cc1oncc1CSCc1ccc(CN2CCCCC2)cc1	ZINC000853776026	DI	On-Demand	Anodyne	HRH3	19	44
CS(=O)(=O)N1CC[C@@H](CSCc2cccc(C(=O)C(F)(F)F)c2)C1	ZINC000853776106	GF	On-Demand	Anodyne	ST14	45	31
CS(=O)(=O)N1CC[C@H](CSCc2cccc(C(=O)C(F)(F)F)c2)C1	ZINC000853776107	GF	On-Demand	Anodyne	ST14	45	31
O=C(NCCCSCCOCc1ccccc1)C(F)(F)F	ZINC000853776242	DG	On-Demand	Anodyne	CES1	24	42
O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853776260	GG	On-Demand	Clean	EPHX2	23	40
O=C(NCc1ccc(N2CC=CC2)cc1)N[C@H]1CCc2ccc(O)cc21	ZINC000853776330	EG	On-Demand	Clean	HTR2A	23	40
O=C(NCc1ccc(N2CC=CC2)cc1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853776331	EG	On-Demand	Clean	HTR2A	23	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc3n(n2)CCC3)CC1	ZINC000853776398	FD	On-Demand	Anodyne	P2RY12	54	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc3n(n2)CCC3)CC1	ZINC000853776400	FD	On-Demand	Anodyne	P2RY12	54	36
C[S@](=O)[C@@H]1CCC[C@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776480	FH	On-Demand	Anodyne	CHEK2	21	40
C[S@](=O)[C@@H]1CCC[C@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776480	FH	On-Demand	Anodyne	PKNB	22	41
C[S@](=O)[C@@H]1CCC[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776482	FH	On-Demand	Anodyne	CHEK2	21	40
C[S@](=O)[C@@H]1CCC[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776482	FH	On-Demand	Anodyne	PKNB	22	41
C[S@](=O)[C@H]1CCC[C@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776485	FH	On-Demand	Anodyne	CHEK2	21	40
C[S@](=O)[C@H]1CCC[C@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776485	FH	On-Demand	Anodyne	PKNB	22	41
C[S@](=O)[C@H]1CCC[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776487	FH	On-Demand	Anodyne	CHEK2	21	40
C[S@](=O)[C@H]1CCC[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853776487	FH	On-Demand	Anodyne	PKNB	22	41
Cn1c(S)nnc1CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000853776524	GG	On-Demand	Anodyne	CTSA	42	32
Cn1c(S)nnc1CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000853776525	GG	On-Demand	Anodyne	CTSA	42	32
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc3n(n2)CCCC3)CC1	ZINC000853776549	GE	On-Demand	Anodyne	P2RY12	47	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc3n(n2)CCCC3)CC1	ZINC000853776551	GE	On-Demand	Anodyne	P2RY12	47	35
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853776671	FF	On-Demand	Clean	CPT1A	92	39
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853776673	FF	On-Demand	Clean	CPT1A	92	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C)nc(C)n2)CC1	ZINC000853776685	FE	On-Demand	Anodyne	P2RY12	113	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C)nc(C)n2)CC1	ZINC000853776686	FE	On-Demand	Anodyne	P2RY12	113	37
O=C(CSCCOCc1ccccc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853776721	GG	On-Demand	Anodyne	MTOR	49	39
O=C(CSCCOCc1ccccc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853776721	GG	On-Demand	Anodyne	EPHX2	23	47
O=C(CSCCOCc1ccccc1)Nc1ccc(N2CCOCC2)cc1	ZINC000853776721	GG	On-Demand	Anodyne	STAT6	59	39
COC[C@H](CSCc1cccc(C(=O)C(F)(F)F)c1)OC	ZINC000853776729	DG	On-Demand	Anodyne	PDS	47	32
COC[C@@H](CSCc1cccc(C(=O)C(F)(F)F)c1)OC	ZINC000853776730	DG	On-Demand	Anodyne	PDS	47	32
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(N3CC=CC3)cc2)C1	ZINC000853776753	EF	On-Demand	Clean	CCR5	40	57
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(N3CC=CC3)cc2)C1	ZINC000853776754	EF	On-Demand	Clean	CCR5	40	57
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2coc(C)n2)CC1	ZINC000853776765	ED	On-Demand	Anodyne	P2RY12	66	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2coc(C)n2)CC1	ZINC000853776766	ED	On-Demand	Anodyne	P2RY12	66	36
COc1cccc(C2(NC(=O)NCc3ccc(N4CC=CC4)cc3)CCC2)c1	ZINC000853776775	GH	On-Demand	Clean	DRD4	45	37
COc1cccc(C2(NC(=O)NCc3ccc(N4CC=CC4)cc3)CCC2)c1	ZINC000853776775	GH	On-Demand	Clean	SOAT1	17	43
COc1cccc(C2(NC(=O)NCc3ccc(N4CC=CC4)cc3)CCC2)c1	ZINC000853776775	GH	On-Demand	Clean	GRIN2C	17	40
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853776806	FD	On-Demand	Clean	L3MBTL3	76	38
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853776806	FD	On-Demand	Clean	NAMPT	23	40
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853776809	FD	On-Demand	Clean	L3MBTL3	76	38
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853776809	FD	On-Demand	Clean	NAMPT	23	40
C[C@H](CSCCOCc1ccccc1)S(C)(=O)=O	ZINC000853776817	CE	On-Demand	Anodyne	CAPN2	54	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(O)nc(C3CC3)n2)CC1	ZINC000853776866	GD	On-Demand	Anodyne	P2RY12	161	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(O)nc(C3CC3)n2)CC1	ZINC000853776868	GD	On-Demand	Anodyne	P2RY12	161	40
CC[C@@H](CCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853776930	FF	On-Demand	Anodyne	PDS	53	32
CC[C@H](CCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853776931	FF	On-Demand	Anodyne	PDS	53	32
C[C@H](O)CCSCc1cccc(C(=O)C(F)(F)F)c1	ZINC000853776966	CG	On-Demand	Anodyne	CACNA2D1	30	44
CON(C)CCNC(=O)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000853777039	FF	On-Demand	Anodyne	MME	22	40
CON(C)CCNC(=O)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000853777039	FF	On-Demand	Anodyne	PAPA1_CARPA	41	34
CON(C)CCNC(=O)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000853777039	FF	On-Demand	Anodyne	CAPNS1	43	31
CON(C)CCNC(=O)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000853777039	FF	On-Demand	Anodyne	CAPN1	39	40
CON(C)CCNC(=O)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000853777039	FF	On-Demand	Anodyne	CAPN2	56	37
CON(C)CCNC(=O)N[C@@H](COCc1ccccc1)c1ccccc1	ZINC000853777039	FF	On-Demand	Anodyne	NPR	48	31
CON(C)CCNC(=O)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000853777041	FF	On-Demand	Anodyne	MME	22	40
CON(C)CCNC(=O)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000853777041	FF	On-Demand	Anodyne	PAPA1_CARPA	41	34
CON(C)CCNC(=O)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000853777041	FF	On-Demand	Anodyne	CAPNS1	43	31
CON(C)CCNC(=O)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000853777041	FF	On-Demand	Anodyne	CAPN1	39	40
CON(C)CCNC(=O)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000853777041	FF	On-Demand	Anodyne	CAPN2	56	37
CON(C)CCNC(=O)N[C@H](COCc1ccccc1)c1ccccc1	ZINC000853777041	FF	On-Demand	Anodyne	NPR	48	31
O=C(NCc1ccc(N2CC=CC2)cc1)N1CCC(CO)(CO)C1	ZINC000853777065	EC	On-Demand	Clean	NAMPT	18	42
CS(=O)(=O)C1CN(C(=O)NCc2ccc(N3CC=CC3)cc2)C1	ZINC000853777110	ED	On-Demand	Clean	NAMPT	26	43
COCc1n[nH]c(CNC(=O)NCc2ccc(N3CC=CC3)cc2)n1	ZINC000853777112	ED	On-Demand	Clean	FLT3	16	40
CCC(C)(C)[C@@H](C)Nc1ccc2c(c1)S(=O)(=O)N=C2Cl	ZINC000853777196	DH	On-Demand	Anodyne	ABCC8	44	33
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000853777202	EF	On-Demand	Anodyne	PAPA1_CARPA	41	34
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000853777203	EF	On-Demand	Anodyne	PAPA1_CARPA	41	34
C[S@](=O)[C@H]1CCC[C@@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777208	DE	On-Demand	Anodyne	MAPK9	31	43
C[S@](=O)[C@H]1CCC[C@@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777208	DE	On-Demand	Anodyne	MAPK8	35	43
C[S@](=O)[C@H]1CCC[C@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777209	DE	On-Demand	Anodyne	MAPK9	31	43
C[S@](=O)[C@H]1CCC[C@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777209	DE	On-Demand	Anodyne	MAPK8	35	43
C[S@](=O)[C@@H]1CCC[C@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777210	DE	On-Demand	Anodyne	MAPK9	31	43
C[S@](=O)[C@@H]1CCC[C@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777210	DE	On-Demand	Anodyne	MAPK8	35	43
C[S@](=O)[C@@H]1CCC[C@@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777211	DE	On-Demand	Anodyne	MAPK9	31	43
C[S@](=O)[C@@H]1CCC[C@@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853777211	DE	On-Demand	Anodyne	MAPK8	35	43
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2noc3ccccc23)CC1	ZINC000853777224	GF	On-Demand	Anodyne	P2RY12	81	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2noc3ccccc23)CC1	ZINC000853777225	GF	On-Demand	Anodyne	P2RY12	81	37
CCCCC[C@@H](C)NC(=O)CSCc1cc(C)nc(C)n1	ZINC000853777237	DG	On-Demand	Anodyne	NOD1	42	33
C[S@](=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777304	DE	On-Demand	Bother	GSTM2	100	43
C[S@](=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777304	DE	On-Demand	Bother	GSTP1	59	43
C[S@](=O)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777304	DE	On-Demand	Bother	EPAS1	46	30
C[S@](=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777305	DE	On-Demand	Bother	GSTM2	100	43
C[S@](=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777305	DE	On-Demand	Bother	GSTP1	59	43
C[S@](=O)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777305	DE	On-Demand	Bother	EPAS1	46	30
C[S@](=O)[C@@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777306	DE	On-Demand	Bother	GSTM2	100	43
C[S@](=O)[C@@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777306	DE	On-Demand	Bother	GSTP1	59	43
C[S@](=O)[C@@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777306	DE	On-Demand	Bother	EPAS1	46	30
C[S@](=O)[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777307	DE	On-Demand	Bother	GSTM2	100	43
C[S@](=O)[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777307	DE	On-Demand	Bother	GSTP1	59	43
C[S@](=O)[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853777307	DE	On-Demand	Bother	EPAS1	46	30
CC[C@@H](NC(=O)N1CCC2=C(CCC(=O)N2)C1)c1cc(F)ccc1F	ZINC000853777317	EF	On-Demand	Anodyne	CACNA1H	31	40
O=C(CSCCOCc1ccccc1)N1CCC2(CC1)OCCO2	ZINC000853777339	FE	On-Demand	Anodyne	SLC12A5	60	33
CCOC(=O)Nc1ccc2c(CSCc3cc(C)nc(C)n3)cc(=O)oc2c1	ZINC000853777391	GI	On-Demand	Anodyne	HSD17B3	19	42
O=C(CCSCCOCc1ccccc1)N1CCCC1	ZINC000853777434	CF	On-Demand	Anodyne	PREP	58	42
O=C(CCSCCOCc1ccccc1)N1CCCC1	ZINC000853777434	CF	On-Demand	Anodyne	SLC12A5	42	33
COc1ccc(N2CCN(C(=O)CSCc3cc(C)nc(C)n3)CC2)cc1	ZINC000853777449	GF	On-Demand	Clean	CCKAR	24	40
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	PAPA1_CARPA	54	39
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	CTSK	26	40
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	CTSL	26	40
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	CAPNS1	52	32
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	CTSS	16	40
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	CAPN1	61	37
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	CAPN2	86	35
C#CCNC(=O)[C@@H](C)SCCOCc1ccccc1	ZINC000853777457	CE	On-Demand	Mild	NPR	71	35
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	PAPA1_CARPA	54	39
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	CTSK	26	40
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	CTSL	26	40
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	CAPNS1	52	32
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	CTSS	16	40
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	CAPN1	61	37
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	CAPN2	86	35
C#CCNC(=O)[C@H](C)SCCOCc1ccccc1	ZINC000853777458	CE	On-Demand	Mild	NPR	71	35
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCC2=CCCC2)CC1	ZINC000853777483	EF	On-Demand	Anodyne	P2RY12	47	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCC2=CCCC2)CC1	ZINC000853777484	EF	On-Demand	Anodyne	P2RY12	47	36
C[S@](=O)[C@@H]1CCC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777574	FI	On-Demand	Anodyne	CHEK1	17	42
C[S@](=O)[C@@H]1CCC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777574	FI	On-Demand	Anodyne	CD38	48	41
C[S@](=O)[C@H]1CCC[C@@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777575	FI	On-Demand	Anodyne	CHEK1	17	42
C[S@](=O)[C@H]1CCC[C@@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777575	FI	On-Demand	Anodyne	CD38	48	41
C[S@](=O)[C@@H]1CCC[C@@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777576	FI	On-Demand	Anodyne	CHEK1	17	42
C[S@](=O)[C@@H]1CCC[C@@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777576	FI	On-Demand	Anodyne	CD38	48	41
C[S@](=O)[C@H]1CCC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777577	FI	On-Demand	Anodyne	CHEK1	17	42
C[S@](=O)[C@H]1CCC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853777577	FI	On-Demand	Anodyne	CD38	48	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2nc(C3CC3)nn2C)CC1	ZINC000853777581	GD	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2nc(C3CC3)nn2C)CC1	ZINC000853777582	GD	On-Demand	Anodyne	P2RY12	41	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOCc2ccccc2)CC1	ZINC000853777589	GF	On-Demand	Anodyne	P2RY12	187	41
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOCc2ccccc2)CC1	ZINC000853777589	GF	On-Demand	Anodyne	CCR8	16	42
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOCc2ccccc2)CC1	ZINC000853777589	GF	On-Demand	Anodyne	Q6PRC7_IXORI	45	40
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOCc2ccccc2)CC1	ZINC000853777589	GF	On-Demand	Anodyne	SLC12A5	49	34
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOCc2ccccc2)CC1	ZINC000853777590	GF	On-Demand	Anodyne	P2RY12	187	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOCc2ccccc2)CC1	ZINC000853777590	GF	On-Demand	Anodyne	CCR8	16	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOCc2ccccc2)CC1	ZINC000853777590	GF	On-Demand	Anodyne	Q6PRC7_IXORI	45	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOCc2ccccc2)CC1	ZINC000853777590	GF	On-Demand	Anodyne	SLC12A5	49	34
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1cc(F)ccc1F	ZINC000853777593	FG	On-Demand	Anodyne	CACNA1H	32	42
C#CCNC(=O)[C@@H](C)SCCc1ccc(C#N)cc1	ZINC000853777657	CD	On-Demand	Mild	CTRB_BOVIN	48	39
C#CCNC(=O)[C@H](C)SCCc1ccc(C#N)cc1	ZINC000853777658	CD	On-Demand	Mild	CTRB_BOVIN	48	39
CCOc1ccccc1NC(=O)CSc1nc(O)cc(=O)n1CCOC	ZINC000853777721	GD	On-Demand	Anodyne	ENPP1	49	31
O=C(CSC[C@@H]1CC[C@@H]2C[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777767	FH	On-Demand	Anodyne	MTOR	55	35
O=C(CSC[C@@H]1CC[C@@H]2C[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777767	FH	On-Demand	Anodyne	STAT6	41	30
O=C(CSC[C@@H]1CC[C@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777769	FH	On-Demand	Anodyne	MTOR	55	35
O=C(CSC[C@@H]1CC[C@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777769	FH	On-Demand	Anodyne	STAT6	41	30
O=C(CSC[C@@H]1CC[C@H]2C[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777772	FH	On-Demand	Anodyne	MTOR	55	35
O=C(CSC[C@@H]1CC[C@H]2C[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777772	FH	On-Demand	Anodyne	STAT6	41	30
O=C(CSC[C@@H]1CC[C@@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777774	FH	On-Demand	Anodyne	MTOR	55	35
O=C(CSC[C@@H]1CC[C@@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853777774	FH	On-Demand	Anodyne	STAT6	41	30
COCCn1c(SCC(=O)Nc2cccc(S(=O)(=O)N3CCOCC3)c2)nc(O)cc1=O	ZINC000853777790	JC	On-Demand	Anodyne	ENPP1	44	30
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)C1CC1	ZINC000853777821	GG	On-Demand	Anodyne	REN	51	38
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)C1CC1	ZINC000853777821	GG	On-Demand	Anodyne	EPHX2	17	41
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)C1CC1	ZINC000853777822	GG	On-Demand	Anodyne	REN	51	38
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)C1CC1	ZINC000853777822	GG	On-Demand	Anodyne	EPHX2	17	41
COCCn1c(SCC(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853777823	HD	On-Demand	Anodyne	MTOR	71	38
COCCn1c(SCC(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853777823	HD	On-Demand	Anodyne	PIK3CB	17	42
COCCn1c(SCC(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853777823	HD	On-Demand	Anodyne	STAT6	50	32
COCCn1c(SCC(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853777823	HD	On-Demand	Anodyne	ENPP1	60	31
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc(O)cc1=O	ZINC000853777826	JD	On-Demand	Anodyne	TGM2	52	36
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc(O)cc1=O	ZINC000853777826	JD	On-Demand	Anodyne	F13A1	68	39
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc(O)cc1=O	ZINC000853777826	JD	On-Demand	Anodyne	ENPP1	49	30
COCCn1c(SCC(=O)Nc2cc(OC)ccc2OC)nc(O)cc1=O	ZINC000853777831	GD	On-Demand	Anodyne	ENPP1	71	34
CC[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)C(C)(C)c1ccccc1	ZINC000853777836	FG	On-Demand	Anodyne	AMY2	43	31
COCCn1c(SCC(=O)Nc2ccc(C(C)(C)C)cc2)nc(O)cc1=O	ZINC000853777934	GF	On-Demand	Anodyne	ENPP1	70	34
COCCn1c(SCC(=O)Nc2cccc(C#N)c2)nc(O)cc1=O	ZINC000853777966	FD	On-Demand	Mild	ENPP1	63	33
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)C(C)(C)c1ccccc1	ZINC000853777987	FG	On-Demand	Anodyne	AMY2	57	35
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)C(C)(C)c1ccccc1	ZINC000853777987	FG	On-Demand	Anodyne	EPHX2	38	41
COc1cccc(Oc2ncccc2CNC(=O)NCCN(C)OC)c1	ZINC000853777992	FE	On-Demand	Anodyne	P2RY1	17	41
COc1cccc(Oc2ncccc2CNC(=O)NCCN(C)OC)c1	ZINC000853777992	FE	On-Demand	Anodyne	MTNR1A	45	41
COc1cccc(Oc2ncccc2CNC(=O)NCCN(C)OC)c1	ZINC000853777992	FE	On-Demand	Anodyne	MTNR1B	40	39
COCCn1c(SCC(=O)Nc2ccc(C)c(C)c2)nc(O)cc1=O	ZINC000853778026	FD	On-Demand	Anodyne	POLC	39	43
COCCn1c(SCC(=O)Nc2ccc(C)c(C)c2)nc(O)cc1=O	ZINC000853778026	FD	On-Demand	Anodyne	ENPP1	80	39
CCC(C)(C)[C@@H](C)NC(=O)NCc1nc(-c2ccccc2)n[nH]1	ZINC000853778046	DG	On-Demand	Anodyne	TPH1	44	35
COCCn1c(SCC(=O)Nc2cccc(C)c2)nc(O)cc1=O	ZINC000853778147	ED	On-Demand	Anodyne	ENPP1	70	33
COCCn1c(SCC(=O)Nc2cccc(C)c2)nc(O)cc1=O	ZINC000853778147	ED	On-Demand	Anodyne	KCNK3	55	34
COCCn1c(SCC(=O)Nc2cccc(C)c2)nc(O)cc1=O	ZINC000853778147	ED	On-Demand	Anodyne	KCNK9	45	34
CC[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)C(C)(C)c1ccccc1	ZINC000853778148	FF	On-Demand	Anodyne	AMY2	43	31
CC[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)C(C)(C)c1ccccc1	ZINC000853778149	FF	On-Demand	Anodyne	AMY2	43	31
COCCn1c(SCC(=O)Nc2cc(C)ccc2OC)nc(O)cc1=O	ZINC000853778181	GD	On-Demand	Anodyne	ENPP1	72	34
COCCn1c(SCC(=O)Nc2ccc(F)c(Cl)c2)nc(O)cc1=O	ZINC000853778201	GE	On-Demand	Anodyne	ENPP1	72	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cn(C(C)(C)C)nn2)CC1	ZINC000853778203	GD	On-Demand	Anodyne	P2RY12	46	35
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cn(C(C)(C)C)nn2)CC1	ZINC000853778205	GD	On-Demand	Anodyne	P2RY12	46	35
O=C(NCCN1C[C@@H]2CCCCN2C1=O)NCc1nc(-c2ccccc2)n[nH]1	ZINC000853778207	GD	On-Demand	Anodyne	CPT1A	42	35
O=C(NCCN1C[C@H]2CCCCN2C1=O)NCc1nc(-c2ccccc2)n[nH]1	ZINC000853778209	GD	On-Demand	Anodyne	CPT1A	42	35
CC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)C(C)(C)c1ccccc1	ZINC000853778237	EG	On-Demand	Anodyne	CTRB1	33	40
CC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)C(C)(C)c1ccccc1	ZINC000853778237	EG	On-Demand	Anodyne	AMY2	59	38
COCCn1c(SCC(=O)Nc2cccc(S(=O)(=O)N(C)C)c2)nc(O)cc1=O	ZINC000853778243	IC	On-Demand	Anodyne	ENPP1	55	32
N#Cc1ccc(CCSCCC(=O)N2CCCC2)cc1	ZINC000853778274	CF	On-Demand	Mild	KCNJ1	15	43
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)c3ccccc3)C2)cc1	ZINC000853778275	FF	On-Demand	Clean	EDNRB	27	40
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)c3ccccc3)C2)cc1	ZINC000853778275	FF	On-Demand	Clean	EDNRA	18	40
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)c3ccccc3)C2)cc1	ZINC000853778275	FF	On-Demand	Clean	CCR5	21	49
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCO)c3ccccc3)C2)cc1	ZINC000853778275	FF	On-Demand	Clean	MTNR1B	17	46
N#Cc1ccc(CCSCCN2CCOC2=O)cc1	ZINC000853778291	CE	On-Demand	Mild	KCNJ1	24	44
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CCN(C2CCOCC2)CC1	ZINC000853778423	GE	On-Demand	Anodyne	VCP	41	33
COCCn1c(SCc2ccc([N+](=O)[O-])cc2)nc(O)cc1=O	ZINC000853778449	ED	On-Demand	Bother	SLC29A1	49	38
COCCn1c(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)nc(O)cc1=O	ZINC000853778451	HE	On-Demand	Anodyne	GCGR	20	40
COCCn1c(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)nc(O)cc1=O	ZINC000853778451	HE	On-Demand	Anodyne	P2RY1	44	37
COCCn1c(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)nc(O)cc1=O	ZINC000853778451	HE	On-Demand	Anodyne	EPHX2	41	38
COCCn1c(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)nc(O)cc1=O	ZINC000853778451	HE	On-Demand	Anodyne	SHH	43	35
COCCn1c(SCC(=O)Nc2ccc(OC(F)(F)F)cc2)nc(O)cc1=O	ZINC000853778451	HE	On-Demand	Anodyne	ENPP1	67	32
COCCn1c(SCc2ccc(F)cc2)nc(O)cc1=O	ZINC000853778455	DE	On-Demand	Anodyne	PLA2G7	127	36
COCCn1c(SCC(=O)Nc2cccc(C(C)=O)c2)nc(O)cc1=O	ZINC000853778466	GD	On-Demand	Anodyne	ENPP1	69	33
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)C1CC1	ZINC000853778483	GE	On-Demand	Anodyne	CPT1A	44	33
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)C1CC1	ZINC000853778483	GE	On-Demand	Anodyne	REN	40	36
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)C1CC1	ZINC000853778485	GE	On-Demand	Anodyne	CPT1A	44	33
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)C1CC1	ZINC000853778485	GE	On-Demand	Anodyne	REN	40	36
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C1CC1	ZINC000853778487	GE	On-Demand	Anodyne	CPT1A	44	33
CC(C)(C)OC(=O)NC[C@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C1CC1	ZINC000853778487	GE	On-Demand	Anodyne	REN	40	36
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C1CC1	ZINC000853778489	GE	On-Demand	Anodyne	CPT1A	44	33
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)C1CC1	ZINC000853778489	GE	On-Demand	Anodyne	REN	40	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N(CCN1CCOCC1)CC1CC1	ZINC000853778517	GD	On-Demand	Anodyne	CASR	59	47
COCCn1c(SCc2ccc(Cl)cc2)nc(O)cc1=O	ZINC000853778543	EF	On-Demand	Anodyne	PLA2G7	44	36
COCCn1c(SCC(=O)Nc2ccccc2Cl)nc(O)cc1=O	ZINC000853778560	FD	On-Demand	Anodyne	EPHB3	40	35
COCCn1c(SCC(=O)Nc2ccccc2Cl)nc(O)cc1=O	ZINC000853778560	FD	On-Demand	Anodyne	FAS	48	37
COCCn1c(SCC(=O)Nc2ccc(I)cc2)nc(O)cc1=O	ZINC000853778598	JD	On-Demand	Anodyne	ENPP1	72	34
CCn1nccc1[C@@H]1OCCC[C@H]1CNc1ccnc2cc(OC)ccc12	ZINC000853778693	FI	On-Demand	Anodyne	HRP1_PLAFA	59	37
CCn1nccc1[C@@H]1OCCC[C@H]1CNc1ccnc2cc(OC)ccc12	ZINC000853778693	FI	On-Demand	Anodyne	HNMT	56	32
COC1CC(CCNC(=O)NCc2nc(-c3ccccc3)n[nH]2)C1	ZINC000853778706	EE	On-Demand	Anodyne	VCP	41	32
CCn1nccc1[C@@H]1OCCC[C@H]1CNc1ncnc2c1CCC2	ZINC000853778709	EF	On-Demand	Anodyne	TNK2	49	34
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853778742	FD	On-Demand	Anodyne	DRD4	30	40
CON(C)CCNC(=O)N[C@H](C)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853778743	FD	On-Demand	Anodyne	DRD4	30	40
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853778744	FD	On-Demand	Anodyne	DRD4	30	40
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853778745	FD	On-Demand	Anodyne	DRD4	30	40
COCCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nc(O)cc1=O	ZINC000853778752	GD	On-Demand	Anodyne	DYRK2	44	39
COCCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nc(O)cc1=O	ZINC000853778752	GD	On-Demand	Anodyne	ENPP1	70	33
COCCn1c(SCC(=O)Nc2ccccc2C)nc(O)cc1=O	ZINC000853778802	ED	On-Demand	Anodyne	FAS	50	37
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCc2ccc(C#N)cc2)CC1	ZINC000853778811	GF	On-Demand	Mild	CTRB_BOVIN	49	36
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCc2ccc(C#N)cc2)CC1	ZINC000853778812	GF	On-Demand	Mild	CTRB_BOVIN	49	36
C[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1cnn(C)c1	ZINC000853778817	FD	On-Demand	Anodyne	MAPK1	42	43
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778819	EC	On-Demand	Anodyne	HTR1A	43	44
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778819	EC	On-Demand	Anodyne	DRD2	31	41
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778819	EC	On-Demand	Anodyne	ADRA1D	20	43
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778819	EC	On-Demand	Anodyne	DRD3	45	42
CON(C)CCNC(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778819	EC	On-Demand	Anodyne	P2RX3	23	41
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778820	EC	On-Demand	Anodyne	HTR1A	43	44
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778820	EC	On-Demand	Anodyne	DRD2	31	41
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778820	EC	On-Demand	Anodyne	ADRA1D	20	43
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778820	EC	On-Demand	Anodyne	DRD3	45	42
CON(C)CCNC(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853778820	EC	On-Demand	Anodyne	P2RX3	23	41
O=C(NCc1cccnc1N1CCCC1)N[C@@H](CCO)c1cccs1	ZINC000853778835	FF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1cccnc1N1CCCC1)N[C@@H](CCO)c1cccs1	ZINC000853778835	FF	On-Demand	Anodyne	SCN10A	18	43
O=C(NCc1cccnc1N1CCCC1)N[C@H](CCO)c1cccs1	ZINC000853778837	FF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1cccnc1N1CCCC1)N[C@H](CCO)c1cccs1	ZINC000853778837	FF	On-Demand	Anodyne	SCN10A	18	43
N#Cc1ccc(CCSCC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853778840	GG	On-Demand	Mild	PIK3CA	21	40
N#Cc1ccc(CCSCC(=O)Nc2ccc(N3CCOCC3)cc2)cc1	ZINC000853778840	GG	On-Demand	Mild	MTOR	34	40
O=C(NCc1ncccn1)N[C@H](CCO)c1ccccc1	ZINC000853778843	CD	On-Demand	Anodyne	TACR3	40	37
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000853778856	GH	On-Demand	Anodyne	ADRB1	19	42
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000853778856	GH	On-Demand	Anodyne	ADRB3	30	43
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000853778857	GH	On-Demand	Anodyne	ADRB1	19	42
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](CCCO)c1ccccc1	ZINC000853778857	GH	On-Demand	Anodyne	ADRB3	30	43
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000853778858	GH	On-Demand	Anodyne	ADRB1	19	42
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000853778858	GH	On-Demand	Anodyne	ADRB3	30	43
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000853778859	GH	On-Demand	Anodyne	ADRB1	19	42
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](CCCO)c1ccccc1	ZINC000853778859	GH	On-Demand	Anodyne	ADRB3	30	43
O=C(NCCCc1nc[nH]n1)N[C@H](CCO)c1ccccc1	ZINC000853778864	DD	On-Demand	Anodyne	C3AR1	45	33
O=C(NCc1ccc(Cl)c(Cl)c1)N[C@H](CCO)c1cccs1	ZINC000853778940	FH	On-Demand	Anodyne	F11	16	41
O=C(NCc1ccc(Cl)c(Cl)c1)N[C@@H](CCO)c1cccs1	ZINC000853778941	FH	On-Demand	Anodyne	F11	16	41
CCN1CC[C@H](N(CC)C(=O)NCc2nc(-c3ccccc3)n[nH]2)C1	ZINC000853778943	EE	On-Demand	Anodyne	CCR5	34	49
CCN1CC[C@@H](N(CC)C(=O)NCc2nc(-c3ccccc3)n[nH]2)C1	ZINC000853778945	EE	On-Demand	Anodyne	CCR5	34	49
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853778995	DF	On-Demand	Anodyne	CPT1A	46	37
CCn1nccc1[C@@H]1OCCC[C@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853779011	FF	On-Demand	Bother	GSTM2	97	39
CCn1nccc1[C@@H]1OCCC[C@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853779011	FF	On-Demand	Bother	GSTP1	58	39
CCC(CC)CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853779054	EH	On-Demand	Anodyne	MTOR	68	40
CCC(CC)CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853779054	EH	On-Demand	Anodyne	STAT6	54	35
CC[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1ccncc1	ZINC000853779065	GE	On-Demand	Anodyne	MAPK1	42	39
C#CCCN(CCOC)C(=O)N[C@H](CC)C(C)(C)c1ccccc1	ZINC000853779084	EG	On-Demand	Mild	AMY2	55	35
C#CCCN(CCOC)C(=O)N[C@@H](CC)C(C)(C)c1ccccc1	ZINC000853779085	EG	On-Demand	Mild	AMY2	55	35
O=C(NCC1CCN(Cc2ccncc2)CC1)N[C@H](CCO)c1cccs1	ZINC000853779087	GF	On-Demand	Anodyne	ACHE	24	43
O=C(NCC1CCN(Cc2ccncc2)CC1)N[C@H](CCO)c1cccs1	ZINC000853779087	GF	On-Demand	Anodyne	SIGMAR1	20	47
O=C(NCC1CCN(Cc2ccncc2)CC1)N[C@H](CCO)c1cccs1	ZINC000853779087	GF	On-Demand	Anodyne	CACNA1I	44	37
O=C(NCC1CCN(Cc2ccncc2)CC1)N[C@@H](CCO)c1cccs1	ZINC000853779093	GF	On-Demand	Anodyne	ACHE	24	43
O=C(NCC1CCN(Cc2ccncc2)CC1)N[C@@H](CCO)c1cccs1	ZINC000853779093	GF	On-Demand	Anodyne	SIGMAR1	20	47
O=C(NCC1CCN(Cc2ccncc2)CC1)N[C@@H](CCO)c1cccs1	ZINC000853779093	GF	On-Demand	Anodyne	CACNA1I	44	37
CCn1nccc1[C@@H]1OCCC[C@H]1CNc1ncnc(F)c1Br	ZINC000853779134	GG	On-Demand	Anodyne	TNK2	43	32
COCCn1c(SCC(=O)Nc2ccc(N3CCCCC3)cc2)nc(O)cc1=O	ZINC000853779151	HE	On-Demand	Anodyne	ENPP1	61	32
COCCn1c(SCc2cccc([N+](=O)[O-])c2)nc(O)cc1=O	ZINC000853779152	ED	On-Demand	Bother	CACNA1D	54	34
COC(=O)N(C)CCNC(=O)N[C@@H](CCCO)c1ccccc1	ZINC000853779231	DD	On-Demand	Anodyne	UTS2	68	40
COC(=O)N(C)CCNC(=O)N[C@H](CCCO)c1ccccc1	ZINC000853779232	DD	On-Demand	Anodyne	UTS2	68	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853779251	ED	On-Demand	Anodyne	MTOR	40	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853779256	ED	On-Demand	Anodyne	MTOR	40	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@H]2COC[C@H]2C1	ZINC000853779258	ED	On-Demand	Anodyne	MTOR	40	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853779259	ED	On-Demand	Anodyne	MTOR	40	36
COc1cccc([C@]2(C)CCN(C(=O)NCc3nc(-c4ccccc4)n[nH]3)C2)c1	ZINC000853779272	GG	On-Demand	Anodyne	DRD4	41	32
COc1ccc([C@@H]2CCCN2C(=O)NCc2nc(-c3ccccc3)n[nH]2)cc1F	ZINC000853779304	GH	On-Demand	Anodyne	TSHR	41	32
COc1ccc([C@@H]2CCCN2C(=O)NCc2nc(-c3ccccc3)n[nH]2)cc1F	ZINC000853779304	GH	On-Demand	Anodyne	CPT1A	84	41
COc1ccc([C@@H]2CCCN2C(=O)NCc2nc(-c3ccccc3)n[nH]2)cc1F	ZINC000853779304	GH	On-Demand	Anodyne	ACKR3	61	32
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCc1cccnc1N1CCCC1	ZINC000853779383	GE	On-Demand	Anodyne	SCN2A	19	46
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCc1cccnc1N1CCCC1	ZINC000853779383	GE	On-Demand	Anodyne	SCN10A	24	50
CC[C@@H](NC(=O)N(CCF)CCOC)C(C)(C)c1ccccc1	ZINC000853779440	DG	On-Demand	Anodyne	AMY2	57	37
COc1ccc(-c2n[nH]c(CNC(=O)N3CC[C@@H](N4CCOC4=O)C3)n2)cc1	ZINC000853779443	GD	On-Demand	Anodyne	MTOR	46	34
COc1ccc(-c2n[nH]c(CNC(=O)N3CC[C@H](N4CCOC4=O)C3)n2)cc1	ZINC000853779444	GD	On-Demand	Anodyne	MTOR	46	34
COCCn1c(SCC(=O)Nc2ccc(Br)c(C)c2)nc(O)cc1=O	ZINC000853779452	IE	On-Demand	Anodyne	POLC	20	40
COCCn1c(SCC(=O)Nc2ccc(Br)c(C)c2)nc(O)cc1=O	ZINC000853779452	IE	On-Demand	Anodyne	ENPP1	73	36
Cc1nocc1CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853779463	EF	On-Demand	Anodyne	MTOR	53	38
Cc1nocc1CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853779463	EF	On-Demand	Anodyne	STAT6	53	32
CCC(CC)CSCC(=O)NCc1ccc(NC(=O)OC)cc1	ZINC000853779531	EH	On-Demand	Anodyne	TPSAB1	17	41
CCC(CC)CSCC(=O)NCc1ccc(NC(=O)OC)cc1	ZINC000853779531	EH	On-Demand	Anodyne	PDS	54	38
CC[C@@H](NC(=O)NCc1ncccn1)C(C)(C)c1ccccc1	ZINC000853779573	DG	On-Demand	Anodyne	CTRB1	37	40
CC[C@@H](NC(=O)NCc1ncccn1)C(C)(C)c1ccccc1	ZINC000853779573	DG	On-Demand	Anodyne	CELA2A	23	40
COCCn1c(SCC(=O)Nc2ccc(C)c(Cl)c2)nc(O)cc1=O	ZINC000853779575	GE	On-Demand	Anodyne	POLC	78	47
COCCn1c(SCC(=O)Nc2ccc(C)c(Cl)c2)nc(O)cc1=O	ZINC000853779575	GE	On-Demand	Anodyne	ENPP1	73	36
O=C(NCC1CCN(CC2CC2)CC1)N[C@@H](CCO)c1cccs1	ZINC000853779581	FF	On-Demand	Anodyne	CACNA1I	48	33
O=C(NCC1CCN(CC2CC2)CC1)N[C@H](CCO)c1cccs1	ZINC000853779582	FF	On-Demand	Anodyne	CACNA1I	48	33
COCCn1c(SCC(=O)Nc2ccc(OC)c(Cl)c2)nc(O)cc1=O	ZINC000853779585	GD	On-Demand	Anodyne	GRM4	22	47
COCCn1c(SCC(=O)Nc2ccc(OC)c(Cl)c2)nc(O)cc1=O	ZINC000853779585	GD	On-Demand	Anodyne	ENPP1	87	42
CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2)c1ccncc1	ZINC000853779589	FG	On-Demand	Anodyne	GPR119	31	40
O=C(NCCc1nnc(S)n1C1CC1)N[C@H](CCO)c1ccccc1	ZINC000853779611	FD	On-Demand	Anodyne	CCR5	19	40
COC(=O)N(C)CCNC(=O)N[C@H](CCO)c1ccccc1	ZINC000853779618	DD	On-Demand	Anodyne	UTS2	70	42
C#CCCN(CCOC)C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000853779636	DE	On-Demand	Mild	UTS2	47	36
C#CCCN(CCOC)C(=O)N[C@H](CCCO)c1ccccc1	ZINC000853779637	DE	On-Demand	Mild	UTS2	47	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853779681	FE	On-Demand	Anodyne	CPT1A	130	45
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853779682	FE	On-Demand	Anodyne	CPT1A	130	45
CCO[C@@H]1C[C@@H](NC(=O)NCc2nc(-c3ccccc3)n[nH]2)C1	ZINC000853779699	DD	On-Demand	Anodyne	TIMP3	57	34
COCCn1c(SCC(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)nc(O)cc1=O	ZINC000853779720	JH	On-Demand	Anodyne	APP	18	43
COCCn1c(SCC(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)nc(O)cc1=O	ZINC000853779720	JH	On-Demand	Anodyne	ENPP1	44	31
COCCn1c(SCC(=O)Nc2ccc(OC)cc2)nc(O)cc1=O	ZINC000853779739	FD	On-Demand	Anodyne	ENPP1	76	37
COCCn1c(SCC(=O)Nc2ccc(C(C)C)cc2)nc(O)cc1=O	ZINC000853779761	GE	On-Demand	Anodyne	ENPP1	71	34
COCCn1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nc(O)cc1=O	ZINC000853779764	HF	On-Demand	Anodyne	FAS	19	40
CC[C@@H](NC(=O)NCCN(C)OC)C(C)(C)c1ccccc1	ZINC000853779790	DF	On-Demand	Anodyne	AMY2	57	36
COCCn1c(SCC(=O)Nc2ccc(SC(F)F)cc2)nc(O)cc1=O	ZINC000853779797	HF	On-Demand	Anodyne	ENPP1	67	32
N#Cc1ccc(CCSCCCN2CCOC2=O)cc1	ZINC000853779811	CF	On-Demand	Mild	KCNJ1	19	43
COCCn1c(SCC(=O)Nc2ccc(Cl)c(Cl)c2)nc(O)cc1=O	ZINC000853779836	HF	On-Demand	Anodyne	ENPP1	75	37
COCCn1c(SCC(=O)Nc2ccc(Cl)c(Cl)c2)nc(O)cc1=O	ZINC000853779836	HF	On-Demand	Anodyne	IMDH_CRYPV	23	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CCN(CC2CC2)CC1	ZINC000853779888	FE	On-Demand	Anodyne	SIGMAR1	15	46
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CCN(CC2CC2)CC1	ZINC000853779888	FE	On-Demand	Anodyne	CPT1A	40	37
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CCN(CC2CC2)CC1	ZINC000853779888	FE	On-Demand	Anodyne	CACNA1I	56	34
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CCN(CC2CC2)CC1	ZINC000853779888	FE	On-Demand	Anodyne	VCP	54	35
COCCn1c(SCC(=O)N2CCC(Cc3ccccc3)CC2)nc(O)cc1=O	ZINC000853779892	HE	On-Demand	Anodyne	GRIN2B	78	39
COCCn1c(SCC(=O)N2CCC(Cc3ccccc3)CC2)nc(O)cc1=O	ZINC000853779892	HE	On-Demand	Anodyne	CCR3	24	41
COCCn1c(SCC(=O)Nc2ccc(OCc3ccccc3)cc2)nc(O)cc1=O	ZINC000853779903	IF	On-Demand	Anodyne	TSHR	59	39
COCCn1c(SCC(=O)Nc2ccc(OCc3ccccc3)cc2)nc(O)cc1=O	ZINC000853779903	IF	On-Demand	Anodyne	LTA4H	22	46
COCCn1c(SCC(=O)Nc2ccc(OCc3ccccc3)cc2)nc(O)cc1=O	ZINC000853779903	IF	On-Demand	Anodyne	ADORA2B	30	40
COCCn1c(SCC(=O)Nc2ccc(OCc3ccccc3)cc2)nc(O)cc1=O	ZINC000853779903	IF	On-Demand	Anodyne	ENPP1	69	34
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779907	GG	On-Demand	Clean	EDNRB	25	42
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779907	GG	On-Demand	Clean	EDNRA	17	42
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779907	GG	On-Demand	Clean	CCR5	17	47
COc1ccc(N2CC[C@H](NC(=O)N[C@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779907	GG	On-Demand	Clean	MTNR1B	16	45
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779912	GG	On-Demand	Clean	EDNRB	25	42
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779912	GG	On-Demand	Clean	EDNRA	17	42
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779912	GG	On-Demand	Clean	CCR5	17	47
COc1ccc(N2CC[C@H](NC(=O)N[C@@H](CCCO)c3ccccc3)C2)cc1	ZINC000853779912	GG	On-Demand	Clean	MTNR1B	16	45
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC(c2ccon2)CC1	ZINC000853779925	FF	On-Demand	Anodyne	EPHX2	15	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC(c2ccon2)CC1	ZINC000853779925	FF	On-Demand	Anodyne	SMO	39	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC(c2ccon2)CC1	ZINC000853779925	FF	On-Demand	Anodyne	ETHR	32	40
COCCn1c(SCc2ccc(Cl)c(Cl)c2)nc(O)cc1=O	ZINC000853780006	FG	On-Demand	Anodyne	POLC	18	43
COCCn1c(SCc2ccc(Cl)c(Cl)c2)nc(O)cc1=O	ZINC000853780006	FG	On-Demand	Anodyne	DNAE	47	35
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CCC(O)CC1	ZINC000853780015	ED	On-Demand	Anodyne	F11	15	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)NCC1CCC(O)CC1	ZINC000853780015	ED	On-Demand	Anodyne	VCP	64	39
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853780024	FF	On-Demand	Anodyne	CPT1A	49	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC([C@H]2CCCCO2)CC1	ZINC000853780026	FF	On-Demand	Anodyne	CPT1A	49	36
COCCn1c(SCC(=O)Nc2cccc(OC)c2)nc(O)cc1=O	ZINC000853780047	FD	On-Demand	Anodyne	MTNR1A	17	43
COCCn1c(SCC(=O)Nc2cccc(OC)c2)nc(O)cc1=O	ZINC000853780047	FD	On-Demand	Anodyne	MTNR1B	21	43
COCCn1c(SCC(=O)Nc2cccc(OC)c2)nc(O)cc1=O	ZINC000853780047	FD	On-Demand	Anodyne	TAAR1	30	40
COCCn1c(SCC(=O)Nc2cccc(OC)c2)nc(O)cc1=O	ZINC000853780047	FD	On-Demand	Anodyne	ENPP1	74	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCN([C@H]2CCOC2)CC1	ZINC000853780055	FD	On-Demand	Anodyne	MTOR	42	34
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCN([C@@H]2CCOC2)CC1	ZINC000853780057	FD	On-Demand	Anodyne	MTOR	42	34
COC[C@H](NC(=O)N[C@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780062	FF	On-Demand	Anodyne	ROCK1	18	48
COC[C@H](NC(=O)N[C@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780062	FF	On-Demand	Anodyne	ROCK2	16	48
COC[C@H](NC(=O)N[C@@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780063	FF	On-Demand	Anodyne	ROCK1	18	48
COC[C@H](NC(=O)N[C@@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780063	FF	On-Demand	Anodyne	ROCK2	16	48
COC[C@@H](NC(=O)N[C@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780065	FF	On-Demand	Anodyne	ROCK1	18	48
COC[C@@H](NC(=O)N[C@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780065	FF	On-Demand	Anodyne	ROCK2	16	48
COC[C@@H](NC(=O)N[C@@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780067	FF	On-Demand	Anodyne	ROCK1	18	48
COC[C@@H](NC(=O)N[C@@H](CCO)c1cccs1)c1cccc(OC)c1	ZINC000853780067	FF	On-Demand	Anodyne	ROCK2	16	48
CN(CC(=O)N1CCCC1)C(=O)NCc1nc(-c2ccccc2)n[nH]1	ZINC000853780092	ED	On-Demand	Anodyne	CPT1A	81	41
C#CCCN(CCOC)C(=O)NCc1cccnc1Oc1cccc(OC)c1	ZINC000853780111	GG	On-Demand	Mild	MTNR1B	15	40
CC[C@@H](NC(=O)NCc1nc(-c2ccccc2)n[nH]1)C1CC1	ZINC000853780153	CE	On-Demand	Anodyne	TACR3	52	34
COCCn1c(SCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)nc(O)cc1=O	ZINC000853780159	IF	On-Demand	Anodyne	RAF1	27	40
COCCn1c(SCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)nc(O)cc1=O	ZINC000853780159	IF	On-Demand	Anodyne	ENPP1	68	34
COCCn1c(SCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)nc(O)cc1=O	ZINC000853780159	IF	On-Demand	Anodyne	IMDH_CRYPV	23	47
COCCn1c(SCC(=O)NCc2ccc(Cl)cc2)nc(O)cc1=O	ZINC000853780207	GD	On-Demand	Anodyne	UL54	74	35
COCCn1c(SCC(=O)Nc2cccc(C(F)(F)F)c2)nc(O)cc1=O	ZINC000853780210	HE	On-Demand	Anodyne	KDR	15	41
COCCn1c(SCC(=O)Nc2cccc(C(F)(F)F)c2)nc(O)cc1=O	ZINC000853780210	HE	On-Demand	Anodyne	ENPP1	61	32
CCC(CC)CSCCCNC(=O)C(F)(F)F	ZINC000853780214	CG	On-Demand	Anodyne	EST1_PIG	51	38
C#CCCN(CCOC)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853780219	FD	On-Demand	Mild	HTR1A	21	40
C#CCCN(CCOC)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853780219	FD	On-Demand	Mild	DRD2	15	40
C#CCCN(CCOC)C(=O)N[C@@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853780219	FD	On-Demand	Mild	P2RX3	22	40
C#CCCN(CCOC)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853780220	FD	On-Demand	Mild	HTR1A	21	40
C#CCCN(CCOC)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853780220	FD	On-Demand	Mild	DRD2	15	40
C#CCCN(CCOC)C(=O)N[C@H](C)CN1CCN(c2ccccc2)CC1	ZINC000853780220	FD	On-Demand	Mild	P2RX3	22	40
COCCn1c(SCC(=O)Nc2ccc(F)c(F)c2)nc(O)cc1=O	ZINC000853780236	FD	On-Demand	Anodyne	ENPP1	74	35
CON(C)CCNC(=O)N[C@@H](CCCO)c1ccccc1	ZINC000853780270	CD	On-Demand	Anodyne	UTS2	70	42
CON(C)CCNC(=O)N[C@H](CCCO)c1ccccc1	ZINC000853780271	CD	On-Demand	Anodyne	UTS2	70	42
COCCN(CCF)C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000853780276	DE	On-Demand	Anodyne	UTS2	62	38
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCc2nc(-c3ccccc3)n[nH]2)C1	ZINC000853780324	ED	On-Demand	Anodyne	VCP	43	32
O=C(NC[C@@H](O)c1cccc2ccccc12)N[C@@H](CCCO)c1ccccc1	ZINC000853780356	GH	On-Demand	Anodyne	SOAT1	28	44
O=C(NC[C@@H](O)c1cccc2ccccc12)N[C@H](CCCO)c1ccccc1	ZINC000853780357	GH	On-Demand	Anodyne	SOAT1	28	44
O=C(NC[C@H](O)c1cccc2ccccc12)N[C@@H](CCCO)c1ccccc1	ZINC000853780358	GH	On-Demand	Anodyne	SOAT1	28	44
O=C(NC[C@H](O)c1cccc2ccccc12)N[C@H](CCCO)c1ccccc1	ZINC000853780359	GH	On-Demand	Anodyne	SOAT1	28	44
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC1CCN([C@H]2CCOC2)CC1	ZINC000853780364	FD	On-Demand	Anodyne	MTOR	43	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC1CCN([C@@H]2CCOC2)CC1	ZINC000853780365	FD	On-Demand	Anodyne	MTOR	43	36
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853780380	GF	On-Demand	Anodyne	CCR5	15	40
N#Cc1ccc(CCNC(=O)N[C@@H](CCO)c2cccs2)cc1	ZINC000853780401	EF	On-Demand	Mild	CTSC	40	39
N#Cc1ccc(CCNC(=O)N[C@H](CCO)c2cccs2)cc1	ZINC000853780402	EF	On-Demand	Mild	CTSC	40	39
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853780416	FD	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853780417	FD	On-Demand	Anodyne	L3MBTL3	41	34
COC[C@H](NC(=O)NCc1nc(-c2ccccc2)n[nH]1)c1cccc(OC)c1	ZINC000853780458	GF	On-Demand	Anodyne	ROCK1	36	44
COC[C@H](NC(=O)NCc1nc(-c2ccccc2)n[nH]1)c1cccc(OC)c1	ZINC000853780458	GF	On-Demand	Anodyne	TACR3	39	44
COC[C@H](NC(=O)NCc1nc(-c2ccccc2)n[nH]1)c1cccc(OC)c1	ZINC000853780458	GF	On-Demand	Anodyne	ROCK2	37	44
COC[C@@H](NC(=O)NCc1nc(-c2ccccc2)n[nH]1)c1cccc(OC)c1	ZINC000853780459	GF	On-Demand	Anodyne	ROCK1	36	44
COC[C@@H](NC(=O)NCc1nc(-c2ccccc2)n[nH]1)c1cccc(OC)c1	ZINC000853780459	GF	On-Demand	Anodyne	TACR3	39	44
COC[C@@H](NC(=O)NCc1nc(-c2ccccc2)n[nH]1)c1cccc(OC)c1	ZINC000853780459	GF	On-Demand	Anodyne	ROCK2	37	44
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853780474	FF	On-Demand	Anodyne	GRIN2B	25	40
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853780474	FF	On-Demand	Anodyne	CPT1A	75	39
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853780474	FF	On-Demand	Anodyne	EPHX2	27	48
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853780475	FE	On-Demand	Anodyne	CCR3	53	37
O=C(NCc1nc(-c2ccccc2)n[nH]1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853780476	FE	On-Demand	Anodyne	CCR3	53	37
CSC[C@@H](CCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853780516	GF	On-Demand	Anodyne	PDS	57	33
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853780539	GD	On-Demand	Anodyne	PIK3CA	26	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853780539	GD	On-Demand	Anodyne	MTOR	50	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853780539	GD	On-Demand	Anodyne	PIK3CG	15	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853780539	GD	On-Demand	Anodyne	L3MBTL3	70	38
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853780540	GD	On-Demand	Anodyne	PIK3CA	26	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853780540	GD	On-Demand	Anodyne	MTOR	50	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853780540	GD	On-Demand	Anodyne	PIK3CG	15	41
O=C(NCc1nc(-c2ccccc2)n[nH]1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853780540	GD	On-Demand	Anodyne	L3MBTL3	70	38
COCCn1c(SCC(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)nc(O)cc1=O	ZINC000853780543	JC	On-Demand	Anodyne	NR1H4	22	50
COCCn1c(SCC(=O)Nc2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)nc(O)cc1=O	ZINC000853780543	JC	On-Demand	Anodyne	ENPP1	61	33
CCN1CCC[C@@H]1CNC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853780550	FF	On-Demand	Anodyne	DRD2	34	46
CCN1CCC[C@@H]1CNC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853780551	FF	On-Demand	Anodyne	DRD2	34	46
CCN1CCC[C@H]1CNC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853780552	FF	On-Demand	Anodyne	DRD2	34	46
CCN1CCC[C@H]1CNC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853780553	FF	On-Demand	Anodyne	DRD2	34	46
COCCn1c(SCC(=O)Nc2ccc(OC)c(OC)c2)nc(O)cc1=O	ZINC000853780566	GD	On-Demand	Anodyne	ENPP1	103	49
COCCn1c(SCC(=O)NC2CCCCCC2)nc(O)cc1=O	ZINC000853780593	FD	On-Demand	Anodyne	CNR2	23	42
CCN1CCC[C@@H]1CNC(=O)NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853780619	DD	On-Demand	Anodyne	DRD2	31	41
CCN1CCC[C@H]1CNC(=O)NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853780620	DD	On-Demand	Anodyne	DRD2	31	41
CCN1CCC[C@@H]1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853780627	EE	On-Demand	Clean	DRD2	37	44
CCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853780628	EE	On-Demand	Clean	DRD2	37	44
CCN1CCC[C@H]1CNC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853780629	EE	On-Demand	Clean	DRD2	37	44
CCN1CCC[C@H]1CNC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853780630	EE	On-Demand	Clean	DRD2	37	44
O=C(NCCCSCC1=NS(=O)(=O)c2ccccc21)C(F)(F)F	ZINC000853780681	FD	On-Demand	Anodyne	KCNA3	18	41
CCN1CCC[C@@H]1CNC(=O)NNC(=O)CCCNC(=O)C(C)(C)C	ZINC000853780692	FC	On-Demand	Reactive	DRD2	31	41
CCN1CCC[C@H]1CNC(=O)NNC(=O)CCCNC(=O)C(C)(C)C	ZINC000853780693	FC	On-Demand	Reactive	DRD2	31	41
CC[C@@H](C)c1ccc(NC(=O)CSc2nc(O)cc(=O)n2CCOC)cc1	ZINC000853780705	GF	On-Demand	Anodyne	ENPP1	68	32
COCCn1c(SCC(=O)NCc2ccc3c(c2)OCO3)nc(O)cc1=O	ZINC000853780732	GC	On-Demand	Anodyne	BMP1	49	36
COCCn1c(SCC(=O)NCc2ccc3c(c2)OCO3)nc(O)cc1=O	ZINC000853780732	GC	On-Demand	Anodyne	NOS2	100	40
COCCn1c(SCC(=O)NCc2ccc3c(c2)OCO3)nc(O)cc1=O	ZINC000853780732	GC	On-Demand	Anodyne	MCHR1	19	42
CCN1CCC[C@@H]1CNC(=O)N1CCn2ncc(Br)c2C1	ZINC000853780748	FD	On-Demand	Anodyne	DRD2	33	45
CCN1CCC[C@H]1CNC(=O)N1CCn2ncc(Br)c2C1	ZINC000853780749	FD	On-Demand	Anodyne	DRD2	33	45
CCN1CCC[C@H]1CNC(=O)NCCc1nnc(S)n1C	ZINC000853780756	DC	On-Demand	Anodyne	DRD2	31	42
CCN1CCC[C@@H]1CNC(=O)NCCc1nnc(S)n1C	ZINC000853780757	DC	On-Demand	Anodyne	DRD2	31	42
COCCn1c(SCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)nc(O)cc1=O	ZINC000853780831	IH	On-Demand	Clean	ENPP1	68	32
COCCn1c(SCC(=O)Nc2ccc(N=Nc3ccccc3)cc2)nc(O)cc1=O	ZINC000853780831	IH	On-Demand	Clean	SLC27A1	17	41
COCCn1c(SCC(=O)Nc2cccc(SC)c2)nc(O)cc1=O	ZINC000853780842	GE	On-Demand	Anodyne	ENPP1	73	36
CCC[C@@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780843	DF	On-Demand	Anodyne	MME	47	38
CCC[C@@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780843	DF	On-Demand	Anodyne	PAPA1_CARPA	55	35
CCC[C@@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780843	DF	On-Demand	Anodyne	CAPNS1	58	36
CCC[C@@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780843	DF	On-Demand	Anodyne	MMP3	49	36
CCC[C@@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780843	DF	On-Demand	Anodyne	CAPN1	56	38
CCC[C@@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780843	DF	On-Demand	Anodyne	CAPN2	87	38
CCC[C@@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780843	DF	On-Demand	Anodyne	NPR	76	39
CCC[C@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780844	DF	On-Demand	Anodyne	MME	47	38
CCC[C@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780844	DF	On-Demand	Anodyne	PAPA1_CARPA	55	35
CCC[C@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780844	DF	On-Demand	Anodyne	CAPNS1	58	36
CCC[C@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780844	DF	On-Demand	Anodyne	MMP3	49	36
CCC[C@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780844	DF	On-Demand	Anodyne	CAPN1	56	38
CCC[C@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780844	DF	On-Demand	Anodyne	CAPN2	87	38
CCC[C@H](CCc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853780844	DF	On-Demand	Anodyne	NPR	76	39
O=C(CSCC1=NS(=O)(=O)c2ccccc21)NCCCc1ccccc1	ZINC000853780865	GF	On-Demand	Anodyne	KCNA3	17	48
C[C@@H](O)CC(C)(C)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853780866	FG	On-Demand	Reactive	CSNK1D	43	44
CCN1CCC[C@@H]1CNC(=O)NNC(=O)c1cn(C)nn1	ZINC000853780882	CB	On-Demand	Reactive	DRD2	37	47
CCN1CCC[C@H]1CNC(=O)NNC(=O)c1cn(C)nn1	ZINC000853780883	CB	On-Demand	Reactive	DRD2	37	47
CCN(CC)S(=O)(=O)c1cc(NC(=O)CSc2nc(O)cc(=O)n2CCOC)ccc1C	ZINC000853780884	JD	On-Demand	Anodyne	ENPP1	66	32
CCN1CCC[C@H]1CNC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853780889	GG	On-Demand	Anodyne	DRD2	32	40
CCN1CCC[C@@H]1CNC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853780890	GG	On-Demand	Anodyne	DRD2	32	40
CCN1CCC[C@@H]1CNC(=O)NCCCc1nc[nH]n1	ZINC000853780912	CC	On-Demand	Anodyne	DRD2	34	42
CCN1CCC[C@H]1CNC(=O)NCCCc1nc[nH]n1	ZINC000853780913	CC	On-Demand	Anodyne	DRD2	34	42
CON(C)CCNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780923	EE	On-Demand	Anodyne	DRD2	21	41
CON(C)CCNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780923	EE	On-Demand	Anodyne	SLC6A1	43	35
CON(C)CCNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780923	EE	On-Demand	Anodyne	DRD3	31	41
CON(C)CCNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780923	EE	On-Demand	Anodyne	KCNQ2	63	37
CON(C)CCNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780924	EE	On-Demand	Anodyne	DRD2	21	41
CON(C)CCNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780924	EE	On-Demand	Anodyne	SLC6A1	43	35
CON(C)CCNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780924	EE	On-Demand	Anodyne	DRD3	31	41
CON(C)CCNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853780924	EE	On-Demand	Anodyne	KCNQ2	63	37
COCCn1c(SCC(=O)Nc2ccc(C(=O)OC)cc2)nc(O)cc1=O	ZINC000853780970	GD	On-Demand	Anodyne	ENPP1	70	34
COCCn1c(SCC(=O)Nc2ccc(C(=O)OC)cc2)nc(O)cc1=O	ZINC000853780970	GD	On-Demand	Anodyne	SLC27A1	17	46
CCN1CCC[C@H]1CNC(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1	ZINC000853780974	FF	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1	ZINC000853780975	FF	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853780976	ED	On-Demand	Anodyne	DRD2	30	41
CCN1CCC[C@H]1CNC(=O)NCCc1nnc(S)n1C1CC1	ZINC000853780977	ED	On-Demand	Anodyne	DRD2	30	41
COCCn1c(SCC(=O)NC2CCCCCCC2)nc(O)cc1=O	ZINC000853780978	FD	On-Demand	Anodyne	CNR2	23	42
CCC[C@@H](CCc1ccccc1)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853780983	GH	On-Demand	Anodyne	CAPN2	48	35
CCC[C@H](CCc1ccccc1)NC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853780984	GH	On-Demand	Anodyne	CAPN2	48	35
COCCn1c(SCC(=O)Nc2ccc(Oc3ccccc3)cc2)nc(O)cc1=O	ZINC000853781023	IG	On-Demand	Anodyne	ENPP1	69	33
COCCn1c(SCC(=O)Nc2cccc(NC(C)=O)c2)nc(O)cc1=O	ZINC000853781029	GD	On-Demand	Anodyne	ENPP1	71	34
O=C(NCCCOC1CCOCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853781030	GG	On-Demand	Reactive	CSNK1D	28	40
COCCn1c(SCC(=O)Nc2ccc(OC)cc2OC)nc(O)cc1=O	ZINC000853781031	GD	On-Demand	Anodyne	ENPP1	68	32
COCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)nc(O)cc1=O	ZINC000853781055	HD	On-Demand	Bother	KCNMA1	21	46
COCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)nc(O)cc1=O	ZINC000853781055	HD	On-Demand	Bother	ENPP1	54	30
CN1CCC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)[C@H]1c1cccs1	ZINC000853781062	GI	On-Demand	Reactive	CACNA1I	45	34
CN1CCC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)[C@@H]1c1cccs1	ZINC000853781064	GI	On-Demand	Reactive	CACNA1I	45	34
CO[C@@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)[C@H]1CCOC1	ZINC000853781080	FI	On-Demand	Anodyne	MTOR	62	35
CO[C@@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)[C@H]1CCOC1	ZINC000853781080	FI	On-Demand	Anodyne	ENPP1	54	32
CO[C@@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)[C@@H]1CCOC1	ZINC000853781081	FI	On-Demand	Anodyne	MTOR	62	35
CO[C@@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)[C@@H]1CCOC1	ZINC000853781081	FI	On-Demand	Anodyne	ENPP1	54	32
CCN1CCC[C@H]1CNC(=O)NCCS(=O)(=O)CC(F)(F)F	ZINC000853781105	EC	On-Demand	Anodyne	DRD2	30	40
CCN1CCC[C@@H]1CNC(=O)NCCS(=O)(=O)CC(F)(F)F	ZINC000853781106	EC	On-Demand	Anodyne	DRD2	30	40
CCN1CCC[C@@H]1CNC(=O)N1CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000853781130	FE	On-Demand	Anodyne	DRD2	31	41
CCN1CCC[C@H]1CNC(=O)N1CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000853781131	FE	On-Demand	Anodyne	DRD2	31	41
CO[C@@H](CSCC(=O)Nc1ccc2ccccc2c1)[C@@H]1CCOC1	ZINC000853781140	EH	On-Demand	Anodyne	ENPP1	73	36
CO[C@@H](CSCC(=O)Nc1ccc2ccccc2c1)[C@H]1CCOC1	ZINC000853781143	EH	On-Demand	Anodyne	ENPP1	73	36
COCCn1c(SCC(=O)Nc2ccccc2OC)nc(O)cc1=O	ZINC000853781148	FD	On-Demand	Anodyne	ENPP1	70	33
COCCn1c(SCC(=O)Nc2ccccc2OC)nc(O)cc1=O	ZINC000853781148	FD	On-Demand	Anodyne	FAS	45	37
COCCn1c(SCC(=O)Nc2ccccc2)nc(O)cc1=O	ZINC000853781149	ED	On-Demand	Anodyne	ENPP1	70	33
COCCn1c(SCC(=O)Nc2ccccc2)nc(O)cc1=O	ZINC000853781149	ED	On-Demand	Anodyne	SLC27A1	18	42
COCCCNC(=O)[C@@H](C)SCC1=NS(=O)(=O)c2ccccc21	ZINC000853781197	FD	On-Demand	Anodyne	KCNA3	18	41
COCCCNC(=O)[C@H](C)SCC1=NS(=O)(=O)c2ccccc21	ZINC000853781198	FD	On-Demand	Anodyne	KCNA3	18	41
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)nc(O)cc1=O	ZINC000853781213	IH	On-Demand	Anodyne	PDGFRB	23	40
COCCn1c(S[C@H](C)C(=O)Nc2ccc(Oc3ccccc3)cc2)nc(O)cc1=O	ZINC000853781214	IH	On-Demand	Anodyne	PDGFRB	23	40
O=C(CCSCC1=NS(=O)(=O)c2ccccc21)NC1CCCC1	ZINC000853781228	FE	On-Demand	Anodyne	TNKS	64	34
COCCn1c(SCC(=O)Nc2cc(OC)c(OC)c(OC)c2)nc(O)cc1=O	ZINC000853781246	ID	On-Demand	Anodyne	ENPP1	78	38
COCCn1c(SCC(=O)Nc2cccc(Oc3ccccc3)c2)nc(O)cc1=O	ZINC000853781271	IG	On-Demand	Anodyne	ENPP1	62	32
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781280	FF	On-Demand	Mild	DRD3	18	40
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781280	FF	On-Demand	Mild	KCNQ2	47	34
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781281	FF	On-Demand	Mild	DRD3	18	40
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781281	FF	On-Demand	Mild	KCNQ2	47	34
COCCn1c(SCC(=O)Nc2ccc(C(F)(F)F)cc2)nc(O)cc1=O	ZINC000853781298	HE	On-Demand	Anodyne	ENPP1	69	33
CCN1CCC[C@@H]1CNC(=O)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853781306	ED	On-Demand	Anodyne	DRD2	34	43
CCN1CCC[C@H]1CNC(=O)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853781307	ED	On-Demand	Anodyne	DRD2	34	43
CCN1CCC[C@@H]1CNC(=O)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853781308	ED	On-Demand	Anodyne	DRD2	34	43
CCN1CCC[C@H]1CNC(=O)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853781309	ED	On-Demand	Anodyne	DRD2	34	43
COCCn1c(SCC(=O)Nc2ccc(C(C)=O)cc2)nc(O)cc1=O	ZINC000853781322	GD	On-Demand	Anodyne	ENPP1	71	35
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000853781330	GE	On-Demand	Anodyne	PIK3CA	40	39
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1	ZINC000853781330	GE	On-Demand	Anodyne	MTOR	88	39
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1	ZINC000853781331	GE	On-Demand	Anodyne	PIK3CA	40	39
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1	ZINC000853781331	GE	On-Demand	Anodyne	MTOR	88	39
COCCn1c(SCC(=O)Nc2ccccc2C(=O)OC)nc(O)cc1=O	ZINC000853781358	GD	On-Demand	Anodyne	FAS	73	53
CCN1CCC[C@@H]1CNC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853781364	ED	On-Demand	Anodyne	DRD2	30	40
CCN1CCC[C@H]1CNC(=O)NCCc1nnc(S)n1C(C)C	ZINC000853781365	ED	On-Demand	Anodyne	DRD2	30	40
CCN1CCC[C@H]1CNC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C	ZINC000853781366	FE	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C	ZINC000853781367	FE	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)NC[C@H](O)c1cccc2ccccc12	ZINC000853781368	EF	On-Demand	Anodyne	DRD2	35	42
CCN1CCC[C@H]1CNC(=O)NC[C@H](O)c1cccc2ccccc12	ZINC000853781369	EF	On-Demand	Anodyne	DRD2	35	42
CCN1CCC[C@H]1CNC(=O)NC[C@@H](O)c1cccc2ccccc12	ZINC000853781370	EF	On-Demand	Anodyne	DRD2	35	42
CCN1CCC[C@@H]1CNC(=O)NC[C@@H](O)c1cccc2ccccc12	ZINC000853781371	EF	On-Demand	Anodyne	DRD2	35	42
COCCn1c(SCC(=O)Nc2ccccc2C(C)C)nc(O)cc1=O	ZINC000853781372	GE	On-Demand	Anodyne	FAS	41	36
CCCCCNC(=O)CSCC1=NS(=O)(=O)c2ccccc21	ZINC000853781389	EE	On-Demand	Anodyne	KCNA3	16	42
CCCCCNC(=O)CSCC1=NS(=O)(=O)c2ccccc21	ZINC000853781389	EE	On-Demand	Anodyne	ASAH1	44	34
CCC[C@@H](CCc1ccccc1)NC(=O)NCCc1nnc(S)n1CC	ZINC000853781414	GG	On-Demand	Anodyne	CAPN2	50	36
CCC[C@H](CCc1ccccc1)NC(=O)NCCc1nnc(S)n1CC	ZINC000853781415	GG	On-Demand	Anodyne	CAPN2	50	36
COCCn1c(SCC(=O)Nc2ccccc2-c2ccccc2)nc(O)cc1=O	ZINC000853781416	HF	On-Demand	Anodyne	FAS	44	38
COCCn1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nc(O)cc1=O	ZINC000853781417	GD	On-Demand	Bother	CACNA1D	45	32
COCCn1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nc(O)cc1=O	ZINC000853781418	GD	On-Demand	Bother	CACNA1D	45	32
COCCn1c(SCC(=O)Nc2ccc(C)c(F)c2)nc(O)cc1=O	ZINC000853781442	FD	On-Demand	Anodyne	ENPP1	72	36
C[C@H](SCC1=NS(=O)(=O)c2ccccc21)C(=O)NCCc1ccccc1	ZINC000853781450	GF	On-Demand	Anodyne	AMP1_PLAFQ	20	40
COCCn1c(SCC(=O)Nc2ccc(-c3ccccc3)cc2)nc(O)cc1=O	ZINC000853781463	HF	On-Demand	Anodyne	ENPP1	70	33
COCCn1c(SCC(=O)Nc2ccc(-c3ccccc3)cc2)nc(O)cc1=O	ZINC000853781463	HF	On-Demand	Anodyne	SLC27A1	17	40
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781490	FF	On-Demand	Anodyne	DRD2	20	41
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781490	FF	On-Demand	Anodyne	SLC6A1	48	34
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781490	FF	On-Demand	Anodyne	DRD3	23	41
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781490	FF	On-Demand	Anodyne	KCNQ2	65	35
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853781490	FF	On-Demand	Anodyne	ACKR3	61	30
CCN1CCC[C@@H]1CNC(=O)N1CCC2=C(CCC(=O)N2)C1	ZINC000853781500	DD	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@H]1CNC(=O)N1CCC2=C(CCC(=O)N2)C1	ZINC000853781501	DD	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@H]1CNC(=O)NNC(=O)c1cccc(F)n1	ZINC000853781525	DC	On-Demand	Reactive	DRD2	37	45
CCN1CCC[C@@H]1CNC(=O)NNC(=O)c1cccc(F)n1	ZINC000853781526	DC	On-Demand	Reactive	DRD2	37	45
COCCn1c(SCC(=O)N2c3ccccc3C[C@H]2C)nc(O)cc1=O	ZINC000853781528	GD	On-Demand	Anodyne	DRD4	22	44
COCCn1c(SCC(=O)N2c3ccccc3C[C@@H]2C)nc(O)cc1=O	ZINC000853781529	GD	On-Demand	Anodyne	DRD4	22	44
CCN1CCC[C@@H]1CNC(=O)NCCN(C)C(=O)OC	ZINC000853781539	CC	On-Demand	Anodyne	DRD2	34	44
CCN1CCC[C@H]1CNC(=O)NCCN(C)C(=O)OC	ZINC000853781540	CC	On-Demand	Anodyne	DRD2	34	44
CCN1CCC[C@@H]1CNC(=O)NCCc1nnc(S)n1CC	ZINC000853781544	EC	On-Demand	Anodyne	DRD2	31	42
CCN1CCC[C@H]1CNC(=O)NCCc1nnc(S)n1CC	ZINC000853781545	EC	On-Demand	Anodyne	DRD2	31	42
CCN1CCC[C@@H]1CNC(=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853781549	DC	On-Demand	Anodyne	DRD2	32	45
CCN1CCC[C@@H]1CNC(=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853781550	DC	On-Demand	Anodyne	DRD2	32	45
CCN1CCC[C@H]1CNC(=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853781551	DC	On-Demand	Anodyne	DRD2	32	45
CCN1CCC[C@H]1CNC(=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853781552	DC	On-Demand	Anodyne	DRD2	32	45
CCN1CCC[C@@H]1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853781561	FD	On-Demand	Clean	DRD2	33	41
CCN1CCC[C@H]1CNC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853781563	FD	On-Demand	Clean	DRD2	33	41
CCN1CCC[C@@H]1CNC(=O)NCc1ccc(Cl)c(C(=O)OC)n1	ZINC000853781581	FD	On-Demand	Anodyne	DRD2	34	48
CCN1CCC[C@H]1CNC(=O)NCc1ccc(Cl)c(C(=O)OC)n1	ZINC000853781583	FD	On-Demand	Anodyne	DRD2	34	48
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853781594	JC	On-Demand	Anodyne	TGM2	41	35
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853781594	JC	On-Demand	Anodyne	F13A1	58	36
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853781594	JC	On-Demand	Anodyne	MERTK	30	40
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853781594	JC	On-Demand	Anodyne	ENPP1	50	31
COCCn1c(SCC(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853781594	JC	On-Demand	Anodyne	NAMPT	22	42
COCCn1c(SCC(=O)Nc2cc3oc4ccccc4c3cc2OC)nc(O)cc1=O	ZINC000853781628	JG	On-Demand	Anodyne	ENPP1	55	31
COCCn1c(SCC(=O)Nc2cc3oc4ccccc4c3cc2OC)nc(O)cc1=O	ZINC000853781628	JG	On-Demand	Anodyne	FAS	40	35
CCCCNC(=O)CSCC1=NS(=O)(=O)c2ccccc21	ZINC000853781629	ED	On-Demand	Anodyne	KCNA3	17	43
CCCCNC(=O)CCSCC1=NS(=O)(=O)c2ccccc21	ZINC000853781632	EE	On-Demand	Anodyne	KCNA3	16	42
COCCn1c(SCC(=O)Nc2cccc(F)c2)nc(O)cc1=O	ZINC000853781653	FD	On-Demand	Anodyne	ENPP1	69	33
CCN1CCC[C@@H]1CNC(=O)N(CCF)CCOC	ZINC000853781682	CD	On-Demand	Anodyne	DRD2	37	50
CCN1CCC[C@@H]1CNC(=O)N(CCF)CCOC	ZINC000853781682	CD	On-Demand	Anodyne	ACKR3	53	29
CCN1CCC[C@H]1CNC(=O)N(CCF)CCOC	ZINC000853781683	CD	On-Demand	Anodyne	DRD2	37	50
CCN1CCC[C@H]1CNC(=O)N(CCF)CCOC	ZINC000853781683	CD	On-Demand	Anodyne	ACKR3	53	29
CCN1CCC[C@H]1CNC(=O)N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853781693	FD	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853781694	FD	On-Demand	Anodyne	DRD2	31	40
COCCn1c(SCC(=O)Nc2ccccc2Br)nc(O)cc1=O	ZINC000853781704	HE	On-Demand	Anodyne	FAS	60	37
COCCn1c(SCC(=O)N[C@H]2CCCc3ccccc32)nc(O)cc1=O	ZINC000853781715	GD	On-Demand	Anodyne	BDKRB1	51	37
COCCn1c(SCC(=O)N[C@@H]2CCCc3ccccc32)nc(O)cc1=O	ZINC000853781716	GD	On-Demand	Anodyne	BDKRB1	51	37
CCN1CCC[C@H]1CNC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853781727	DD	On-Demand	Anodyne	DRD2	31	46
CCN1CCC[C@@H]1CNC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853781729	DD	On-Demand	Anodyne	DRD2	31	46
COCCn1c(SCC(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)nc(O)cc1=O	ZINC000853781739	JD	On-Demand	Anodyne	NR1H4	18	41
COCCn1c(SCC(=O)Nc2ccc(C)c(S(=O)(=O)N3CCCCC3)c2)nc(O)cc1=O	ZINC000853781739	JD	On-Demand	Anodyne	ENPP1	55	32
CCN1CCC[C@H]1CNC(=O)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853781752	GF	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853781754	GF	On-Demand	Anodyne	DRD2	31	40
COCCn1c(SCC(=O)Nc2ccccc2Sc2ccccc2)nc(O)cc1=O	ZINC000853781760	IG	On-Demand	Anodyne	FAS	53	41
CCN1CCC[C@@H]1CNC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853781814	DD	On-Demand	Anodyne	DRD2	35	44
CCN1CCC[C@H]1CNC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853781816	DD	On-Demand	Anodyne	DRD2	35	44
COCCn1c(SCC(=O)N2N=C(c3ccc(Cl)cc3)C[C@H]2c2ccco2)nc(O)cc1=O	ZINC000853781844	JG	On-Demand	Anodyne	GRIN2D	75	33
COCCn1c(SCC(=O)N2N=C(c3ccc(Cl)cc3)C[C@@H]2c2ccco2)nc(O)cc1=O	ZINC000853781847	JG	On-Demand	Anodyne	GRIN2D	75	33
COCCN(CCF)C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1	ZINC000853781859	FF	On-Demand	Anodyne	ACKR3	63	32
COCCN(CCF)C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1	ZINC000853781860	FF	On-Demand	Anodyne	ACKR3	63	32
COCCN(CCF)C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000853781861	FF	On-Demand	Anodyne	ACKR3	63	32
COCCN(CCF)C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000853781862	FF	On-Demand	Anodyne	ACKR3	63	32
COCCn1c(SCC(=O)NCc2ccc(OC)cc2)nc(O)cc1=O	ZINC000853781864	GD	On-Demand	Anodyne	PROKR1	59	32
COCCn1c(SCC(=O)Nc2ccccc2Sc2ccc(Cl)cc2)nc(O)cc1=O	ZINC000853781875	JI	On-Demand	Anodyne	FAS	47	36
COCCn1c(SCC(=O)Nc2ccc(C#N)cc2)nc(O)cc1=O	ZINC000853781906	FD	On-Demand	Mild	ADORA2B	18	42
COCCn1c(SCC(=O)Nc2ccc(C#N)cc2)nc(O)cc1=O	ZINC000853781906	FD	On-Demand	Mild	ENPP1	69	35
COCCn1c(S[C@@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)nc(O)cc1=O	ZINC000853781911	JD	On-Demand	Anodyne	FPR2	49	38
COCCn1c(S[C@H](C)C(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)nc(O)cc1=O	ZINC000853781913	JD	On-Demand	Anodyne	FPR2	49	38
COCCn1c(SCC(=O)Nc2cc(Cl)ccc2OC)nc(O)cc1=O	ZINC000853781914	GD	On-Demand	Anodyne	CPT1A	43	30
COCCn1c(SCC(=O)Nc2cc(Cl)ccc2OC)nc(O)cc1=O	ZINC000853781914	GD	On-Demand	Anodyne	ENPP1	72	37
C[C@@H]1Cc2ccccc2N1C(=O)CSCC1=NS(=O)(=O)c2ccccc21	ZINC000853781917	GF	On-Demand	Anodyne	DRD4	24	44
C[C@@H]1Cc2ccccc2N1C(=O)CSCC1=NS(=O)(=O)c2ccccc21	ZINC000853781917	GF	On-Demand	Anodyne	TPP2	56	34
O=C(NCCCOC1CCOCC1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853781927	GF	On-Demand	Anodyne	ADRB1	18	41
O=C(NCCCOC1CCOCC1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853781929	GF	On-Demand	Anodyne	ADRB1	18	41
O=C(CSCc1ccsc1Cl)Nc1ccc(N2CCOCC2)cc1	ZINC000853781983	GI	On-Demand	Anodyne	MTOR	48	38
O=C(CSCc1ccsc1Cl)Nc1ccc(N2CCOCC2)cc1	ZINC000853781983	GI	On-Demand	Anodyne	PIK3CB	15	44
O=C(CSCc1ccsc1Cl)Nc1ccc(N2CCOCC2)cc1	ZINC000853781983	GI	On-Demand	Anodyne	STAT6	52	35
COCCn1c(SCC(=O)Nc2ccccc2Cc2ccccc2)nc(O)cc1=O	ZINC000853782008	IF	On-Demand	Anodyne	FAS	46	37
CON(C)CCNC(=O)NCCc1c[nH]c2c(C)cccc12	ZINC000853782020	DD	On-Demand	Anodyne	MTNR1A	32	46
C#C[C@H](NC(=O)NC[C@H]1CCCN1CC)C1CCOCC1	ZINC000853782040	CD	On-Demand	Mild	DRD2	27	40
C#C[C@H](NC(=O)NC[C@@H]1CCCN1CC)C1CCOCC1	ZINC000853782041	CD	On-Demand	Mild	DRD2	27	40
C#C[C@@H](NC(=O)NC[C@H]1CCCN1CC)C1CCOCC1	ZINC000853782043	CD	On-Demand	Mild	DRD2	27	40
C#C[C@@H](NC(=O)NC[C@@H]1CCCN1CC)C1CCOCC1	ZINC000853782044	CD	On-Demand	Mild	DRD2	27	40
CCN(Cc1ccccc1)C(=O)CSCC1=NS(=O)(=O)c2ccccc21	ZINC000853782076	GF	On-Demand	Anodyne	TSPO	23	40
COCCn1c(SCC(=O)Nc2cccc(I)c2)nc(O)cc1=O	ZINC000853782079	JD	On-Demand	Anodyne	ENPP1	69	33
COCCn1c(SCC(=O)Nc2ccc3ccccc3c2)nc(O)cc1=O	ZINC000853782098	GE	On-Demand	Anodyne	ENPP1	74	35
COCCn1c(SCC(=O)Nc2ccc3ccccc3c2)nc(O)cc1=O	ZINC000853782098	GE	On-Demand	Anodyne	IMDH_CRYPV	33	45
CCN1CCC[C@@H]1CNC(=O)NNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000853782102	GC	On-Demand	Reactive	DRD2	31	41
CCN1CCC[C@H]1CNC(=O)NNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000853782104	GC	On-Demand	Reactive	DRD2	31	41
CCN1CCC[C@H]1CNC(=O)NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1	ZINC000853782108	FC	On-Demand	Reactive	DRD2	28	40
CCN1CCC[C@@H]1CNC(=O)NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1	ZINC000853782110	FC	On-Demand	Reactive	DRD2	28	40
CCN1CCC[C@H]1CNC(=O)NCc1ccc(N2CCCNC2=O)cc1	ZINC000853782117	FD	On-Demand	Anodyne	DRD2	33	42
CCN1CCC[C@@H]1CNC(=O)NCc1ccc(N2CCCNC2=O)cc1	ZINC000853782119	FD	On-Demand	Anodyne	DRD2	33	42
COCCn1c(SCC(=O)Nc2cc(OC)cc(OC)c2)nc(O)cc1=O	ZINC000853782129	GD	On-Demand	Anodyne	ENPP1	69	33
COCCn1c(SCC(=O)NCCc2ccc(F)cc2)nc(O)cc1=O	ZINC000853782133	GD	On-Demand	Anodyne	CNR2	28	40
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853782141	GE	On-Demand	Anodyne	SLC6A1	47	34
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCN(c2ccccc2Cl)C1	ZINC000853782141	GE	On-Demand	Anodyne	GPBAR1	19	41
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853782143	GE	On-Demand	Anodyne	SLC6A1	47	34
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCN(c2ccccc2Cl)C1	ZINC000853782143	GE	On-Demand	Anodyne	GPBAR1	19	41
COCCn1c(SCC(=O)Nc2ccc(OC(F)F)cc2)nc(O)cc1=O	ZINC000853782159	HD	On-Demand	Anodyne	ENPP1	67	32
COCCn1c(SCC(=O)Nc2cccc(Cl)c2)nc(O)cc1=O	ZINC000853782162	FD	On-Demand	Anodyne	ENPP1	70	36
COCCn1c(SCC(=O)Nc2ccc(C)c(S(=O)(=O)N(C)C)c2)nc(O)cc1=O	ZINC000853782165	JC	On-Demand	Anodyne	ENPP1	67	33
CCC[C@@H](CCc1ccccc1)NC(=O)NCCc1nnc(S)n1C	ZINC000853782178	FF	On-Demand	Anodyne	CAPN2	41	34
CCC[C@H](CCc1ccccc1)NC(=O)NCCc1nnc(S)n1C	ZINC000853782180	FF	On-Demand	Anodyne	CAPN2	41	34
CCN1CCC[C@@H]1CNC(=O)N(C)CCN(C)C(=O)OC	ZINC000853782194	DC	On-Demand	Anodyne	DRD2	36	47
CCN1CCC[C@H]1CNC(=O)N(C)CCN(C)C(=O)OC	ZINC000853782196	DC	On-Demand	Anodyne	DRD2	36	47
COCCn1c(SCC(=O)Nc2ccc(NC(C)=O)cc2)nc(O)cc1=O	ZINC000853782228	GD	On-Demand	Anodyne	ENPP1	73	35
CCN1CCC[C@@H]1CNC(=O)NCc1ncccn1	ZINC000853782230	CC	On-Demand	Anodyne	DRD2	35	44
COCCn1c(SCC(=O)NCc2ccc(OC)c(OC)c2)nc(O)cc1=O	ZINC000853782231	HD	On-Demand	Anodyne	ENPP1	72	34
COCCn1c(SCC(=O)NCc2ccc(OC)c(OC)c2)nc(O)cc1=O	ZINC000853782231	HD	On-Demand	Anodyne	DRTS_TRYCR	46	32
CCN1CCC[C@H]1CNC(=O)NCc1ncccn1	ZINC000853782232	CC	On-Demand	Anodyne	DRD2	35	44
CCN1CCC[C@H]1CNC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853782233	EE	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@H]1CNC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853782235	EE	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853782237	EE	On-Demand	Anodyne	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853782239	EE	On-Demand	Anodyne	DRD2	31	40
COCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)nc(O)cc1=O	ZINC000853782266	HD	On-Demand	Bother	KCNMA1	19	44
COCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)nc(O)cc1=O	ZINC000853782268	HD	On-Demand	Bother	KCNMA1	19	44
COCCn1c(SCC(=O)Nc2ccc(Cl)c(S(=O)(=O)N(C)C)c2)nc(O)cc1=O	ZINC000853782273	JD	On-Demand	Anodyne	ENPP1	62	33
COCCn1c(SCC(=O)N2N=C(c3ccccc3)C[C@H]2c2ccc(OC)cc2)nc(O)cc1=O	ZINC000853782318	JG	On-Demand	Anodyne	GRIN2D	85	35
COCCn1c(SCC(=O)N2N=C(c3ccccc3)C[C@@H]2c2ccc(OC)cc2)nc(O)cc1=O	ZINC000853782319	JG	On-Demand	Anodyne	GRIN2D	85	35
CCN1CCC[C@H]1CNC(=O)N[C@@H]1C=CCC1	ZINC000853782345	BD	On-Demand	Anodyne	DRD2	34	45
CCN1CCC[C@@H]1CNC(=O)N[C@H]1C=CCC1	ZINC000853782346	BD	On-Demand	Anodyne	DRD2	34	45
CCN1CCC[C@H]1CNC(=O)N[C@H]1C=CCC1	ZINC000853782347	BD	On-Demand	Anodyne	DRD2	34	45
CCN1CCC[C@@H]1CNC(=O)N[C@@H]1C=CCC1	ZINC000853782348	BD	On-Demand	Anodyne	DRD2	34	45
CCN1CCC[C@H]1CNC(=O)NCC1SCCS1	ZINC000853782352	CD	On-Demand	Anodyne	DRD2	35	45
CCN1CCC[C@@H]1CNC(=O)NCC1SCCS1	ZINC000853782353	CD	On-Demand	Anodyne	DRD2	35	45
COCCn1c(SCC(=O)NC2CCCCC2)nc(O)cc1=O	ZINC000853782379	ED	On-Demand	Anodyne	CNR2	23	42
CCN1CCC[C@@H]1CNC(=O)NCCC1SCCS1	ZINC000853782381	DD	On-Demand	Anodyne	DRD2	33	42
CCN1CCC[C@H]1CNC(=O)NCCC1SCCS1	ZINC000853782382	DD	On-Demand	Anodyne	DRD2	33	42
CCN1CCC[C@@H]1CNC(=O)NNC(=O)[C@H]1CN(C)C[C@@H](C)O1	ZINC000853782385	EB	On-Demand	Reactive	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)NNC(=O)[C@@H]1CN(C)C[C@@H](C)O1	ZINC000853782386	EB	On-Demand	Reactive	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)NNC(=O)[C@@H]1CN(C)C[C@H](C)O1	ZINC000853782387	EB	On-Demand	Reactive	DRD2	31	40
CCN1CCC[C@@H]1CNC(=O)NNC(=O)[C@H]1CN(C)C[C@H](C)O1	ZINC000853782388	EB	On-Demand	Reactive	DRD2	31	40
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1Cl	ZINC000853782414	DH	On-Demand	Mild	CXCL8	51	38
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1Cl	ZINC000853782414	DH	On-Demand	Mild	P2RX7	36	41
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1Cl	ZINC000853782415	DH	On-Demand	Mild	CXCL8	51	38
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1Cl	ZINC000853782415	DH	On-Demand	Mild	P2RX7	36	41
C=C(Cl)CSCC(=O)Nc1ccccc1C(F)(F)F	ZINC000853782418	DI	On-Demand	Mild	RBP4	77	34
C=C(Cl)CSCC(=O)Nc1ccc(C(=O)OCC)cc1	ZINC000853782419	DG	On-Demand	Mild	ACR	66	38
C=C(Cl)CSCC(=O)Nc1ccc(C(=O)OCC)cc1	ZINC000853782419	DG	On-Demand	Mild	NOD2	17	43
C=C(Cl)CSCC(=O)Nc1cc(OC)cc(OC)c1	ZINC000853782428	DG	On-Demand	Mild	ENPP1	55	33
C=C(Cl)CSCC(=O)Nc1ccc(C)c(C)c1	ZINC000853782431	CH	On-Demand	Mild	ENPP1	70	35
C=C(Cl)CSCC(=O)Nc1ccc(OCC)c(OCC)c1	ZINC000853782438	EH	On-Demand	Mild	ENPP1	80	40
C=C(Cl)CSCC(=O)NCc1ccc2c(c1)OCO2	ZINC000853782439	CF	On-Demand	Mild	NOS2	102	39
C=C(Cl)CSCC(=O)NCc1ccc2c(c1)OCO2	ZINC000853782439	CF	On-Demand	Mild	MCHR1	18	41
C=C(Cl)CSCC(=O)NCc1cccc(Cl)c1	ZINC000853782441	CG	On-Demand	Mild	PDS	45	40
C=C(Cl)CS[C@H](C)C(=O)Nc1ccc(OCC)cc1	ZINC000853782445	CH	On-Demand	Mild	LTA4H	17	41
C=C(Cl)CS[C@H](C)C(=O)Nc1ccc(OCC)cc1	ZINC000853782445	CH	On-Demand	Mild	SCN2A	18	40
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccc(OCC)cc1	ZINC000853782446	CH	On-Demand	Mild	LTA4H	17	41
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccc(OCC)cc1	ZINC000853782446	CH	On-Demand	Mild	SCN2A	18	40
O=C(CSCC=C(Cl)Cl)Nc1ccccc1N1CCCC1=O	ZINC000853782459	FH	On-Demand	Anodyne	KCNQ2	65	40
CCCCCNC(=O)CSCC=C(Cl)Cl	ZINC000853782460	CG	On-Demand	Anodyne	ASAH1	65	35
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1	ZINC000853782525	CG	On-Demand	Mild	MTNR1A	20	41
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1	ZINC000853782525	CG	On-Demand	Mild	MTNR1B	23	43
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1	ZINC000853782525	CG	On-Demand	Mild	ACR	34	41
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1	ZINC000853782525	CG	On-Demand	Mild	CA9	21	45
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1	ZINC000853782525	CG	On-Demand	Mild	ENPP1	73	35
C=C(Cl)CSCC(=O)NCCCc1ccccc1	ZINC000853782526	CG	On-Demand	Mild	AMP1_PLAFQ	22	43
C=C(Cl)CSCC(=O)NCCCc1ccccc1	ZINC000853782526	CG	On-Demand	Mild	CRTM	37	45
CNC(=O)[C@@H](Cc1ccccc1)SCC=C(Cl)Cl	ZINC000853782528	DG	On-Demand	Anodyne	MME	87	41
CNC(=O)[C@@H](Cc1ccccc1)SCC=C(Cl)Cl	ZINC000853782528	DG	On-Demand	Anodyne	ANPEP	42	33
CNC(=O)[C@@H](Cc1ccccc1)SCC=C(Cl)Cl	ZINC000853782528	DG	On-Demand	Anodyne	FCER2	48	36
CNC(=O)[C@@H](Cc1ccccc1)SCC=C(Cl)Cl	ZINC000853782528	DG	On-Demand	Anodyne	PAPA1_CARPA	32	41
CNC(=O)[C@@H](Cc1ccccc1)SCC=C(Cl)Cl	ZINC000853782528	DG	On-Demand	Anodyne	CAPNS1	46	31
CNC(=O)[C@@H](Cc1ccccc1)SCC=C(Cl)Cl	ZINC000853782528	DG	On-Demand	Anodyne	CAPN1	52	35
CNC(=O)[C@@H](Cc1ccccc1)SCC=C(Cl)Cl	ZINC000853782528	DG	On-Demand	Anodyne	CAPN2	57	34
Cc1cccc(CNC(=O)CSCC=C(Cl)Cl)c1	ZINC000853782537	DH	On-Demand	Anodyne	FBP1	15	40
C=C(Cl)CSCC(=O)NCc1cccs1	ZINC000853782545	CF	On-Demand	Mild	CA5B	29	40
C=C(Cl)CSCC(=O)NCc1cccs1	ZINC000853782545	CF	On-Demand	Mild	CA5A	28	40
C=C(Cl)CS[C@H](C)C(=O)NCc1ccc(OC)c(OC)c1	ZINC000853782548	EG	On-Demand	Mild	TRPV1	16	40
C=C(Cl)CS[C@H](C)C(=O)NCc1ccc(OC)c(OC)c1	ZINC000853782548	EG	On-Demand	Mild	MT-ND1	20	42
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccc(OC)c(OC)c1	ZINC000853782549	EG	On-Demand	Mild	TRPV1	16	40
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccc(OC)c(OC)c1	ZINC000853782549	EG	On-Demand	Mild	MT-ND1	20	42
O=C(CCSCC=C(Cl)Cl)Nc1cccnc1	ZINC000853782550	CG	On-Demand	Anodyne	NAMPT	22	40
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccc(Cl)cc1	ZINC000853782554	DH	On-Demand	Mild	AMP1_PLAFQ	19	50
C=C(Cl)CS[C@H](C)C(=O)NCc1ccc(Cl)cc1	ZINC000853782555	DH	On-Demand	Mild	AMP1_PLAFQ	19	50
C=C(Cl)CSCC(=O)Nc1cc(C)ccc1OC	ZINC000853782561	CG	On-Demand	Mild	ENPP1	68	32
O=S(=O)(NCCSCC=C(Cl)Cl)c1ccccc1	ZINC000853782573	EG	On-Demand	Anodyne	TBXA2R	42	37
C=C(Cl)CSCC(=O)N1CCc2ccccc21	ZINC000853782578	CG	On-Demand	Mild	DRD4	15	52
C=C(Cl)CSCC(=O)Nc1c(C)cccc1C(C)C	ZINC000853782595	CJ	On-Demand	Mild	SOAT1	48	40
C=C(Cl)CSCC(=O)Nc1ccc(OC)c(OC)c1	ZINC000853782614	DG	On-Demand	Mild	ENPP1	104	49
C=C(Cl)CSCC(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000853782616	DI	On-Demand	Mild	PRCP	16	44
C=C(Cl)CSCC(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000853782617	DI	On-Demand	Mild	PRCP	16	44
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccc(F)cc1	ZINC000853782626	CG	On-Demand	Mild	AMP1_PLAFQ	18	42
C=C(Cl)CS[C@H](C)C(=O)NCc1ccc(F)cc1	ZINC000853782627	CG	On-Demand	Mild	AMP1_PLAFQ	18	42
C=C(Cl)CSCC(=O)N(C)Cc1cccc(OC)c1	ZINC000853782629	CG	On-Demand	Mild	ROCK1	28	42
C=C(Cl)CSCC(=O)N(C)Cc1cccc(OC)c1	ZINC000853782629	CG	On-Demand	Mild	ROCK2	39	42
C=C(Cl)CSCC(=O)N(C)Cc1cccc(OC)c1	ZINC000853782629	CG	On-Demand	Mild	HSD17B2	33	50
C=C(Cl)CSCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853782632	EF	On-Demand	Mild	CCR1	16	47
C=C(Cl)CSCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853782632	EF	On-Demand	Mild	SSTR1	26	42
C=C(Cl)CSCC(=O)Nc1cccc(C)c1	ZINC000853782634	CG	On-Demand	Mild	CCKAR	23	40
C=C(Cl)CSCC(=O)Nc1cccc(C)c1	ZINC000853782634	CG	On-Demand	Mild	KDR	15	40
C=C(Cl)CSCC(=O)Nc1cccc(C)c1	ZINC000853782634	CG	On-Demand	Mild	KCNK3	79	43
C=C(Cl)CSCC(=O)Nc1cccc(C)c1	ZINC000853782634	CG	On-Demand	Mild	KCNK9	56	43
C=C(Cl)CSCC(=O)N(C)c1ccccc1	ZINC000853782639	CG	On-Demand	Mild	TSPO	25	40
C=C(Cl)CS[C@H](C)C(=O)Nc1c(C)cccc1C	ZINC000853782640	CI	On-Demand	Mild	CXCL8	35	47
C=C(Cl)CS[C@@H](C)C(=O)Nc1c(C)cccc1C	ZINC000853782641	CI	On-Demand	Mild	CXCL8	35	47
C=C(Cl)CSCC(=O)Nc1ccc(OC)c(Cl)c1	ZINC000853782649	DH	On-Demand	Mild	GRM4	16	49
C=C(Cl)CSCC(=O)Nc1ccc(OC)c(Cl)c1	ZINC000853782649	DH	On-Demand	Mild	ENPP1	88	44
C=C(Cl)CSCC(=O)Nc1ccc(OC)c(Cl)c1	ZINC000853782649	DH	On-Demand	Mild	IMDH_CRYPV	21	40
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853782650	FF	On-Demand	Mild	LPL	43	35
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853782650	FF	On-Demand	Mild	TGM2	69	39
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853782650	FF	On-Demand	Mild	F13A1	90	48
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853782650	FF	On-Demand	Mild	AKR1C3	51	42
C=C(Cl)CSCC(=O)NCCc1ccc(OC)c(OC)c1	ZINC000853782658	EF	On-Demand	Mild	MTNR1A	21	40
C=C(Cl)CSCC(=O)NCCc1ccc(OC)c(OC)c1	ZINC000853782658	EF	On-Demand	Mild	MTNR1B	23	43
C=C(Cl)CSCC(=O)NCCc1ccc(OC)c(OC)c1	ZINC000853782658	EF	On-Demand	Mild	ENPP1	61	31
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1Cl	ZINC000853782665	CI	On-Demand	Mild	CXCL8	58	42
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1Cl	ZINC000853782665	CI	On-Demand	Mild	KCNQ2	52	36
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1Cl	ZINC000853782665	CI	On-Demand	Mild	EPHB3	48	35
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1Cl	ZINC000853782666	CI	On-Demand	Mild	CXCL8	58	42
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1Cl	ZINC000853782666	CI	On-Demand	Mild	KCNQ2	52	36
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1Cl	ZINC000853782666	CI	On-Demand	Mild	EPHB3	48	35
C[C@H](SCC=C(Cl)Cl)C(=O)N1CCc2ccccc2C1	ZINC000853782673	EI	On-Demand	Anodyne	DPP8	24	45
CS(=O)(=O)c1ccc(OCCSCC=C(Cl)Cl)cc1	ZINC000853782683	EH	On-Demand	Anodyne	LOX1.1	47	33
CS(=O)(=O)c1ccc(OCCSCC=C(Cl)Cl)cc1	ZINC000853782683	EH	On-Demand	Anodyne	O49150_SOLTU	51	35
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	DRD4	42	32
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	PDGFRB	17	40
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	MTNR1A	38	51
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	MTNR1B	40	53
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	EPHX2	17	44
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	TAAR1	41	47
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	AKR1C3	15	40
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	ENPP1	70	35
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	KCNK3	55	38
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	KCNK9	54	38
C=C(Cl)CSCC(=O)Nc1cccc(OC)c1	ZINC000853782686	CG	On-Demand	Mild	FAS	25	41
O=C(c1ccccc1)N1CC[C@@H](CSCC=C(Cl)Cl)C1	ZINC000853782710	EI	On-Demand	Anodyne	L3MBTL3	54	35
O=C(c1ccccc1)N1CC[C@H](CSCC=C(Cl)Cl)C1	ZINC000853782711	EI	On-Demand	Anodyne	L3MBTL3	54	35
COc1cc2c(cc1OC)CN(C(=O)CSCC=C(Cl)Cl)CC2	ZINC000853782722	GH	On-Demand	Anodyne	SLC18A2	46	34
COc1cc2c(cc1OC)CN(C(=O)CSCC=C(Cl)Cl)CC2	ZINC000853782722	GH	On-Demand	Anodyne	ABCB1B	40	33
COc1cc2c(cc1OC)CN(C(=O)CSCC=C(Cl)Cl)CC2	ZINC000853782722	GH	On-Demand	Anodyne	ABCB1	20	51
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853782727	GE	On-Demand	Mild	EPHX2	19	57
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853782727	GE	On-Demand	Mild	TGM2	61	36
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853782727	GE	On-Demand	Mild	F13A1	78	46
C=C(Cl)CSCC(=O)Nc1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853782727	GE	On-Demand	Mild	AKR1C3	37	40
C=C(Cl)CSCC(=O)Nc1cccc(SC)c1	ZINC000853782749	CH	On-Demand	Mild	ENPP1	40	31
C=C(Cl)CSCC(=O)NCc1ccc(OC)cc1	ZINC000853782750	CF	On-Demand	Mild	MTNR1A	46	33
C=C(Cl)CSCC(=O)NCc1ccc(OC)cc1	ZINC000853782750	CF	On-Demand	Mild	CA9	22	49
C=C(Cl)CSCC(=O)NCc1ccc(OC)cc1	ZINC000853782750	CF	On-Demand	Mild	PROKR1	62	34
C=C(Cl)CSCC(=O)Nc1cc(C(=O)OC)ccc1C	ZINC000853782752	DG	On-Demand	Mild	FAS	48	36
C=C(Cl)CSCC(=O)N[C@H]1CCCc2ccccc21	ZINC000853782753	CH	On-Demand	Mild	HTR7	15	49
C=C(Cl)CSCC(=O)N[C@H]1CCCc2ccccc21	ZINC000853782753	CH	On-Demand	Mild	BDKRB1	62	44
C=C(Cl)CSCC(=O)N[C@H]1CCCc2ccccc21	ZINC000853782753	CH	On-Demand	Mild	BIRC3	27	40
C=C(Cl)CSCC(=O)N[C@H]1CCCc2ccccc21	ZINC000853782753	CH	On-Demand	Mild	BIRC2	28	40
C=C(Cl)CSCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000853782754	CH	On-Demand	Mild	HTR7	15	49
C=C(Cl)CSCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000853782754	CH	On-Demand	Mild	BDKRB1	62	44
C=C(Cl)CSCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000853782754	CH	On-Demand	Mild	BIRC3	27	40
C=C(Cl)CSCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000853782754	CH	On-Demand	Mild	BIRC2	28	40
C=C(Cl)CSCC(=O)Nc1cc(Cl)ccc1OC	ZINC000853782769	DH	On-Demand	Mild	CPT1A	47	36
C=C(Cl)CSCC(=O)Nc1cc(Cl)ccc1OC	ZINC000853782769	DH	On-Demand	Mild	RBP4	20	45
C=C(Cl)CSCC(=O)Nc1cc(Cl)ccc1OC	ZINC000853782769	DH	On-Demand	Mild	ENPP1	69	36
C=C(Cl)CSCC(=O)Nc1cc(Cl)ccc1OC	ZINC000853782769	DH	On-Demand	Mild	FAS	29	43
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853782773	DJ	On-Demand	Mild	RBP4	61	33
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853782774	DJ	On-Demand	Mild	RBP4	61	33
C=C(Cl)CSCC(=O)Nc1cc(OC)ccc1OC	ZINC000853782775	DG	On-Demand	Mild	ENPP1	68	32
C=C(Cl)CSCC(=O)Nc1cc(OC)ccc1OC	ZINC000853782775	DG	On-Demand	Mild	FAS	33	40
C=C(Cl)CSCC(=O)NCc1cccc(OC)c1	ZINC000853782795	CF	On-Demand	Mild	DRD4	43	33
C=C(Cl)CSCC(=O)NCc1cccc(OC)c1	ZINC000853782795	CF	On-Demand	Mild	ROCK1	38	43
C=C(Cl)CSCC(=O)NCc1cccc(OC)c1	ZINC000853782795	CF	On-Demand	Mild	MTNR1A	74	45
C=C(Cl)CSCC(=O)NCc1cccc(OC)c1	ZINC000853782795	CF	On-Demand	Mild	MTNR1B	76	45
C=C(Cl)CSCC(=O)NCc1cccc(OC)c1	ZINC000853782795	CF	On-Demand	Mild	ROCK2	40	45
C=C(Cl)CSCC(=O)NCc1cccc(OC)c1	ZINC000853782795	CF	On-Demand	Mild	PDS	63	42
C=C(Cl)CSCCCNC(=O)C(F)(F)F	ZINC000853782807	CF	On-Demand	Mild	EST1_PIG	44	38
C=C(Cl)CS[C@H](C)C(=O)Nc1cccc(C)c1	ZINC000853782823	CH	On-Demand	Mild	CCKAR	18	41
C=C(Cl)CS[C@H](C)C(=O)Nc1cccc(C)c1	ZINC000853782823	CH	On-Demand	Mild	KCNK3	63	40
C=C(Cl)CS[C@H](C)C(=O)Nc1cccc(C)c1	ZINC000853782823	CH	On-Demand	Mild	KCNK9	54	40
C=C(Cl)CS[C@@H](C)C(=O)Nc1cccc(C)c1	ZINC000853782824	CH	On-Demand	Mild	CCKAR	18	41
C=C(Cl)CS[C@@H](C)C(=O)Nc1cccc(C)c1	ZINC000853782824	CH	On-Demand	Mild	KCNK3	63	40
C=C(Cl)CS[C@@H](C)C(=O)Nc1cccc(C)c1	ZINC000853782824	CH	On-Demand	Mild	KCNK9	54	40
C=C(Cl)CSCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	ZINC000853782840	ED	On-Demand	Mild	CA1	15	59
C=C(Cl)CSCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	ZINC000853782840	ED	On-Demand	Mild	CA7	31	59
C=C(Cl)CSCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	ZINC000853782840	ED	On-Demand	Mild	EIF2AK3	50	34
C=C(Cl)CSCCC(=O)Nc1cc(OC)c(OC)c(OC)c1	ZINC000853782851	EH	On-Demand	Mild	ENPP1	72	34
C=C(Cl)CSCC(=O)NCc1cccc(OCC)c1	ZINC000853782858	CG	On-Demand	Mild	PDS	100	46
C=C(Cl)CSC[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853782889	CH	On-Demand	Mild	L3MBTL3	58	37
C=C(Cl)CSC[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000853782890	CH	On-Demand	Mild	L3MBTL3	58	37
C=C(Cl)CSCC(=O)NCc1cc(Cl)ccc1OC	ZINC000853782894	DG	On-Demand	Mild	CPT1A	43	30
C=C(Cl)CSCC(=O)NCCOc1cccc(C)c1	ZINC000853782900	CF	On-Demand	Mild	MTNR1A	19	44
COc1ccc(CNC(=O)[C@H](C)SCC=C(Cl)Cl)cc1OC	ZINC000853782906	FH	On-Demand	Anodyne	MT-ND1	19	42
C[C@@H](CCNC(=O)NCC[S@](C)=O)N(C)C	ZINC000853782915	BC	On-Demand	Anodyne	CHRNA4	19	44
C[C@@H](CCNC(=O)NCC[S@@](C)=O)N(C)C	ZINC000853782917	BC	On-Demand	Anodyne	CHRNA4	19	44
C[S@@](=O)CCNC(=O)N1CCC[C@]1(C)Cc1cccc2ccccc12	ZINC000853782920	FG	On-Demand	Anodyne	SLC12A5	58	34
C[S@@](=O)CCNC(=O)N1CCC[C@@]1(C)Cc1cccc2ccccc12	ZINC000853782922	FG	On-Demand	Anodyne	SLC12A5	58	34
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCc2coc(-c3ccccc3)n2)C1	ZINC000853782935	GF	On-Demand	Anodyne	PDE8B	52	34
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCc2coc(-c3ccccc3)n2)C1	ZINC000853782936	GF	On-Demand	Anodyne	PDE8B	52	34
Cc1cccc(C(C)C)c1NC(=O)CSCC=C(Cl)Cl	ZINC000853782956	EK	On-Demand	Anodyne	SOAT1	43	41
C#CCCN(CCOC)C(=O)NCc1coc(-c2ccccc2)n1	ZINC000853782975	EF	On-Demand	Mild	PDE8B	48	33
C[S@@](=O)CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853782979	CD	On-Demand	Anodyne	CHRM3	19	43
C[S@@](=O)CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853782979	CD	On-Demand	Anodyne	PRSS2	56	34
C[S@@](=O)CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853782979	CD	On-Demand	Anodyne	EPHX2	28	49
C[S@@](=O)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853783011	ED	On-Demand	Reactive	LCK	24	42
C[S@@](=O)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853783011	ED	On-Demand	Reactive	CSNK1D	45	48
C[S@@](=O)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853783011	ED	On-Demand	Reactive	PIK3CA	15	40
C=C(Cl)CSCC(=O)NCCc1ccccc1OC	ZINC000853783015	CF	On-Demand	Mild	MTNR1A	45	38
C=C(Cl)CSCC(=O)NCCc1ccccc1OC	ZINC000853783015	CF	On-Demand	Mild	MBTPS1	51	34
C=C(Cl)CSCC(=O)N1CCC[C@H]1c1cc(OC)ccc1OC	ZINC000853783029	FH	On-Demand	Mild	FKBP1A	50	44
C=C(Cl)CSCC(=O)N1CCC[C@@H]1c1cc(OC)ccc1OC	ZINC000853783030	FH	On-Demand	Mild	FKBP1A	50	44
C=C(Cl)CS[C@H](CC)C(=O)NCc1ccccc1	ZINC000853783042	CH	On-Demand	Mild	ANPEP	28	42
C=C(Cl)CS[C@H](CC)C(=O)NCc1ccccc1	ZINC000853783042	CH	On-Demand	Mild	FURIN	40	32
C=C(Cl)CS[C@H](CC)C(=O)NCc1ccccc1	ZINC000853783042	CH	On-Demand	Mild	CAPN2	59	37
C=C(Cl)CS[C@H](CC)C(=O)NCc1ccccc1	ZINC000853783042	CH	On-Demand	Mild	AMP1_PLAFQ	47	42
C=C(Cl)CS[C@H](CC)C(=O)NCc1ccccc1	ZINC000853783042	CH	On-Demand	Mild	PDS	63	42
C=C(Cl)CS[C@@H](CC)C(=O)NCc1ccccc1	ZINC000853783043	CH	On-Demand	Mild	ANPEP	28	42
C=C(Cl)CS[C@@H](CC)C(=O)NCc1ccccc1	ZINC000853783043	CH	On-Demand	Mild	FURIN	40	32
C=C(Cl)CS[C@@H](CC)C(=O)NCc1ccccc1	ZINC000853783043	CH	On-Demand	Mild	CAPN2	59	37
C=C(Cl)CS[C@@H](CC)C(=O)NCc1ccccc1	ZINC000853783043	CH	On-Demand	Mild	AMP1_PLAFQ	47	42
C=C(Cl)CS[C@@H](CC)C(=O)NCc1ccccc1	ZINC000853783043	CH	On-Demand	Mild	PDS	63	42
COc1ccc([C@@H]2CCCN2C(=O)CSCC=C(Cl)Cl)c(OC)c1	ZINC000853783048	GI	On-Demand	Anodyne	FKBP1A	41	37
C=C(Cl)CSCC(=O)NCC1(c2ccccc2)CC1	ZINC000853783064	CG	On-Demand	Mild	KCNA3	47	41
C=C(Cl)CSCC(=O)NCC1(c2ccccc2)CC1	ZINC000853783064	CG	On-Demand	Mild	NPFFR1	30	46
C=C(Cl)CSCCC(=O)Nc1ccccc1C(F)(F)F	ZINC000853783065	DJ	On-Demand	Mild	RBP4	77	34
C=C(Cl)CSCC(=O)N(C)Cc1ccc(OC)c(OC)c1	ZINC000853783076	EG	On-Demand	Mild	MT-ND1	18	45
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccc(OC)cc1	ZINC000853783084	CH	On-Demand	Mild	MTNR1B	19	43
C=C(Cl)CS[C@H](C)C(=O)Nc1ccc(OC)cc1	ZINC000853783085	CH	On-Demand	Mild	MTNR1B	19	43
C=C(Cl)CSCC(=O)Nc1ccccc1OC	ZINC000853783087	CG	On-Demand	Mild	FAS	61	41
C=C(Cl)CS[C@H](C)C(=O)N1CCc2ccccc21	ZINC000853783089	CG	On-Demand	Mild	HSD17B3	16	40
C=C(Cl)CS[C@@H](C)C(=O)N1CCc2ccccc21	ZINC000853783090	CG	On-Demand	Mild	HSD17B3	16	40
C=C(Cl)CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853783091	EF	On-Demand	Mild	MTOR	56	39
C=C(Cl)CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853783091	EF	On-Demand	Mild	EPHX2	19	47
C=C(Cl)CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853783091	EF	On-Demand	Mild	STAT6	58	35
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1C	ZINC000853783104	CG	On-Demand	Mild	AMP1_PLAFQ	22	46
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1C	ZINC000853783106	CG	On-Demand	Mild	AMP1_PLAFQ	22	46
C=C(Cl)CSCC(=O)Nc1ccc(C(=O)N(CC)CC)cc1	ZINC000853783114	EH	On-Demand	Mild	OPRD1	28	41
C=C(Cl)CSCC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000853783116	FH	On-Demand	Mild	PDS	70	42
C=C(Cl)CSCCC(=O)Nc1ccccc1Cl	ZINC000853783124	CI	On-Demand	Mild	CXCL8	19	40
C=C(Cl)CSCCC(=O)Nc1ccccc1Cl	ZINC000853783124	CI	On-Demand	Mild	EPHB3	51	35
C=C(Cl)CSCCOc1ccc(S(C)(=O)=O)cc1	ZINC000853783142	DF	On-Demand	Mild	LOX1.1	45	32
C=C(Cl)CSCCOc1ccc(S(C)(=O)=O)cc1	ZINC000853783142	DF	On-Demand	Mild	O49150_SOLTU	49	33
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	ACE	42	37
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	MME	60	39
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	MMP2	25	40
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	MMP3	40	39
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	MMP8	15	40
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	CAPN2	57	39
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	NPR	49	38
C=C(Cl)CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853783147	CG	On-Demand	Mild	AMP1_PLAFQ	47	48
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	ACE	42	37
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	MME	60	39
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	MMP2	25	40
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	MMP3	40	39
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	MMP8	15	40
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	CAPN2	57	39
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	NPR	49	38
C=C(Cl)CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853783148	CG	On-Demand	Mild	AMP1_PLAFQ	47	48
C=C(Cl)CSCC(=O)NC1CCN(C(C)=O)CC1	ZINC000853783168	CD	On-Demand	Mild	EPHX2	21	48
C=C(Cl)CSCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000853783183	CF	On-Demand	Mild	QPCT	16	40
CCOc1ccc([C@@H](C)NC(=O)CSCC=C(Cl)Cl)cc1OC	ZINC000853783199	GI	On-Demand	Anodyne	ENPP1	45	32
C=C(Cl)CSCC(=O)Nc1ccc2c(c1)OCO2	ZINC000853783207	CF	On-Demand	Mild	DYRK2	45	34
C=C(Cl)CSCC(=O)Nc1ccccc1OCC	ZINC000853783208	CH	On-Demand	Mild	HCN1	46	31
C=C(Cl)CSCC(=O)N1CCCc2ccccc21	ZINC000853783212	CG	On-Demand	Mild	AVPR2	39	43
C=C(Cl)CSCCC(=O)Nc1ccc2c(c1)OCO2	ZINC000853783227	CG	On-Demand	Mild	DYRK2	44	33
C=C(Cl)CSCC(=O)Nc1cccc(C(=O)N(CC)CC)c1	ZINC000853783232	EH	On-Demand	Mild	OPRD1	26	41
C=C(Cl)CSCC(=O)Nc1cccc(C(=O)N(CC)CC)c1	ZINC000853783232	EH	On-Demand	Mild	KCNK3	48	34
COc1ccc(NC(=O)[C@H](C)SCC=C(Cl)Cl)cc1OC	ZINC000853783289	FI	On-Demand	Anodyne	ENPP1	78	37
C[S@@](=O)CCNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853783299	CD	On-Demand	Mild	IMDH_CRYPV	54	33
C=C(Cl)CS[C@H](C)C(=O)N[C@H](C)c1ccccc1C	ZINC000853783300	CI	On-Demand	Mild	CTSA	40	34
C=C(Cl)CS[C@@H](C)C(=O)N[C@H](C)c1ccccc1C	ZINC000853783302	CI	On-Demand	Mild	CTSA	40	34
C=C(Cl)CS[C@H](C)C(=O)N[C@@H](C)c1ccccc1C	ZINC000853783304	CI	On-Demand	Mild	CTSA	40	34
C=C(Cl)CS[C@@H](C)C(=O)N[C@@H](C)c1ccccc1C	ZINC000853783306	CI	On-Demand	Mild	CTSA	40	34
C=C(Cl)CSCC(=O)Nc1ccccc1N1CCCC1=O	ZINC000853783308	DG	On-Demand	Mild	KCNQ2	70	41
C=C(Cl)CSCC(=O)N[C@H](C)c1ccc(OCC)c(OC)c1	ZINC000853783311	EH	On-Demand	Mild	ENPP1	51	32
C=C(Cl)CSCC(=O)N[C@@H](C)c1ccc(OCC)c(OC)c1	ZINC000853783312	EH	On-Demand	Mild	ENPP1	51	32
O=C(CCSCC=C(Cl)Cl)Nc1ccccc1	ZINC000853783345	CI	On-Demand	Anodyne	LTA4H	24	43
O=C(CCSCC=C(Cl)Cl)Nc1ccccc1	ZINC000853783345	CI	On-Demand	Anodyne	HDAC10	27	49
O=C(CCSCC=C(Cl)Cl)Nc1ccccc1	ZINC000853783345	CI	On-Demand	Anodyne	HDAC2	20	49
O=C(CCSCC=C(Cl)Cl)Nc1ccccc1	ZINC000853783345	CI	On-Demand	Anodyne	HDAC3	23	49
O=C(CCSCC=C(Cl)Cl)Nc1ccccc1	ZINC000853783345	CI	On-Demand	Anodyne	HDAC6	23	49
O=C(CCSCC=C(Cl)Cl)Nc1ccccc1	ZINC000853783345	CI	On-Demand	Anodyne	HDAC11	17	49
C[S@@](=O)CCNC(=O)N1CCC[C@]1(C)Cc1ccc(C(C)(C)C)cc1	ZINC000853783348	FG	On-Demand	Anodyne	SLC12A5	59	37
C[S@@](=O)CCNC(=O)N1CCC[C@@]1(C)Cc1ccc(C(C)(C)C)cc1	ZINC000853783350	FG	On-Demand	Anodyne	SLC12A5	59	37
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1OC	ZINC000853783359	DG	On-Demand	Mild	MTNR1A	41	36
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1OC	ZINC000853783359	DG	On-Demand	Mild	MTNR1B	40	39
C=C(Cl)CSCC(=O)Nc1ccc(OC)cc1OC	ZINC000853783359	DG	On-Demand	Mild	ENPP1	54	30
C=C(Cl)CSCC(=O)N(C)Cc1ccccc1	ZINC000853783364	CG	On-Demand	Mild	TSPO	15	40
C=C(Cl)CSCC(=O)N(CC)Cc1ccccc1	ZINC000853783392	CH	On-Demand	Mild	TSPO	27	40
COC[C@@H](NC(=O)NNc1ccc([N+](=O)[O-])cc1F)C(C)C	ZINC000853783396	DE	On-Demand	Reactive	CACNA1D	42	33
COC[C@H](NC(=O)NNc1ccc([N+](=O)[O-])cc1F)C(C)C	ZINC000853783397	DE	On-Demand	Reactive	CACNA1D	42	33
O=C(CSCC=C(Cl)Cl)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853783417	FG	On-Demand	Anodyne	DRD4	15	40
O=C(CSCC=C(Cl)Cl)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853783417	FG	On-Demand	Anodyne	MAPK14	17	42
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CSCC=C(Cl)Cl	ZINC000853783419	GE	On-Demand	Anodyne	CA1	15	55
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CSCC=C(Cl)Cl	ZINC000853783419	GE	On-Demand	Anodyne	CA7	32	55
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CSCC=C(Cl)Cl	ZINC000853783419	GE	On-Demand	Anodyne	EIF2AK3	49	33
C=C(Cl)CSCC(=O)Nc1cc(OC)c(OC)c(OC)c1	ZINC000853783436	EG	On-Demand	Mild	ENPP1	75	36
C=C(Cl)CSCC(=O)NCCCCCC	ZINC000853783474	BG	On-Demand	Mild	EST1_PIG	50	36
C=C(Cl)CSCC(=O)NCCCCCC	ZINC000853783474	BG	On-Demand	Mild	ASAH1	93	39
C=C(Cl)CSCC(=O)NCc1cccc(OCCOC)c1	ZINC000853783482	EF	On-Demand	Mild	ROCK2	24	44
C=C(Cl)CSCC(=O)NCc1cccc(OCCOC)c1	ZINC000853783482	EF	On-Demand	Mild	PDS	77	40
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccc(OC)c(OC)c1	ZINC000853783504	DH	On-Demand	Mild	ENPP1	84	40
C=C(Cl)CS[C@H](C)C(=O)Nc1ccc(OC)c(OC)c1	ZINC000853783506	DH	On-Demand	Mild	ENPP1	84	40
C=C(Cl)CS[C@H](C)C(=O)Nc1cccc(C(=O)N(CC)CC)c1	ZINC000853783511	FH	On-Demand	Mild	OPRD1	27	40
C=C(Cl)CS[C@@H](C)C(=O)Nc1cccc(C(=O)N(CC)CC)c1	ZINC000853783513	FH	On-Demand	Mild	OPRD1	27	40
O=C(CSCC=C(Cl)Cl)NCC1(c2ccccc2)CCOCC1	ZINC000853783514	FH	On-Demand	Anodyne	KCNA3	42	37
C=C(Cl)CSCC(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000853783518	EK	On-Demand	Mild	SOAT1	59	46
C=C(Cl)CSCC(=O)N1CCC[C@H]1c1ccc(OC)cc1OC	ZINC000853783521	FH	On-Demand	Mild	FKBP1A	45	41
C=C(Cl)CSCC(=O)N1CCC[C@@H]1c1ccc(OC)cc1OC	ZINC000853783523	FH	On-Demand	Mild	FKBP1A	45	41
C=C(Cl)CSCC(=O)N1c2ccccc2C[C@H]1C	ZINC000853783529	CG	On-Demand	Mild	ACE	17	42
C=C(Cl)CSCC(=O)N1c2ccccc2C[C@H]1C	ZINC000853783529	CG	On-Demand	Mild	DRD4	30	51
C=C(Cl)CSCC(=O)N1c2ccccc2C[C@H]1C	ZINC000853783529	CG	On-Demand	Mild	TPP2	61	37
C=C(Cl)CSCC(=O)N1c2ccccc2C[C@@H]1C	ZINC000853783532	CG	On-Demand	Mild	ACE	17	42
C=C(Cl)CSCC(=O)N1c2ccccc2C[C@@H]1C	ZINC000853783532	CG	On-Demand	Mild	DRD4	30	51
C=C(Cl)CSCC(=O)N1c2ccccc2C[C@@H]1C	ZINC000853783532	CG	On-Demand	Mild	TPP2	61	37
C=C(Cl)CS[C@@H](C)C(=O)N1CCN(c2ccccc2)CC1	ZINC000853783537	DG	On-Demand	Mild	CCR1	15	45
C=C(Cl)CS[C@H](C)C(=O)N1CCN(c2ccccc2)CC1	ZINC000853783538	DG	On-Demand	Mild	CCR1	15	45
C=C(Cl)CSCC(=O)NCc1ccccc1	ZINC000853783555	CF	On-Demand	Mild	CA5B	16	42
C=C(Cl)CSCC(=O)NCc1ccccc1	ZINC000853783555	CF	On-Demand	Mild	CA5A	18	42
C=C(Cl)CSCC(=O)NCc1ccccc1	ZINC000853783555	CF	On-Demand	Mild	PDS	53	36
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	ACE	40	38
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	MME	105	42
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	ANPEP	45	36
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	FCER2	62	39
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	CYSP_TRYCR	50	39
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	CPA1	41	33
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	TIMP3	22	43
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	CAPNS1	51	32
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	MMP3	26	42
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	MMP8	23	43
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	CAPN1	41	38
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	MMP9	23	43
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	CAPN2	46	33
C=C(Cl)CS[C@H](Cc1ccccc1)C(=O)NC	ZINC000853783596	CF	On-Demand	Mild	FPR1	52	36
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	ACE	40	38
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	MME	105	42
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	ANPEP	45	36
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	FCER2	62	39
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	CYSP_TRYCR	50	39
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	CPA1	41	33
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	TIMP3	22	43
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	CAPNS1	51	32
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	MMP3	26	42
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	MMP8	23	43
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	CAPN1	41	38
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	MMP9	23	43
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	CAPN2	46	33
C=C(Cl)CS[C@@H](Cc1ccccc1)C(=O)NC	ZINC000853783597	CF	On-Demand	Mild	FPR1	52	36
C=C(Cl)CSCCC(=O)Nc1cc(Cl)ccc1OC	ZINC000853783610	DI	On-Demand	Mild	CPT1A	45	31
C=C(Cl)CSCCC(=O)Nc1cc(Cl)ccc1OC	ZINC000853783610	DI	On-Demand	Mild	RBP4	18	43
C=C(Cl)CSCCC(=O)Nc1cc(Cl)ccc1OC	ZINC000853783610	DI	On-Demand	Mild	ENPP1	61	35
C=C(Cl)CSCCC(=O)Nc1ccc(OCC)cc1	ZINC000853783614	CH	On-Demand	Mild	PLA2G4B	21	40
C=C(Cl)CSCC(=O)NCCOc1cccc(F)c1	ZINC000853783618	DF	On-Demand	Mild	MTNR1A	15	42
C=C(Cl)CSCC(=O)NCCOc1cccc(F)c1	ZINC000853783618	DF	On-Demand	Mild	PDS	40	38
C=C(Cl)CSCC(=O)NCc1cccc(OC(C)C)c1	ZINC000853783623	DH	On-Demand	Mild	PDS	69	37
C=C(Cl)CSCC(=O)Nc1cccc(C(=O)NCC)c1	ZINC000853783630	DF	On-Demand	Mild	KCNK3	102	38
C=C(Cl)CSCC(=O)Nc1cccc(C(=O)NCC)c1	ZINC000853783630	DF	On-Demand	Mild	KCNK9	64	38
C=C(Cl)CSCC(=O)NCc1cccc(OCCC)c1	ZINC000853783632	DH	On-Demand	Mild	HRH2	25	40
C=C(Cl)CSCC(=O)NCc1cccc(OCCC)c1	ZINC000853783632	DH	On-Demand	Mild	MTNR1A	27	40
C=C(Cl)CSCC(=O)NCc1cccc(OCCC)c1	ZINC000853783632	DH	On-Demand	Mild	ROCK2	15	44
C=C(Cl)CSCC(=O)NCc1cccc(OCCC)c1	ZINC000853783632	DH	On-Demand	Mild	PDS	91	40
C=C(Cl)CSCC(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853783647	DG	On-Demand	Mild	CCR2	41	38
C=C(Cl)CSCC(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853783647	DG	On-Demand	Mild	KCNK3	74	35
C=C(Cl)CSCCC(=O)Nc1cccc(OC)c1	ZINC000853783650	CH	On-Demand	Mild	DRD4	40	31
C=C(Cl)CSCCC(=O)Nc1cccc(OC)c1	ZINC000853783650	CH	On-Demand	Mild	MTNR1A	40	53
C=C(Cl)CSCCC(=O)Nc1cccc(OC)c1	ZINC000853783650	CH	On-Demand	Mild	MTNR1B	42	57
C=C(Cl)CSCCC(=O)Nc1cccc(OC)c1	ZINC000853783650	CH	On-Demand	Mild	EPHX2	19	45
C=C(Cl)CSCCC(=O)Nc1cccc(OC)c1	ZINC000853783650	CH	On-Demand	Mild	TAAR1	35	45
C=C(Cl)CSCCC(=O)Nc1cccc(OC)c1	ZINC000853783650	CH	On-Demand	Mild	ENPP1	50	31
C=C(Cl)CS[C@H](C)C(=O)Nc1cc(Cl)ccc1OC	ZINC000853783654	DI	On-Demand	Mild	CPT1A	44	30
C=C(Cl)CS[C@H](C)C(=O)Nc1cc(Cl)ccc1OC	ZINC000853783654	DI	On-Demand	Mild	RBP4	18	43
C=C(Cl)CS[C@@H](C)C(=O)Nc1cc(Cl)ccc1OC	ZINC000853783655	DI	On-Demand	Mild	CPT1A	44	30
C=C(Cl)CS[C@@H](C)C(=O)Nc1cc(Cl)ccc1OC	ZINC000853783655	DI	On-Demand	Mild	RBP4	18	43
C=C(Cl)CSCC(=O)NCc1ccccc1C	ZINC000853783668	CG	On-Demand	Mild	P2RX7	43	46
C=C(Cl)CSCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000853783671	EE	On-Demand	Mild	CA5B	16	41
C=C(Cl)CSCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000853783671	EE	On-Demand	Mild	CA5A	19	41
C=C(Cl)CSCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000853783671	EE	On-Demand	Mild	CA9	16	43
C=C(Cl)CSCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000853783671	EE	On-Demand	Mild	O49150_SOLTU	41	31
C=C(Cl)CS[C@@H](C)C(=O)NCCCCC	ZINC000853783674	BG	On-Demand	Mild	ASAH1	75	36
C=C(Cl)CS[C@H](C)C(=O)NCCCCC	ZINC000853783675	BG	On-Demand	Mild	ASAH1	75	36
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000853783681	CJ	On-Demand	Mild	CXCL8	47	38
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1C(C)C	ZINC000853783682	CJ	On-Demand	Mild	CXCL8	47	38
C=C(Cl)CSCC(=O)Nc1cc(C(F)(F)F)ccc1OCCOC	ZINC000853783687	GI	On-Demand	Mild	PPARD	27	40
C=C(Cl)CSCC(=O)NCc1ccc(OCCC)cc1	ZINC000853783689	DH	On-Demand	Mild	PLA2G4B	52	35
C=C(Cl)CSCC(=O)NCc1ccc(OCCC)cc1	ZINC000853783689	DH	On-Demand	Mild	PDS	47	35
C=C(Cl)CSCCc1nc2ccccc2n1C	ZINC000853783699	CH	On-Demand	Mild	GRM2	15	40
C=C(Cl)CSCC(=O)NCc1ccccc1OC	ZINC000853783712	CF	On-Demand	Mild	TACR1	15	44
C=C(Cl)CSCC(=O)NCc1ccccc1OC	ZINC000853783712	CF	On-Demand	Mild	P2RX7	23	46
C=C(Cl)CSCC(=O)NCc1ccccc1OC	ZINC000853783712	CF	On-Demand	Mild	MBTPS1	43	31
C=C(Cl)CSCCC(=O)Nc1ccc(F)cc1	ZINC000853783715	CH	On-Demand	Mild	HDAC10	15	40
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1OCC	ZINC000853783754	CH	On-Demand	Mild	HCN1	48	33
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1OCC	ZINC000853783754	CH	On-Demand	Mild	HCN4	40	33
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1OCC	ZINC000853783755	CH	On-Demand	Mild	HCN1	48	33
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1OCC	ZINC000853783755	CH	On-Demand	Mild	HCN4	40	33
C=C(Cl)CSCCn1ccnc1	ZINC000853783757	BE	On-Demand	Mild	CYP11B1	16	41
C=C(Cl)CSCCn1ccnc1	ZINC000853783757	BE	On-Demand	Mild	TBXAS1	32	44
C=C(Cl)CSCCn1ccnc1	ZINC000853783757	BE	On-Demand	Mild	HMOX2	46	33
C[C@H](SCC=C(Cl)Cl)C(=O)NCCc1ccccc1	ZINC000853783771	DH	On-Demand	Anodyne	MME	41	38
C[C@H](SCC=C(Cl)Cl)C(=O)NCCc1ccccc1	ZINC000853783771	DH	On-Demand	Anodyne	MMP2	19	42
C[C@H](SCC=C(Cl)Cl)C(=O)NCCc1ccccc1	ZINC000853783771	DH	On-Demand	Anodyne	AMP1_PLAFQ	39	47
C=C(Cl)CSCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853783794	CH	On-Demand	Mild	EPHX2	75	47
C[C@H](SCC=C(Cl)Cl)C(=O)NCc1ccccc1	ZINC000853783807	DH	On-Demand	Anodyne	ANPEP	33	46
C[C@H](SCC=C(Cl)Cl)C(=O)NCc1ccccc1	ZINC000853783807	DH	On-Demand	Anodyne	PAPA1_CARPA	30	40
C[C@H](SCC=C(Cl)Cl)C(=O)NCc1ccccc1	ZINC000853783807	DH	On-Demand	Anodyne	AMP1_PLAFQ	55	46
C[C@H](SCC=C(Cl)Cl)C(=O)NCc1ccccc1	ZINC000853783807	DH	On-Demand	Anodyne	PDS	52	38
C=C(Cl)CSCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000853783832	GG	On-Demand	Mild	LPL	40	38
C=C(Cl)CSCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000853783832	GG	On-Demand	Mild	TGM2	85	51
C=C(Cl)CSCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000853783832	GG	On-Demand	Mild	F13A1	113	55
C=C(Cl)CSCC(=O)Nc1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000853783832	GG	On-Demand	Mild	NAMPT	44	51
C=C(Cl)CSCC(=O)NCc1ccc(OC)c(OC)c1	ZINC000853783837	DF	On-Demand	Mild	PDE6A	41	32
C=C(Cl)CSCC(=O)NCc1ccc(OC)c(OC)c1	ZINC000853783837	DF	On-Demand	Mild	MT-ND1	24	45
C=C(Cl)CSCC(=O)NCc1ccc(OC)c(OC)c1	ZINC000853783837	DF	On-Demand	Mild	ENPP1	68	32
C=C(Cl)CSCC(=O)NCc1ccc(OC)c(OC)c1	ZINC000853783837	DF	On-Demand	Mild	DRTS_TRYCR	45	32
O=C(CSCC=C(Cl)Cl)Nc1ccc2c(c1)OCO2	ZINC000853783848	DG	On-Demand	Anodyne	DYRK2	51	35
C[S@@](=O)CCNC(=O)N1CCc2sccc2[C@@H]1c1ccc(Cl)cc1	ZINC000853783887	GG	On-Demand	Anodyne	TRPM8	32	61
C[S@@](=O)CCNC(=O)N1CCc2sccc2[C@H]1c1ccc(Cl)cc1	ZINC000853783888	GG	On-Demand	Anodyne	TRPM8	32	61
C=C(Cl)CS[C@@H](C)C(=O)N[C@H]1CCOc2ccccc21	ZINC000853783916	DH	On-Demand	Mild	BIRC3	55	39
C=C(Cl)CS[C@H](C)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000853783917	DH	On-Demand	Mild	BIRC3	55	39
C=C(Cl)CS[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000853783918	DH	On-Demand	Mild	BIRC3	55	39
C=C(Cl)CS[C@H](C)C(=O)N[C@H]1CCOc2ccccc21	ZINC000853783919	DH	On-Demand	Mild	BIRC3	55	39
C=C(Cl)CSCCC(=O)NCc1ccccc1Cl	ZINC000853783931	DH	On-Demand	Mild	P2RX7	57	43
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1SC	ZINC000853783934	DI	On-Demand	Mild	CXCL8	43	33
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1SC	ZINC000853783935	DI	On-Demand	Mild	CXCL8	43	33
C=C(Cl)CSCCC(=O)Nc1ccccc1	ZINC000853783936	CH	On-Demand	Mild	LTA4H	25	44
C=C(Cl)CSCCC(=O)Nc1ccccc1	ZINC000853783936	CH	On-Demand	Mild	HDAC10	26	46
C=C(Cl)CSCCC(=O)Nc1ccccc1	ZINC000853783936	CH	On-Demand	Mild	HDAC2	19	46
C=C(Cl)CSCCC(=O)Nc1ccccc1	ZINC000853783936	CH	On-Demand	Mild	HDAC3	26	46
C=C(Cl)CSCCC(=O)Nc1ccccc1	ZINC000853783936	CH	On-Demand	Mild	HDAC6	23	46
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	MME	54	38
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	ANPEP	40	47
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	CAPNS1	42	31
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	FURIN	48	34
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	CAPN2	51	36
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	NPR	42	33
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	AMP1_PLAFQ	58	47
C=C(Cl)CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853783941	CG	On-Demand	Mild	PDS	53	38
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	MME	54	38
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	ANPEP	40	47
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	CAPNS1	42	31
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	FURIN	48	34
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	CAPN2	51	36
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	NPR	42	33
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	AMP1_PLAFQ	58	47
C=C(Cl)CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853783942	CG	On-Demand	Mild	PDS	53	38
C=C(Cl)CS[C@H](C)C(=O)N1CCc2ccccc2C1	ZINC000853783951	CG	On-Demand	Mild	DPP8	28	47
C=C(Cl)CS[C@@H](C)C(=O)N1CCc2ccccc2C1	ZINC000853783952	CG	On-Demand	Mild	DPP8	28	47
C=C(Cl)CSCC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853783958	EF	On-Demand	Mild	DRD4	17	41
C=C(Cl)CSCC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853783958	EF	On-Demand	Mild	MAPK14	29	43
C=C(Cl)CSCC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853783958	EF	On-Demand	Mild	CCR2	50	39
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	DRD4	41	31
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	ROCK1	35	41
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	MTNR1A	41	42
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	MTNR1B	42	42
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	ROCK2	42	41
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	AMP1_PLAFQ	30	43
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	CARM1	35	40
C=C(Cl)CS[C@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783961	CG	On-Demand	Mild	PDS	65	43
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	DRD4	41	31
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	ROCK1	35	41
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	MTNR1A	41	42
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	MTNR1B	42	42
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	ROCK2	42	41
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	AMP1_PLAFQ	30	43
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	CARM1	35	40
C=C(Cl)CS[C@@H](C)C(=O)NCc1cccc(OC)c1	ZINC000853783962	CG	On-Demand	Mild	PDS	65	43
C=C(Cl)CSCC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853783967	DF	On-Demand	Mild	KCNK3	61	38
C=C(Cl)CSCC(=O)N1CCC[C@H]1c1ccc(OCC)cc1	ZINC000853783968	EI	On-Demand	Mild	CPT1A	77	36
C=C(Cl)CSCC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1	ZINC000853783969	EI	On-Demand	Mild	CPT1A	77	36
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1CC	ZINC000853783976	CI	On-Demand	Mild	CXCL8	49	35
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1CC	ZINC000853783976	CI	On-Demand	Mild	KCNQ2	46	33
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1CC	ZINC000853783977	CI	On-Demand	Mild	CXCL8	49	35
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1CC	ZINC000853783977	CI	On-Demand	Mild	KCNQ2	46	33
C=C(Cl)CS[C@H](C)C(=O)Nc1ccccc1C	ZINC000853783988	CH	On-Demand	Mild	CXCL8	41	41
C=C(Cl)CS[C@@H](C)C(=O)Nc1ccccc1C	ZINC000853783989	CH	On-Demand	Mild	CXCL8	41	41
C=C(Cl)CSCCC(=O)Nc1ccc(OC)cc1	ZINC000853783992	CH	On-Demand	Mild	MTNR1A	17	44
C=C(Cl)CSCCC(=O)Nc1ccc(OC)cc1	ZINC000853783992	CH	On-Demand	Mild	MTNR1B	21	44
C=C(Cl)CSCCC(=O)Nc1ccc(OC)cc1	ZINC000853783992	CH	On-Demand	Mild	CA9	17	42
C=C(Cl)CSCCC(=O)Nc1ccc(OC)cc1	ZINC000853783992	CH	On-Demand	Mild	ENPP1	69	33
C=C(Cl)CSCC(=O)NCCCCC	ZINC000853784029	BF	On-Demand	Mild	EST1_PIG	41	33
C=C(Cl)CSCC(=O)NCCCCC	ZINC000853784029	BF	On-Demand	Mild	ASAH1	85	37
C=C(Cl)CSCCC(=O)Nc1cccnc1	ZINC000853784037	CF	On-Demand	Mild	HDAC3	15	53
C=C(Cl)CSCCC(=O)Nc1cccnc1	ZINC000853784037	CF	On-Demand	Mild	NAMPT	28	41
C=C(Cl)CSCC(=O)NCC1(c2ccccc2)CCOCC1	ZINC000853784045	EG	On-Demand	Mild	KCNA3	44	40
C=C(Cl)CSCC(=O)NCc1cccc(COC(C)C)c1	ZINC000853784047	EH	On-Demand	Mild	PDS	53	33
C=C(Cl)CSCCc1cccnc1	ZINC000853784051	BG	On-Demand	Mild	TBXAS1	28	45
C[S@@](=O)CCNC(=O)N1CCC[C@@]1(C)Cc1ccccc1Cl	ZINC000853784115	EF	On-Demand	Anodyne	SLC12A5	58	35
C[S@@](=O)CCNC(=O)N1CCC[C@]1(C)Cc1ccccc1Cl	ZINC000853784116	EF	On-Demand	Anodyne	SLC12A5	58	35
C=C(Cl)CSCC(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000853784118	EG	On-Demand	Mild	SLC18A2	40	37
C=C(Cl)CSCC(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000853784118	EG	On-Demand	Mild	ABCB1B	46	34
C=C(Cl)CSCC(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000853784118	EG	On-Demand	Mild	ABCB1	20	53
C=C(Cl)CS[C@H](C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000853784126	DJ	On-Demand	Mild	CXCL8	28	45
C=C(Cl)CS[C@H](C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000853784126	DJ	On-Demand	Mild	SOAT1	50	39
C=C(Cl)CS[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000853784128	DJ	On-Demand	Mild	CXCL8	28	45
C=C(Cl)CS[C@@H](C)C(=O)Nc1c(C)cccc1C(C)C	ZINC000853784128	DJ	On-Demand	Mild	SOAT1	50	39
C=C(Cl)CSCC(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000853784130	EH	On-Demand	Mild	P2RX7	68	51
COc1ccccc1NC(=O)CSCC=C(Cl)Cl	ZINC000853784131	DH	On-Demand	Anodyne	FAS	56	40
C=C(Cl)CSCC(=O)N[C@H](C)CCCCC	ZINC000853784138	CH	On-Demand	Mild	NOD1	58	37
C=C(Cl)CSCC(=O)N[C@@H](C)CCCCC	ZINC000853784140	CH	On-Demand	Mild	NOD1	58	37
C[S@@](=O)CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853784173	FD	On-Demand	Anodyne	HTR1A	37	47
C[S@@](=O)CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853784173	FD	On-Demand	Anodyne	DRD2	22	42
C[S@@](=O)CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853784173	FD	On-Demand	Anodyne	HTR2A	27	40
C[S@@](=O)CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853784173	FD	On-Demand	Anodyne	DRD3	32	40
C=C(Cl)CSCCC(=O)NCc1ccc(OC)cc1OC	ZINC000853784188	EG	On-Demand	Mild	MTNR1A	66	37
C=C(Cl)CSCCC(=O)NCc1ccc(OC)cc1OC	ZINC000853784188	EG	On-Demand	Mild	MTNR1B	54	37
C=C(Cl)CSCC(=O)NCc1ccc(NC(=O)OC)cc1	ZINC000853784196	EF	On-Demand	Mild	TPSAB1	17	42
C[S@@](=O)CCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853784197	DC	On-Demand	Anodyne	L3MBTL3	44	37
C[S@@](=O)CCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853784199	DC	On-Demand	Anodyne	L3MBTL3	44	37
C=C(Cl)CS[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853784226	CG	On-Demand	Mild	HTR1A	54	44
C=C(Cl)CS[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000853784227	CG	On-Demand	Mild	HTR1A	54	44
C=C(Cl)CSCC(=O)NCc1cccc(COC)c1	ZINC000853784228	CF	On-Demand	Mild	PDS	46	32
COC[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)C(C)C	ZINC000853784230	EG	On-Demand	Reactive	CSNK1D	43	46
COC[C@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)C(C)C	ZINC000853784231	EG	On-Demand	Reactive	CSNK1D	43	46
C=C(Cl)CS[C@H](Cc1ccccc1)C(N)=O	ZINC000853784232	CF	On-Demand	Mild	NPFFR1	60	33
C=C(Cl)CS[C@@H](Cc1ccccc1)C(N)=O	ZINC000853784233	CF	On-Demand	Mild	NPFFR1	60	33
C[C@H](SCC=C(Cl)Cl)C(=O)NCc1ccc(F)cc1	ZINC000853784302	DH	On-Demand	Anodyne	AMP1_PLAFQ	18	42
O=C(CSCC=C(Cl)Cl)NCc1cccs1	ZINC000853784358	CG	On-Demand	Anodyne	CA5B	30	41
O=C(CSCC=C(Cl)Cl)NCc1cccs1	ZINC000853784358	CG	On-Demand	Anodyne	CA5A	29	41
COCCn1c(SCC(=O)Nc2ccccc2C(C)=O)nc(O)cc1=O	ZINC000853784361	GD	On-Demand	Anodyne	FAS	43	43
C[C@H](SCC=C(Cl)Cl)C(=O)Nc1ccccc1Cl	ZINC000853784367	DJ	On-Demand	Anodyne	CXCL8	53	38
Cc1ccccc1CNC(=O)CSCC=C(Cl)Cl	ZINC000853784393	DH	On-Demand	Anodyne	P2RX7	29	44
O=C(CSCC=C(Cl)Cl)Nc1ccc(N2CCOCC2)cc1	ZINC000853784394	FH	On-Demand	Anodyne	MTOR	45	38
O=C(CSCC=C(Cl)Cl)Nc1ccc(N2CCOCC2)cc1	ZINC000853784394	FH	On-Demand	Anodyne	EPHX2	15	45
O=C(CSCC=C(Cl)Cl)Nc1ccc(N2CCOCC2)cc1	ZINC000853784394	FH	On-Demand	Anodyne	STAT6	53	33
CN(C(=O)NCC[S@](C)=O)[C@H](CO)Cc1ccccc1	ZINC000853784408	CC	On-Demand	Anodyne	MME	42	40
CN(C(=O)NCC[S@](C)=O)[C@H](CO)Cc1ccccc1	ZINC000853784408	CC	On-Demand	Anodyne	NPY5R	20	43
CN(C(=O)NCC[S@](C)=O)[C@H](CO)Cc1ccccc1	ZINC000853784408	CC	On-Demand	Anodyne	NPFFR1	41	31
CN(C(=O)NCC[S@@](C)=O)[C@H](CO)Cc1ccccc1	ZINC000853784409	CC	On-Demand	Anodyne	MME	42	40
CN(C(=O)NCC[S@@](C)=O)[C@H](CO)Cc1ccccc1	ZINC000853784409	CC	On-Demand	Anodyne	NPY5R	20	43
CN(C(=O)NCC[S@@](C)=O)[C@H](CO)Cc1ccccc1	ZINC000853784409	CC	On-Demand	Anodyne	NPFFR1	41	31
CN(C(=O)NCC[S@](C)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784410	CC	On-Demand	Anodyne	MME	42	40
CN(C(=O)NCC[S@](C)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784410	CC	On-Demand	Anodyne	NPY5R	20	43
CN(C(=O)NCC[S@](C)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784410	CC	On-Demand	Anodyne	NPFFR1	41	31
CN(C(=O)NCC[S@@](C)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784411	CC	On-Demand	Anodyne	MME	42	40
CN(C(=O)NCC[S@@](C)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784411	CC	On-Demand	Anodyne	NPY5R	20	43
CN(C(=O)NCC[S@@](C)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784411	CC	On-Demand	Anodyne	NPFFR1	41	31
COCCn1c(SCC(=O)Nc2c(C(C)C)cccc2C(C)C)nc(O)cc1=O	ZINC000853784416	HH	On-Demand	Anodyne	SOAT1	54	40
COc1ccc(NC(=O)[C@H](C)SCC=C(Cl)Cl)cc1	ZINC000853784435	DI	On-Demand	Anodyne	MTNR1A	16	40
COc1ccc(NC(=O)[C@H](C)SCC=C(Cl)Cl)cc1	ZINC000853784435	DI	On-Demand	Anodyne	MTNR1B	19	42
C[S@@](=O)CCNC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853784464	DC	On-Demand	Anodyne	CASR	43	40
C[S@@](=O)CCNC(=O)N1CCC[C@]1(C)Cc1ccc(OC(F)(F)F)cc1	ZINC000853784484	GG	On-Demand	Anodyne	SLC12A5	63	37
C[S@@](=O)CCNC(=O)N1CCC[C@@]1(C)Cc1ccc(OC(F)(F)F)cc1	ZINC000853784487	GG	On-Demand	Anodyne	SLC12A5	63	37
O=C(CSCC=C(Cl)Cl)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853784511	FH	On-Demand	Anodyne	KCNK3	49	33
O=C(CSCC=C(Cl)Cl)NCc1ccccc1	ZINC000853784513	CG	On-Demand	Anodyne	CA5B	24	43
O=C(CSCC=C(Cl)Cl)NCc1ccccc1	ZINC000853784513	CG	On-Demand	Anodyne	CA5A	27	43
O=C(CSCC=C(Cl)Cl)NCc1ccccc1	ZINC000853784513	CG	On-Demand	Anodyne	PDS	48	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1coc(-c2ccccc2)n1	ZINC000853784519	FF	On-Demand	Mild	PDE8B	48	32
COC[C@@H](NC(=O)NCC[S@](C)=O)c1cccc(OC)c1	ZINC000853784599	DD	On-Demand	Anodyne	DRD4	42	32
COC[C@@H](NC(=O)NCC[S@](C)=O)c1cccc(OC)c1	ZINC000853784599	DD	On-Demand	Anodyne	MTNR1A	45	41
COC[C@@H](NC(=O)NCC[S@](C)=O)c1cccc(OC)c1	ZINC000853784599	DD	On-Demand	Anodyne	MTNR1B	46	41
COC[C@@H](NC(=O)NCC[S@@](C)=O)c1cccc(OC)c1	ZINC000853784600	DD	On-Demand	Anodyne	DRD4	42	32
COC[C@@H](NC(=O)NCC[S@@](C)=O)c1cccc(OC)c1	ZINC000853784600	DD	On-Demand	Anodyne	MTNR1A	45	41
COC[C@@H](NC(=O)NCC[S@@](C)=O)c1cccc(OC)c1	ZINC000853784600	DD	On-Demand	Anodyne	MTNR1B	46	41
COC[C@H](NC(=O)NCC[S@@](C)=O)c1cccc(OC)c1	ZINC000853784601	DD	On-Demand	Anodyne	DRD4	42	32
COC[C@H](NC(=O)NCC[S@@](C)=O)c1cccc(OC)c1	ZINC000853784601	DD	On-Demand	Anodyne	MTNR1A	45	41
COC[C@H](NC(=O)NCC[S@@](C)=O)c1cccc(OC)c1	ZINC000853784601	DD	On-Demand	Anodyne	MTNR1B	46	41
COC[C@H](NC(=O)NCC[S@](C)=O)c1cccc(OC)c1	ZINC000853784602	DD	On-Demand	Anodyne	DRD4	42	32
COC[C@H](NC(=O)NCC[S@](C)=O)c1cccc(OC)c1	ZINC000853784602	DD	On-Demand	Anodyne	MTNR1A	45	41
COC[C@H](NC(=O)NCC[S@](C)=O)c1cccc(OC)c1	ZINC000853784602	DD	On-Demand	Anodyne	MTNR1B	46	41
COCCn1c(SCC(=O)Nc2sc3c(c2C#N)CCCCC3)nc(O)cc1=O	ZINC000853784607	IF	On-Demand	Mild	VIPR1	30	49
O=C(NCc1coc(-c2ccccc2)n1)N1CCC(N2CCOC2=O)CC1	ZINC000853784657	FE	On-Demand	Anodyne	PDE8B	54	32
C[S@@](=O)CCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853784667	EC	On-Demand	Anodyne	SIGMAR1	19	42
C[S@@](=O)CCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853784667	EC	On-Demand	Anodyne	CCR3	35	42
C[S@@](=O)CCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853784667	EC	On-Demand	Anodyne	MCHR1	16	43
C[S@@](=O)CCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853784668	EC	On-Demand	Anodyne	SIGMAR1	19	42
C[S@@](=O)CCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853784668	EC	On-Demand	Anodyne	CCR3	35	42
C[S@@](=O)CCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853784668	EC	On-Demand	Anodyne	MCHR1	16	43
O=C(CSCC=C(Cl)Cl)NCc1ccc2c(c1)OCO2	ZINC000853784693	EG	On-Demand	Anodyne	NOS2	100	38
COc1cccc(C2(NC(=O)NCC[S@](C)=O)CCC2)c1	ZINC000853784706	DD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(C2(NC(=O)NCC[S@](C)=O)CCC2)c1	ZINC000853784706	DD	On-Demand	Anodyne	MTNR1A	43	37
COc1cccc(C2(NC(=O)NCC[S@](C)=O)CCC2)c1	ZINC000853784706	DD	On-Demand	Anodyne	MTNR1B	40	37
COc1cccc(C2(NC(=O)NCC[S@@](C)=O)CCC2)c1	ZINC000853784707	DD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(C2(NC(=O)NCC[S@@](C)=O)CCC2)c1	ZINC000853784707	DD	On-Demand	Anodyne	MTNR1A	43	37
COc1cccc(C2(NC(=O)NCC[S@@](C)=O)CCC2)c1	ZINC000853784707	DD	On-Demand	Anodyne	MTNR1B	40	37
O=C(CCSCC=C(Cl)Cl)N1CCN(c2ccccn2)CC1	ZINC000853784731	FG	On-Demand	Anodyne	DRD4	26	41
C[S@@](=O)CCNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853784738	DD	On-Demand	Anodyne	SLC6A3	16	44
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	MME	86	39
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	FCER2	44	33
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	CAPNS1	57	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	HLA-DRB1	45	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	CAPN2	49	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	ACE2	41	35
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	NPR	56	35
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@](C)=O	ZINC000853784742	FG	On-Demand	Anodyne	AMP1_PLAFQ	46	37
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	MME	86	39
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	FCER2	44	33
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	CAPNS1	57	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	HLA-DRB1	45	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	CAPN2	49	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	ACE2	41	35
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	NPR	56	35
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCC[S@@](C)=O	ZINC000853784744	FG	On-Demand	Anodyne	AMP1_PLAFQ	46	37
C[S@@](=O)CCNC(=O)N1CCC[C@@]1(C)Cc1ccccc1C(F)(F)F	ZINC000853784747	GG	On-Demand	Anodyne	SLC12A5	60	37
C[S@@](=O)CCNC(=O)N1CCC[C@]1(C)Cc1ccccc1C(F)(F)F	ZINC000853784749	GG	On-Demand	Anodyne	SLC12A5	60	37
O=C(CSCC=C(Cl)Cl)Nc1ccccc1C(F)(F)F	ZINC000853784750	EJ	On-Demand	Anodyne	RBP4	57	33
COc1ccc(NC(=O)[C@H](C)SCC=C(Cl)Cl)c(OC)c1	ZINC000853784760	FI	On-Demand	Anodyne	CYP1B1	15	46
O=C(CSCC[C@H]1CCCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853784777	FG	On-Demand	Anodyne	MTOR	75	37
O=C(CSCC[C@H]1CCCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853784777	FG	On-Demand	Anodyne	TNK2	15	40
O=C(CSCC[C@@H]1CCCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853784778	FG	On-Demand	Anodyne	MTOR	75	37
O=C(CSCC[C@@H]1CCCCO1)Nc1ccc(N2CCOCC2)cc1	ZINC000853784778	FG	On-Demand	Anodyne	TNK2	15	40
COc1ccc(C)cc1NC(=O)CSCC=C(Cl)Cl	ZINC000853784799	DH	On-Demand	Anodyne	ENPP1	61	31
O=C(NCc1coc(-c2ccccc2)n1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853784825	FE	On-Demand	Anodyne	PDE8B	53	33
O=C(NCc1coc(-c2ccccc2)n1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853784826	FE	On-Demand	Anodyne	PDE8B	53	33
COCCN(CCF)C(=O)NCc1coc(-c2ccccc2)n1	ZINC000853784838	DE	On-Demand	Anodyne	PDE8B	40	33
CN(C(=O)NCCOCCS(C)(=O)=O)[C@H](CO)Cc1ccccc1	ZINC000853784915	FC	On-Demand	Anodyne	NPY5R	19	41
CN(C(=O)NCCOCCS(C)(=O)=O)[C@H](CO)Cc1ccccc1	ZINC000853784915	FC	On-Demand	Anodyne	CAPN2	44	32
CN(C(=O)NCCOCCS(C)(=O)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784916	FC	On-Demand	Anodyne	NPY5R	19	41
CN(C(=O)NCCOCCS(C)(=O)=O)[C@@H](CO)Cc1ccccc1	ZINC000853784916	FC	On-Demand	Anodyne	CAPN2	44	32
Cc1ccc(N2CC[C@H](NC(=O)N3CCCC[C@H]3c3nc[nH]n3)C2=O)cc1	ZINC000853785052	FE	On-Demand	Anodyne	CPT1A	45	34
Cc1ccc(N2CC[C@H](NC(=O)N3CCCC[C@@H]3c3nc[nH]n3)C2=O)cc1	ZINC000853785054	FE	On-Demand	Anodyne	CPT1A	45	34
COCCn1c(SCc2cc(=O)oc3cc4c(cc23)CCC4)nc(O)cc1=O	ZINC000853785066	HE	On-Demand	Anodyne	HSD17B3	18	42
C[C@H]1C[C@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)CCN1C	ZINC000853785089	FG	On-Demand	Reactive	LCK	20	41
C[C@@H](CCNC(=O)NCCOCCS(C)(=O)=O)N(C)C	ZINC000853785146	DB	On-Demand	Anodyne	CHRNA4	21	41
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(OCc3ccccc3)cc2)nc(O)cc1=O	ZINC000853785166	JG	On-Demand	Anodyne	TSHR	57	38
COCCn1c(S[C@H](C)C(=O)Nc2ccc(OCc3ccccc3)cc2)nc(O)cc1=O	ZINC000853785167	JG	On-Demand	Anodyne	TSHR	57	38
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)C1CCCC1	ZINC000853785205	GG	On-Demand	Anodyne	MTOR	60	36
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)C1CCCCC1	ZINC000853785213	GH	On-Demand	Anodyne	MTOR	56	36
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)C1CCCCC1	ZINC000853785213	GH	On-Demand	Anodyne	CTSS	15	45
Cc1ccc(N2CC[C@H](NC(=O)N(C)[C@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853785236	GE	On-Demand	Anodyne	ACE	45	39
Cc1ccc(N2CC[C@H](NC(=O)N(C)[C@@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853785238	GE	On-Demand	Anodyne	ACE	45	39
COCCn1c(SCC(=O)Nc2ccc3c(c2)OCCCO3)nc(O)cc1=O	ZINC000853785267	HD	On-Demand	Anodyne	ENPP1	68	33
COCCCN(C)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853785326	FF	On-Demand	Reactive	LCK	22	44
COCCCN(C)CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853785326	FF	On-Demand	Reactive	CSNK1D	39	46
COCCn1c(SCC(=O)Nc2ccc3c(c2)CCC3)nc(O)cc1=O	ZINC000853785335	GD	On-Demand	Anodyne	ENPP1	71	35
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc(O)cc1=O	ZINC000853785410	JD	On-Demand	Anodyne	F13A1	50	37
COCCn1c(S[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCCCC3)cc2)nc(O)cc1=O	ZINC000853785411	JD	On-Demand	Anodyne	F13A1	50	37
COCCn1c(SCC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)nc(O)cc1=O	ZINC000853785458	ID	On-Demand	Anodyne	EPHX2	84	40
COCCn1c(SCc2cc(=O)oc3cc(C)c(C(C)C)cc23)nc(O)cc1=O	ZINC000853785460	HG	On-Demand	Anodyne	HSD17B3	17	42
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785488	ID	On-Demand	Anodyne	PIK3CA	32	40
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785488	ID	On-Demand	Anodyne	MTOR	60	40
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785488	ID	On-Demand	Anodyne	PIK3CG	28	40
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785488	ID	On-Demand	Anodyne	STAT6	52	34
COCCn1c(S[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785490	ID	On-Demand	Anodyne	PIK3CA	32	40
COCCn1c(S[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785490	ID	On-Demand	Anodyne	MTOR	60	40
COCCn1c(S[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785490	ID	On-Demand	Anodyne	PIK3CG	28	40
COCCn1c(S[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853785490	ID	On-Demand	Anodyne	STAT6	52	34
COCCn1c(SCc2cc(=O)oc3cc(C)ccc23)nc(O)cc1=O	ZINC000853785521	FE	On-Demand	Anodyne	HSD17B3	24	48
COCCn1c(S[C@H](C)C(=O)NCCc2ccc(F)cc2)nc(O)cc1=O	ZINC000853785649	GD	On-Demand	Anodyne	CNR2	29	40
COCCn1c(S[C@@H](C)C(=O)NCCc2ccc(F)cc2)nc(O)cc1=O	ZINC000853785651	GD	On-Demand	Anodyne	CNR2	29	40
COCCn1c(SCc2ccc(F)cc2Cl)nc(O)cc1=O	ZINC000853785745	EF	On-Demand	Anodyne	P2RX7	44	41
Cc1ccc(N2CC[C@H](NC(=O)N[C@H]3Cc4ccccc4N(C)C3=O)C2=O)cc1	ZINC000853785769	GD	On-Demand	Anodyne	PYGL	32	51
Cc1ccc(N2CC[C@H](NC(=O)N[C@H]3Cc4ccccc4N(C)C3=O)C2=O)cc1	ZINC000853785769	GD	On-Demand	Anodyne	PYGM	30	51
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H]3Cc4ccccc4N(C)C3=O)C2=O)cc1	ZINC000853785771	GD	On-Demand	Anodyne	PYGL	32	51
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H]3Cc4ccccc4N(C)C3=O)C2=O)cc1	ZINC000853785771	GD	On-Demand	Anodyne	PYGM	30	51
Cc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3CCCN(CC4CC4)C3)C2=O)cc1	ZINC000853785776	GF	On-Demand	Anodyne	CCR3	46	38
Cc1ccc(N2CC[C@H](NC(=O)NC[C@H]3CCCN(CC4CC4)C3)C2=O)cc1	ZINC000853785778	GF	On-Demand	Anodyne	CCR3	46	38
CCOC(=O)Nc1ccc2c(CSc3nc(O)cc(=O)n3CCOC)cc(=O)oc2c1	ZINC000853785843	IF	On-Demand	Anodyne	HSD17B3	19	43
COC[C@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853785858	EH	On-Demand	Anodyne	SLC1A1	23	44
COC[C@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853785858	EH	On-Demand	Anodyne	SLC1A2	39	44
COC[C@@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853785860	EH	On-Demand	Anodyne	SLC1A1	23	44
COC[C@@H](CSCC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853785860	EH	On-Demand	Anodyne	SLC1A2	39	44
COCCn1c(SCc2cc(=O)oc3cc(NC(C)=O)ccc23)nc(O)cc1=O	ZINC000853785931	HD	On-Demand	Anodyne	HSD17B3	19	45
Cc1oncc1CSCCC(=O)Nc1ccccc1	ZINC000853785958	CG	On-Demand	Anodyne	HDAC10	17	40
COC(=O)c1ccc([N+](=O)[O-])c(CSCc2cnoc2C)c1	ZINC000853786012	DG	On-Demand	Bother	GSTM2	45	36
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@H]1CCc2c(O)cccc21	ZINC000853786027	GH	On-Demand	Anodyne	ADRB3	18	41
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H]1CCc2c(O)cccc21	ZINC000853786030	GH	On-Demand	Anodyne	ADRB3	18	41
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@H]1CCc2c(O)cccc21	ZINC000853786031	GH	On-Demand	Anodyne	ADRB3	18	41
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H]1CCc2c(O)cccc21	ZINC000853786032	GH	On-Demand	Anodyne	ADRB3	18	41
Cc1oncc1CSCC(=O)NCC1(c2ccccc2)CCCC1	ZINC000853786110	EH	On-Demand	Anodyne	KCNA3	40	37
C[C@H](O)CCS[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853786120	CF	On-Demand	Anodyne	SAP2	42	37
C[C@H](O)CCS[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853786123	CF	On-Demand	Anodyne	SAP2	42	37
C[C@H](O)CCSCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000853786163	EG	On-Demand	Anodyne	CYNT	36	42
CCCCC[C@@H](C)NC(=O)CSCC[C@H](C)O	ZINC000853786165	CF	On-Demand	Anodyne	EST1_PIG	42	35
CCCCC[C@@H](C)NC(=O)CSCC[C@H](C)O	ZINC000853786165	CF	On-Demand	Anodyne	NOD1	67	38
CCCCC[C@@H](C)NC(=O)CSCC[C@H](C)O	ZINC000853786165	CF	On-Demand	Anodyne	CQSS	40	33
CCCCC[C@@H](C)NC(=O)CSCC[C@@H](C)O	ZINC000853786170	CF	On-Demand	Anodyne	EST1_PIG	42	35
CCCCC[C@@H](C)NC(=O)CSCC[C@@H](C)O	ZINC000853786170	CF	On-Demand	Anodyne	NOD1	67	38
CCCCC[C@@H](C)NC(=O)CSCC[C@@H](C)O	ZINC000853786170	CF	On-Demand	Anodyne	CQSS	40	33
CC(=O)Nc1ccccc1CNC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853786200	FG	On-Demand	Anodyne	TRPV1	15	45
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853786209	JC	On-Demand	Anodyne	MERTK	31	42
COCCn1c(S[C@@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853786209	JC	On-Demand	Anodyne	NAMPT	17	40
COCCn1c(S[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853786211	JC	On-Demand	Anodyne	MERTK	31	42
COCCn1c(S[C@H](C)C(=O)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc(O)cc1=O	ZINC000853786211	JC	On-Demand	Anodyne	NAMPT	17	40
COCCn1c(SCc2ncc(-c3ccccc3)o2)nc(O)cc1=O	ZINC000853786228	FF	On-Demand	Anodyne	NPPA	27	40
Cc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)[C@@H](C)c3ccccc3)C2=O)cc1	ZINC000853786258	GF	On-Demand	Anodyne	XIAP	48	33
Cc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)[C@@H](C)c3ccccc3)C2=O)cc1	ZINC000853786258	GF	On-Demand	Anodyne	BIRC8	46	32
COCCn1c(SCc2cc(=O)oc3cc(C)c(C)cc23)nc(O)cc1=O	ZINC000853786259	GF	On-Demand	Anodyne	HSD17B3	20	45
Cc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)[C@H](C)c3ccccc3)C2=O)cc1	ZINC000853786260	GF	On-Demand	Anodyne	XIAP	48	33
Cc1ccc(N2CC[C@H](NC(=O)NC[C@@H](O)[C@H](C)c3ccccc3)C2=O)cc1	ZINC000853786260	GF	On-Demand	Anodyne	BIRC8	46	32
Cc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)[C@H](C)c3ccccc3)C2=O)cc1	ZINC000853786262	GF	On-Demand	Anodyne	XIAP	48	33
Cc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)[C@H](C)c3ccccc3)C2=O)cc1	ZINC000853786262	GF	On-Demand	Anodyne	BIRC8	46	32
Cc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)[C@@H](C)c3ccccc3)C2=O)cc1	ZINC000853786264	GF	On-Demand	Anodyne	XIAP	48	33
Cc1ccc(N2CC[C@H](NC(=O)NC[C@H](O)[C@@H](C)c3ccccc3)C2=O)cc1	ZINC000853786264	GF	On-Demand	Anodyne	BIRC8	46	32
CCOC(=O)c1c(CSc2nc(O)cc(=O)n2CCOC)nc2ccccc2c1-c1ccccc1	ZINC000853786284	JI	On-Demand	Anodyne	TACR3	49	35
CCO[C@H]1C[C@@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCC2	ZINC000853786337	EE	On-Demand	Anodyne	TIMP3	52	34
CCO[C@H]1C[C@@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCC2	ZINC000853786337	EE	On-Demand	Anodyne	HCN1	50	31
CCO[C@H]1C[C@@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCC2	ZINC000853786337	EE	On-Demand	Anodyne	HCN4	48	31
CCO[C@H]1C[C@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCC2	ZINC000853786338	EE	On-Demand	Anodyne	TIMP3	52	34
CCO[C@H]1C[C@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCC2	ZINC000853786338	EE	On-Demand	Anodyne	HCN1	50	31
CCO[C@H]1C[C@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCC2	ZINC000853786338	EE	On-Demand	Anodyne	HCN4	48	31
Cc1oncc1CSCC(=O)NCc1cccc(OCC(F)(F)F)c1	ZINC000853786368	FG	On-Demand	Anodyne	PDS	59	36
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4c(O)cccc43)C2)cc1	ZINC000853786373	FF	On-Demand	Clean	MTNR1A	17	46
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4c(O)cccc43)C2)cc1	ZINC000853786373	FF	On-Demand	Clean	MTNR1B	17	46
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4c(O)cccc43)C2)cc1	ZINC000853786375	FF	On-Demand	Clean	MTNR1A	17	46
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4c(O)cccc43)C2)cc1	ZINC000853786375	FF	On-Demand	Clean	MTNR1B	17	46
Cc1oncc1CSCC(=O)NCC1(c2ccccc2)CC1	ZINC000853786394	DG	On-Demand	Anodyne	KCNA3	40	36
Cc1oncc1CSCC(=O)NCC1(c2ccccc2)CCCCC1	ZINC000853786400	FI	On-Demand	Anodyne	KCNA3	40	37
Cc1oncc1CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853786422	CF	On-Demand	Anodyne	AMP1_PLAFQ	40	41
Cc1oncc1CS[C@H](C)C(=O)NCc1ccccc1	ZINC000853786422	CF	On-Demand	Anodyne	PDS	45	34
Cc1oncc1CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853786423	CF	On-Demand	Anodyne	AMP1_PLAFQ	40	41
Cc1oncc1CS[C@@H](C)C(=O)NCc1ccccc1	ZINC000853786423	CF	On-Demand	Anodyne	PDS	45	34
Cc1oncc1CS[C@@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853786452	EH	On-Demand	Anodyne	EPHX2	44	41
Cc1oncc1CS[C@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853786454	EH	On-Demand	Anodyne	EPHX2	44	41
CCOc1ccc([C@@H]2CCCN2C(=O)CSCc2cnoc2C)cc1	ZINC000853786479	FH	On-Demand	Anodyne	CPT1A	83	36
Cc1oncc1CSCc1ccccc1[N+](=O)[O-]	ZINC000853786488	CG	On-Demand	Bother	COLA	75	34
O=C(CCSCc1cc(C2CC2)no1)N1CCCC1	ZINC000853786503	CF	On-Demand	Anodyne	ETHR	58	34
Cc1oncc1CSCC(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000853786538	GI	On-Demand	Anodyne	PLA2G7	40	31
CON(C)CCNC(=O)NC[C@H](C)Cc1cccs1	ZINC000853786592	CD	On-Demand	Anodyne	CTSC	28	41
CON(C)CCNC(=O)NC[C@@H](C)Cc1cccs1	ZINC000853786604	CD	On-Demand	Anodyne	CTSC	28	41
COCCn1c(SCC(=O)Nc2ccc(Br)cc2C)nc(O)cc1=O	ZINC000853786695	IE	On-Demand	Anodyne	FAS	41	35
COCCn1c(SCC(=O)Nc2ccc(C#N)c(Cl)c2)nc(O)cc1=O	ZINC000853786712	GD	On-Demand	Mild	HSP90AB1	50	32
COCCn1c(SCC(=O)Nc2ccc(C#N)c(Cl)c2)nc(O)cc1=O	ZINC000853786712	GD	On-Demand	Mild	ENPP1	69	34
COCCn1c(SCC(=O)Nc2ccc(C#N)c(Cl)c2)nc(O)cc1=O	ZINC000853786712	GD	On-Demand	Mild	IMDH_CRYPV	16	47
Cc1ccc(CNC(=O)CSCc2cnoc2C)cc1F	ZINC000853786737	DF	On-Demand	Anodyne	P2RX7	17	43
Cc1oncc1CSCC(=O)NCCCC1CCCCC1	ZINC000853786739	DH	On-Demand	Anodyne	BMP1	72	34
Cc1oncc1CSCC(=O)NCc1ccccc1F	ZINC000853786754	CF	On-Demand	Anodyne	P2RX7	33	44
CCCCCNC(=O)CSCc1cnoc1C	ZINC000853786771	CF	On-Demand	Anodyne	ASAH1	76	33
Cc1oncc1CSCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	ZINC000853786873	FD	On-Demand	Anodyne	CA7	18	48
Cc1oncc1CSCC(=O)N1CCc2cc(S(N)(=O)=O)ccc21	ZINC000853786873	FD	On-Demand	Anodyne	EIF2AK3	66	35
C[C@H](O)CCSCc1ccnc(Cl)c1	ZINC000853786884	BF	On-Demand	Anodyne	CACNA2D1	21	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCc2cc(C3CC3)no2)CC1	ZINC000853786904	FE	On-Demand	Anodyne	P2RY12	124	41
CCOC(=O)N1CCN(C(=O)[C@H](C)SCc2cc(C3CC3)no2)CC1	ZINC000853786905	FE	On-Demand	Anodyne	P2RY12	124	41
Cc1oncc1CSCCCNC(=O)C1CCCC1	ZINC000853786906	CF	On-Demand	Anodyne	TBK1	58	32
CCOC(=O)Nc1ccc2c(CSCC[C@@H](C)O)cc(=O)oc2c1	ZINC000853786934	FG	On-Demand	Anodyne	MMP12	19	42
CCOC(=O)Nc1ccc2c(CSCC[C@H](C)O)cc(=O)oc2c1	ZINC000853786935	FG	On-Demand	Anodyne	MMP12	19	42
O=C(CSCc1cc(C2CC2)no1)Nc1ccc(N2CCOCC2)cc1	ZINC000853786937	FG	On-Demand	Anodyne	MTOR	54	35
O=C(CSCc1cc(C2CC2)no1)Nc1ccc(N2CCOCC2)cc1	ZINC000853786937	FG	On-Demand	Anodyne	STAT6	47	33
Cc1oncc1CSCC(=O)NCCc1cccc(Cl)c1Cl	ZINC000853787063	FH	On-Demand	Anodyne	P2RX7	24	44
Cc1oncc1CSCC(=O)NCc1ccc(F)cc1C(F)(F)F	ZINC000853787082	FH	On-Demand	Anodyne	P2RX7	58	58
Cc1oncc1CSCC(=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000853787085	FG	On-Demand	Anodyne	GALR3	65	34
Cc1oncc1CSCC(=O)NCCOc1cccc(C(F)(F)F)c1	ZINC000853787085	FG	On-Demand	Anodyne	PDS	45	41
COCCn1c(S[C@H](C)C(=O)Nc2cccc(C)c2)nc(O)cc1=O	ZINC000853787095	FE	On-Demand	Anodyne	KCNK3	47	34
COCCn1c(S[C@@H](C)C(=O)Nc2cccc(C)c2)nc(O)cc1=O	ZINC000853787097	FE	On-Demand	Anodyne	KCNK3	47	34
CCOc1ccc(-c2nc(CSc3nc(O)cc(=O)n3CCOC)cs2)cc1	ZINC000853787100	HG	On-Demand	Anodyne	DCK	16	42
Cc1ccc(N2CC[C@H](NC(=O)N3CCC[C@@H](C(=O)NC(C)C)C3)C2=O)cc1	ZINC000853787139	GE	On-Demand	Anodyne	BIRC2	48	35
Cc1oncc1CSCCC(=O)Nc1ccc2c(c1)OCO2	ZINC000853787140	DF	On-Demand	Anodyne	DYRK2	46	33
Cc1ccc(N2CC[C@H](NC(=O)N3CCC[C@H](C(=O)NC(C)C)C3)C2=O)cc1	ZINC000853787146	GE	On-Demand	Anodyne	BIRC2	48	35
COCCn1c(S[C@H](C)C(=O)NCc2ccccc2)nc(O)cc1=O	ZINC000853787205	FD	On-Demand	Anodyne	PDS	41	32
COCCn1c(S[C@@H](C)C(=O)NCc2ccccc2)nc(O)cc1=O	ZINC000853787207	FD	On-Demand	Anodyne	PDS	41	32
COc1cc2c(cc1OC)CN(C(=O)CSCc1cnoc1C)CC2	ZINC000853787276	FF	On-Demand	Anodyne	ABCB1B	50	31
COc1cc2c(cc1OC)CN(C(=O)CSCc1cnoc1C)CC2	ZINC000853787276	FF	On-Demand	Anodyne	ABCB1	19	48
C[C@H](O)CCSCCC(=O)N1CCCC1	ZINC000853787310	BD	On-Demand	Anodyne	BHMT	40	32
CCN(Cc1ccccc1)C(=O)[C@H](C)SCc1cnoc1C	ZINC000853787435	DH	On-Demand	Anodyne	TSPO	22	40
CCN(Cc1ccccc1)C(=O)[C@@H](C)SCc1cnoc1C	ZINC000853787436	DH	On-Demand	Anodyne	TSPO	22	40
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H](c3ccccc3)[C@@H](C)O)C2=O)cc1	ZINC000853787439	FF	On-Demand	Anodyne	XIAP	54	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H](c3ccccc3)[C@@H](C)O)C2=O)cc1	ZINC000853787439	FF	On-Demand	Anodyne	BIRC2	41	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H](c3ccccc3)[C@@H](C)O)C2=O)cc1	ZINC000853787439	FF	On-Demand	Anodyne	BIRC8	50	36
Cc1oncc1CSCC(=O)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853787440	FE	On-Demand	Anodyne	MAPK14	42	41
Cc1ccc(N2CC[C@H](NC(=O)N[C@H](c3ccccc3)[C@@H](C)O)C2=O)cc1	ZINC000853787441	FF	On-Demand	Anodyne	XIAP	54	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@H](c3ccccc3)[C@@H](C)O)C2=O)cc1	ZINC000853787441	FF	On-Demand	Anodyne	BIRC2	41	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@H](c3ccccc3)[C@@H](C)O)C2=O)cc1	ZINC000853787441	FF	On-Demand	Anodyne	BIRC8	50	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@H](c3ccccc3)[C@H](C)O)C2=O)cc1	ZINC000853787443	FF	On-Demand	Anodyne	XIAP	54	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@H](c3ccccc3)[C@H](C)O)C2=O)cc1	ZINC000853787443	FF	On-Demand	Anodyne	BIRC2	41	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@H](c3ccccc3)[C@H](C)O)C2=O)cc1	ZINC000853787443	FF	On-Demand	Anodyne	BIRC8	50	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H](c3ccccc3)[C@H](C)O)C2=O)cc1	ZINC000853787447	FF	On-Demand	Anodyne	XIAP	54	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H](c3ccccc3)[C@H](C)O)C2=O)cc1	ZINC000853787447	FF	On-Demand	Anodyne	BIRC2	41	36
Cc1ccc(N2CC[C@H](NC(=O)N[C@@H](c3ccccc3)[C@H](C)O)C2=O)cc1	ZINC000853787447	FF	On-Demand	Anodyne	BIRC8	50	36
O=C(CSCCCC1CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853787466	EH	On-Demand	Anodyne	PIK3CA	41	38
O=C(CSCCCC1CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853787466	EH	On-Demand	Anodyne	MTOR	83	38
O=C(CSCCCC1CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853787466	EH	On-Demand	Anodyne	EPHX2	27	46
O=C(CSCCCC1CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853787466	EH	On-Demand	Anodyne	STAT6	50	31
COC[C@@H](CSCC(=O)Nc1ccc2ccccc2c1)OC	ZINC000853787474	DG	On-Demand	Anodyne	ENPP1	69	35
COC[C@@H](CSCC(=O)Nc1ccc2ccccc2c1)OC	ZINC000853787474	DG	On-Demand	Anodyne	IMDH_CRYPV	25	41
COC[C@H](CSCC(=O)Nc1ccc2ccccc2c1)OC	ZINC000853787477	DG	On-Demand	Anodyne	ENPP1	69	35
COC[C@H](CSCC(=O)Nc1ccc2ccccc2c1)OC	ZINC000853787477	DG	On-Demand	Anodyne	IMDH_CRYPV	25	41
O=C(CCSCc1cnc(-c2ccccc2)nc1)N1CCCC1	ZINC000853787486	EG	On-Demand	Anodyne	PREP	46	37
Cc1oncc1CS[C@@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853787575	DH	On-Demand	Anodyne	DRD4	22	42
Cc1oncc1CS[C@@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853787575	DH	On-Demand	Anodyne	TPP2	59	36
Cc1oncc1CS[C@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853787583	DH	On-Demand	Anodyne	DRD4	22	42
Cc1oncc1CS[C@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853787583	DH	On-Demand	Anodyne	TPP2	59	36
Cc1oncc1CS[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853787587	DH	On-Demand	Anodyne	DRD4	22	42
Cc1oncc1CS[C@H](C)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853787587	DH	On-Demand	Anodyne	TPP2	59	36
Cc1oncc1CS[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853787591	DH	On-Demand	Anodyne	DRD4	22	42
Cc1oncc1CS[C@@H](C)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853787591	DH	On-Demand	Anodyne	TPP2	59	36
O=C(CSC[C@@H]1CCCCC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853787628	GI	On-Demand	Anodyne	MTOR	54	34
O=C(CSC[C@@H]1CCCCC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853787628	GI	On-Demand	Anodyne	STAT6	53	32
O=C(CSC[C@H]1CCCCC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853787631	GI	On-Demand	Anodyne	MTOR	54	34
O=C(CSC[C@H]1CCCCC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853787631	GI	On-Demand	Anodyne	STAT6	53	32
C[C@H](O)CCSCCSCc1ccccc1	ZINC000853787692	CG	On-Demand	Anodyne	CACNA2D1	32	54
Cc1oncc1CSCC(=O)NCc1ccc(S(C)(=O)=O)cc1	ZINC000853787695	FD	On-Demand	Anodyne	NAMPT	45	33
C[C@H](O)CCSCc1ccc(Cl)nc1	ZINC000853787701	BF	On-Demand	Anodyne	NACHRBETA2	50	36
Cc1oncc1CSCC(=O)Nc1ccccc1N1CCCC1=O	ZINC000853787704	EF	On-Demand	Anodyne	KCNQ2	47	37
COc1ccc(N2CCN(C(=O)CSCc3cc(C4CC4)no3)CC2)cc1	ZINC000853787732	GG	On-Demand	Clean	NPBWR1	50	30
COCCn1c(S[C@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc(O)cc1=O	ZINC000853787733	GE	On-Demand	Anodyne	TPP2	52	34
COCCn1c(S[C@@H](C)C(=O)N2c3ccccc3C[C@H]2C)nc(O)cc1=O	ZINC000853787736	GE	On-Demand	Anodyne	TPP2	52	34
COCCn1c(S[C@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc(O)cc1=O	ZINC000853787739	GE	On-Demand	Anodyne	TPP2	52	34
COCCn1c(S[C@@H](C)C(=O)N2c3ccccc3C[C@@H]2C)nc(O)cc1=O	ZINC000853787741	GE	On-Demand	Anodyne	TPP2	52	34
COC(=O)Cc1ccccc1CSCC[C@@H](C)O	ZINC000853787756	CE	On-Demand	Anodyne	CACNA2D1	28	44
COC(=O)Cc1ccccc1CSCC[C@H](C)O	ZINC000853787757	CE	On-Demand	Anodyne	CACNA2D1	28	44
Cc1oncc1CSCCC(=O)NCc1ccccc1Cl	ZINC000853787799	DH	On-Demand	Anodyne	P2RX7	54	53
COCCn1c(SCc2ccc(C(=O)Nc3ccccc3)cc2)nc(O)cc1=O	ZINC000853787823	HG	On-Demand	Anodyne	CPT1A	44	31
COCCn1c(SCc2ccc(C(=O)Nc3ccccc3)cc2)nc(O)cc1=O	ZINC000853787823	HG	On-Demand	Anodyne	NOD2	41	38
COc1ccc([C@@H]2CCCCCN2C(=O)CSCc2cnoc2C)cc1	ZINC000853787824	FI	On-Demand	Anodyne	CPT1A	100	42
C[C@@H]1CCN(C(=O)N[C@@H]2CCc3c(O)cccc32)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853787902	GE	On-Demand	Anodyne	RBP4	41	33
C[C@@H]1CCN(C(=O)N[C@H]2CCc3c(O)cccc32)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853787904	GE	On-Demand	Anodyne	RBP4	41	33
C[C@H](O)CCSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853787912	DD	On-Demand	Anodyne	PIK3CA	34	42
C[C@H](O)CCSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853787912	DD	On-Demand	Anodyne	MTOR	68	42
C[C@H](O)CCSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853787912	DD	On-Demand	Anodyne	EPHX2	19	43
C[C@H](O)CCSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853787912	DD	On-Demand	Anodyne	PIK3CG	33	42
C[C@H](O)CCSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853787912	DD	On-Demand	Anodyne	STAT6	52	32
Cc1oncc1CSCCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853787961	EI	On-Demand	Anodyne	KIT	16	40
Cc1oncc1CSCCn1ccnc1	ZINC000853788061	BE	On-Demand	Anodyne	CYP11B1	28	41
Cc1oncc1CSCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853788069	EF	On-Demand	Anodyne	PLA2G7	28	41
Cc1oncc1CSCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853788069	EF	On-Demand	Anodyne	SSTR1	22	41
Cc1oncc1CSCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853788083	GJ	On-Demand	Anodyne	KCNA5	27	43
Cc1oncc1CSCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853788084	GJ	On-Demand	Anodyne	KCNA5	27	43
C[C@H](O)CCSCC(=O)Nc1ccc2ccccc2c1	ZINC000853788093	CG	On-Demand	Anodyne	SLC1A2	17	41
C[C@H](O)CCSCC(=O)Nc1ccc2ccccc2c1	ZINC000853788093	CG	On-Demand	Anodyne	ENPP1	70	35
C[C@H](O)CCSCC(=O)Nc1ccc2ccccc2c1	ZINC000853788093	CG	On-Demand	Anodyne	IMDH_CRYPV	30	45
C[C@H](O)CCSCc1cc(Cl)nc(Cl)c1	ZINC000853788119	CG	On-Demand	Anodyne	CACNA2D1	19	41
O=C(CSCCO[C@H]1CC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853788122	FF	On-Demand	Anodyne	MTOR	43	35
O=C(CSCCO[C@H]1CC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853788122	FF	On-Demand	Anodyne	EPHX2	22	45
O=C(CSCCO[C@H]1CC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853788122	FF	On-Demand	Anodyne	STAT6	51	30
O=C(CSCCO[C@@H]1CC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853788124	FF	On-Demand	Anodyne	MTOR	43	35
O=C(CSCCO[C@@H]1CC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853788124	FF	On-Demand	Anodyne	EPHX2	22	45
O=C(CSCCO[C@@H]1CC1(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853788124	FF	On-Demand	Anodyne	STAT6	51	30
C[C@H](O)CCSCc1cccc([N+](=O)[O-])c1Br	ZINC000853788159	DG	On-Demand	Bother	COLA	111	37
COC[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)OC	ZINC000853788174	FD	On-Demand	Anodyne	MTOR	52	39
COC[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)OC	ZINC000853788174	FD	On-Demand	Anodyne	STAT6	46	33
COC[C@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)OC	ZINC000853788177	FD	On-Demand	Anodyne	MTOR	52	39
COC[C@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)OC	ZINC000853788177	FD	On-Demand	Anodyne	STAT6	46	33
C[C@H](O)CCSCC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853788188	DH	On-Demand	Anodyne	LTA4H	32	41
C[C@H](O)CCSCC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853788188	DH	On-Demand	Anodyne	PRNP	44	40
C[C@H](O)CCSCC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853788188	DH	On-Demand	Anodyne	HDAC1	15	45
C[C@H](O)CCSCC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853788188	DH	On-Demand	Anodyne	HDAC3	17	45
C[C@H](O)CCSCC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853788188	DH	On-Demand	Anodyne	HDAC6	20	45
C[C@H](O)CCSCC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853788188	DH	On-Demand	Anodyne	SLC1A1	33	48
C[C@H](O)CCSCC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853788188	DH	On-Demand	Anodyne	SLC1A2	48	48
COCCn1c(SCc2cc(=O)oc3c(C)c(C)ccc23)nc(O)cc1=O	ZINC000853788261	GF	On-Demand	Anodyne	HSD17B3	16	41
Cc1oncc1CSCC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000853788336	EI	On-Demand	Anodyne	PTGER3	40	34
Cc1oncc1CSCC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000853788338	EI	On-Demand	Anodyne	PTGER3	40	34
Cc1ccccc1CNC(=O)CSCc1cnoc1C	ZINC000853788361	CF	On-Demand	Anodyne	P2RX7	22	52
Cc1oncc1CSCCC(=O)Nc1ccccc1C(F)(F)F	ZINC000853788366	EI	On-Demand	Anodyne	P2RX7	31	40
COc1ccc([C@@H]2CCCN2C(=O)CSCc2cnoc2C)c(OC)c1	ZINC000853788375	GH	On-Demand	Anodyne	CPT1A	41	35
COCCn1c(SCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nc(O)cc1=O	ZINC000853788417	IC	On-Demand	Bother	SSTR1	45	43
O=C(CSCCO[C@H]1CC1(F)F)Nc1ccc2ccccc2c1	ZINC000853788455	EH	On-Demand	Anodyne	ENPP1	54	32
O=C(CSCCO[C@H]1CC1(F)F)Nc1ccc2ccccc2c1	ZINC000853788455	EH	On-Demand	Anodyne	IMDH_CRYPV	21	40
O=C(CSCCO[C@@H]1CC1(F)F)Nc1ccc2ccccc2c1	ZINC000853788457	EH	On-Demand	Anodyne	ENPP1	54	32
O=C(CSCCO[C@@H]1CC1(F)F)Nc1ccc2ccccc2c1	ZINC000853788457	EH	On-Demand	Anodyne	IMDH_CRYPV	21	40
Cc1oncc1CSCCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853788559	FG	On-Demand	Anodyne	PLA2G7	28	40
Cc1oncc1CSCCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853788559	FG	On-Demand	Anodyne	CCR1	15	44
Cc1oncc1CSCCC(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853788559	FG	On-Demand	Anodyne	SSTR1	34	44
CCCOc1cccc(CNC(=O)CSCc2cnoc2C)c1	ZINC000853788561	EG	On-Demand	Anodyne	MTNR1A	25	40
CCCOc1cccc(CNC(=O)CSCc2cnoc2C)c1	ZINC000853788561	EG	On-Demand	Anodyne	PDS	50	35
O=C(CCSCc1cnc(-c2ccccc2)nc1)N1CCCCC1	ZINC000853788589	EH	On-Demand	Anodyne	PREP	44	36
COC[C@H](CSCC(=O)c1cc(C)n(Cc2ccccc2)c1C)OC	ZINC000853788591	FH	On-Demand	Anodyne	PLA2G2A	49	34
COC[C@H](CSCC(=O)c1cc(C)n(Cc2ccccc2)c1C)OC	ZINC000853788591	FH	On-Demand	Anodyne	PDS	41	31
COC[C@@H](CSCC(=O)c1cc(C)n(Cc2ccccc2)c1C)OC	ZINC000853788605	FH	On-Demand	Anodyne	PLA2G2A	49	34
COC[C@@H](CSCC(=O)c1cc(C)n(Cc2ccccc2)c1C)OC	ZINC000853788605	FH	On-Demand	Anodyne	PDS	41	31
CCCCN(CCCC)C(=O)CSCc1cnoc1C	ZINC000853788616	CH	On-Demand	Anodyne	TSPO	16	40
O=C(CSCc1cc(C2CC2)no1)Nc1ccc2ccccc2c1	ZINC000853788637	EJ	On-Demand	Anodyne	IMDH_CRYPV	17	41
CCOc1ccc([C@@H](C)NC(=O)CSCc2cnoc2C)cc1OC	ZINC000853788651	FH	On-Demand	Anodyne	ENPP1	49	31
Cc1oncc1CSCCC(=O)Nc1cccc(Br)c1	ZINC000853788712	FI	On-Demand	Anodyne	EGFR	32	41
CCOc1ccc(-c2nc(CSc3nc(O)cc(=O)n3CCOC)cs2)cc1OC	ZINC000853788758	IG	On-Demand	Anodyne	DCK	43	51
COC[C@]1(C(=O)OC)CCCN1c1ncnc2sc(-c3ccccc3)cc12	ZINC000853788802	GH	On-Demand	Anodyne	SLC12A5	58	37
COC[C@@]1(C(=O)OC)CCCN1c1ncnc2sc(-c3ccccc3)cc12	ZINC000853788803	GH	On-Demand	Anodyne	SLC12A5	58	37
Cc1ccc(NC(=O)CSCc2cnoc2C)cc1C	ZINC000853788824	CG	On-Demand	Anodyne	ENPP1	63	33
Cc1oncc1CSCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853788831	GF	On-Demand	Anodyne	LPL	47	39
Cc1oncc1CSCC(=O)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853788831	GF	On-Demand	Anodyne	F13A1	48	39
COC[C@]1(C(=O)OC)CCCN1c1ccc([N+](=O)[O-])cc1	ZINC000853788833	CD	On-Demand	Bother	SLC12A5	45	38
COC[C@@]1(C(=O)OC)CCCN1c1ccc([N+](=O)[O-])cc1	ZINC000853788834	CD	On-Demand	Bother	SLC12A5	45	38
Cc1oncc1CSCC(=O)NCc1cccc(Cl)c1	ZINC000853788843	DG	On-Demand	Anodyne	P2RX7	26	48
Cc1oncc1CSCC(=O)NCc1ccc(Cl)cc1	ZINC000853788869	DG	On-Demand	Anodyne	P2RX7	20	53
COC[C@]1(C(=O)OC)CCCN1c1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000853788923	ED	On-Demand	Bother	TAAR1	21	41
COC[C@@]1(C(=O)OC)CCCN1c1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000853788924	ED	On-Demand	Bother	TAAR1	21	41
Cc1oncc1CSCC(=O)N[C@H]1CCCc2ccccc21	ZINC000853788961	DG	On-Demand	Anodyne	BDKRB1	52	43
Cc1oncc1CSCC(=O)N[C@@H]1CCCc2ccccc21	ZINC000853788962	DG	On-Demand	Anodyne	BDKRB1	52	43
Cc1oncc1CSCC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853788964	EH	On-Demand	Anodyne	P2RY1	57	39
Cc1oncc1CSCC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853788964	EH	On-Demand	Anodyne	EPHX2	53	41
Cc1oncc1CSCC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853788964	EH	On-Demand	Anodyne	SHH	46	37
Cc1oncc1CSCC(=O)Nc1ccccc1C(F)(F)F	ZINC000853788970	EH	On-Demand	Anodyne	P2RX7	33	41
Cc1oncc1CS[C@H](C)C(=O)NCCc1ccccc1	ZINC000853788982	DF	On-Demand	Anodyne	AMP1_PLAFQ	24	42
Cc1oncc1CS[C@@H](C)C(=O)NCCc1ccccc1	ZINC000853788983	DF	On-Demand	Anodyne	AMP1_PLAFQ	24	42
Cc1oncc1CSCC(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853788996	EF	On-Demand	Anodyne	MAPK14	43	38
Cc1oncc1CSCC(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853788996	EF	On-Demand	Anodyne	MAPK13	47	33
Cc1oncc1CSCC(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853788996	EF	On-Demand	Anodyne	KCNK3	50	33
Cc1oncc1CSCC(=O)NCc1ccc2c(c1)OCO2	ZINC000853789001	DE	On-Demand	Anodyne	NOS2	102	40
Cc1oncc1CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853789093	EF	On-Demand	Anodyne	MTOR	67	38
Cc1oncc1CSCC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853789093	EF	On-Demand	Anodyne	STAT6	64	34
COc1ccc(C)cc1NC(=O)CSCc1cnoc1C	ZINC000853789098	DG	On-Demand	Anodyne	ENPP1	62	32
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCOc2ccc(C#N)cc2)C1	ZINC000853789101	GF	On-Demand	Mild	GPR119	17	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCOc2ccc(C#N)cc2)C1	ZINC000853789102	GF	On-Demand	Mild	GPR119	17	40
Cc1oncc1CSCC(=O)NCc1ccc(F)cc1	ZINC000853789142	CF	On-Demand	Anodyne	P2RX7	31	40
COC[C@]1(C(=O)OC)CCCN1c1nc(-c2ccncc2)nc2ccccc12	ZINC000853789154	GF	On-Demand	Anodyne	ADAM17	45	36
COC[C@]1(C(=O)OC)CCCN1c1nc(-c2ccncc2)nc2ccccc12	ZINC000853789154	GF	On-Demand	Anodyne	SLC12A5	51	37
COC[C@@]1(C(=O)OC)CCCN1c1nc(-c2ccncc2)nc2ccccc12	ZINC000853789155	GF	On-Demand	Anodyne	ADAM17	45	36
COC[C@@]1(C(=O)OC)CCCN1c1nc(-c2ccncc2)nc2ccccc12	ZINC000853789155	GF	On-Demand	Anodyne	SLC12A5	51	37
Cc1oncc1CSCC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853789163	FJ	On-Demand	Anodyne	IMDH_CRYPV	27	47
CCOC(=O)Nc1ccc2c(CSCc3cnoc3C)cc(=O)oc2c1	ZINC000853789179	FI	On-Demand	Anodyne	HSD17B3	20	40
Cc1oncc1CSCC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853789212	EH	On-Demand	Anodyne	EPHX2	21	40
Cc1oncc1CSCC(=O)NC1C2CC3CC(C2)CC1C3	ZINC000853789229	DG	On-Demand	Anodyne	HSD11B1	40	31
Cc1oncc1CSCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853789232	EH	On-Demand	Anodyne	KIT	18	42
Cc1oncc1CSCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853789232	EH	On-Demand	Anodyne	KDR	18	42
Cc1oncc1CSCC(=O)Nc1ccc2c(c1)OCCCO2	ZINC000853789271	EG	On-Demand	Anodyne	QPCT	16	40
Cc1oncc1CSCC(=O)Nc1c(C(C)C)cccc1C(C)C	ZINC000853789295	EK	On-Demand	Anodyne	SOAT1	52	41
Cc1oncc1CS[C@H](C)C(=O)Nc1ccc(F)cc1F	ZINC000853789297	DH	On-Demand	Anodyne	SOAT1	38	43
Cc1oncc1CS[C@@H](C)C(=O)Nc1ccc(F)cc1F	ZINC000853789298	DH	On-Demand	Anodyne	SOAT1	38	43
COC(=O)c1cccc(N2CCc3ccc(C)cc3C2)n1	ZINC000853789303	CF	On-Demand	Anodyne	AKR1C3	15	41
Cc1oncc1CSCC(=O)Nc1ccc2c(c1)OCCO2	ZINC000853789306	DF	On-Demand	Anodyne	QPCT	16	41
Cc1oncc1CSCC(=O)NCCCc1ccccc1	ZINC000853789357	DF	On-Demand	Anodyne	MTNR1A	25	41
Cc1oncc1CSCC(=O)NCCCc1ccccc1	ZINC000853789357	DF	On-Demand	Anodyne	MTNR1B	28	41
Cc1oncc1CSCC(=O)NCCCc1ccccc1	ZINC000853789357	DF	On-Demand	Anodyne	FAAH	47	36
Cc1oncc1CSCC(=O)NCCCc1ccccc1	ZINC000853789357	DF	On-Demand	Anodyne	CRTM	35	40
Cc1oncc1CSCC(=O)NCCCc1ccccc1	ZINC000853789357	DF	On-Demand	Anodyne	CES1D	44	32
Cc1oncc1CSCC(=O)N1c2ccccc2C[C@H]1C	ZINC000853789376	DG	On-Demand	Anodyne	DRD4	26	49
Cc1oncc1CSCC(=O)N1c2ccccc2C[C@H]1C	ZINC000853789376	DG	On-Demand	Anodyne	TPP2	57	35
Cc1oncc1CSCC(=O)N1c2ccccc2C[C@@H]1C	ZINC000853789377	DG	On-Demand	Anodyne	DRD4	26	49
Cc1oncc1CSCC(=O)N1c2ccccc2C[C@@H]1C	ZINC000853789377	DG	On-Demand	Anodyne	TPP2	57	35
Cc1oncc1CSCC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1	ZINC000853789405	GI	On-Demand	Anodyne	TNF	43	40
Cc1oncc1CSCC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1	ZINC000853789405	GI	On-Demand	Anodyne	MAPK14	30	49
Cc1oncc1CSCC(=O)Nc1cc(C(C)(C)C)nn1-c1ccccc1	ZINC000853789405	GI	On-Demand	Anodyne	DDR2	36	45
COC[C@]1(C(=O)OC)CCCN1c1nc2ccccn2c1[N+](=O)[O-]	ZINC000853789406	ED	On-Demand	Bother	SLC12A5	61	40
COC[C@@]1(C(=O)OC)CCCN1c1nc2ccccn2c1[N+](=O)[O-]	ZINC000853789407	ED	On-Demand	Bother	SLC12A5	61	40
Cc1oncc1CS[C@H](C)C(=O)NCc1ccccc1Cl	ZINC000853789426	DH	On-Demand	Anodyne	P2RX7	22	47
Cc1oncc1CS[C@@H](C)C(=O)NCc1ccccc1Cl	ZINC000853789427	DH	On-Demand	Anodyne	P2RX7	22	47
Cc1oncc1CSCC(=O)N(C)Cc1ccc(F)cc1	ZINC000853789430	DG	On-Demand	Anodyne	PLA2G7	60	38
Cc1oncc1CSCC(=O)Nc1ccc2c(c1)OCO2	ZINC000853789436	DF	On-Demand	Anodyne	DYRK2	53	34
Cc1oncc1CSCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853789445	EH	On-Demand	Anodyne	GRIN2B	78	44
Cc1oncc1CSCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853789445	EH	On-Demand	Anodyne	SIGMAR1	20	40
Cc1oncc1CSCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853789445	EH	On-Demand	Anodyne	CCR3	26	43
COC[C@]1(C(=O)OC)CCCN1c1ccnc(C(C)C)n1	ZINC000853789533	CD	On-Demand	Anodyne	SORD	72	35
COC[C@@]1(C(=O)OC)CCCN1c1ccnc(C(C)C)n1	ZINC000853789534	CD	On-Demand	Anodyne	SORD	72	35
COc1ccc(NC(=O)[C@H](C)SCc2cnoc2C)cc1OC	ZINC000853789542	EG	On-Demand	Anodyne	ENPP1	77	38
COC[C@]1(C(=O)OC)CCCN1c1nc(C(F)(F)F)nc2ccccc12	ZINC000853789558	FF	On-Demand	Anodyne	SLC12A5	56	37
COC[C@@]1(C(=O)OC)CCCN1c1nc(C(F)(F)F)nc2ccccc12	ZINC000853789559	FF	On-Demand	Anodyne	SLC12A5	56	37
Cc1cccc(NC(=O)[C@@H](C)SCc2cnoc2C)c1	ZINC000853789570	CH	On-Demand	Anodyne	KCNK3	47	36
Cc1cccc(NC(=O)[C@H](C)SCc2cnoc2C)c1	ZINC000853789571	CH	On-Demand	Anodyne	KCNK3	47	36
Cc1oncc1CS[C@@H](C)C(=O)Nc1ccccc1Cl	ZINC000853789583	DH	On-Demand	Anodyne	CXCL8	45	36
Cc1oncc1CS[C@@H](C)C(=O)Nc1ccccc1Cl	ZINC000853789583	DH	On-Demand	Anodyne	EPHB3	46	34
Cc1oncc1CS[C@H](C)C(=O)Nc1ccccc1Cl	ZINC000853789584	DH	On-Demand	Anodyne	CXCL8	45	36
Cc1oncc1CS[C@H](C)C(=O)Nc1ccccc1Cl	ZINC000853789584	DH	On-Demand	Anodyne	EPHB3	46	34
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)C1	ZINC000853789609	GF	On-Demand	Anodyne	PAPA1_CARPA	38	42
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)C1	ZINC000853789609	GF	On-Demand	Anodyne	SOAT1	22	56
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)C1	ZINC000853789609	GF	On-Demand	Anodyne	FPR1	44	35
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)C1	ZINC000853789610	GF	On-Demand	Anodyne	PAPA1_CARPA	38	42
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)C1	ZINC000853789610	GF	On-Demand	Anodyne	SOAT1	22	56
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)C1	ZINC000853789610	GF	On-Demand	Anodyne	FPR1	44	35
Cc1cnc(CNC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)s1	ZINC000853789615	FH	On-Demand	Anodyne	FFAR2	25	47
Cc1cnc(CNC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)s1	ZINC000853789616	FH	On-Demand	Anodyne	FFAR2	25	47
Cc1cnc(CNC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)s1	ZINC000853789617	FH	On-Demand	Anodyne	FFAR2	25	47
Cc1cnc(CNC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)s1	ZINC000853789618	FH	On-Demand	Anodyne	FFAR2	25	47
C#C[C@@H](NC(=O)NCc1ccc(-c2cccc(OC)c2)cc1)C1CCOCC1	ZINC000853789623	GH	On-Demand	Mild	ROCK2	37	40
C#C[C@@H](NC(=O)NCc1ccc(-c2cccc(OC)c2)cc1)C1CCOCC1	ZINC000853789623	GH	On-Demand	Mild	LGMN	28	40
C#C[C@H](NC(=O)NCc1ccc(-c2cccc(OC)c2)cc1)C1CCOCC1	ZINC000853789624	GH	On-Demand	Mild	ROCK2	37	40
C#C[C@H](NC(=O)NCc1ccc(-c2cccc(OC)c2)cc1)C1CCOCC1	ZINC000853789624	GH	On-Demand	Mild	LGMN	28	40
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000853789625	CD	On-Demand	Anodyne	MTNR1A	28	49
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(C)c1	ZINC000853789625	CD	On-Demand	Anodyne	MTNR1B	22	49
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000853789626	CD	On-Demand	Anodyne	MTNR1A	28	49
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(C)c1	ZINC000853789626	CD	On-Demand	Anodyne	MTNR1B	22	49
COc1cccc(OC)c1CNc1nc(C)ccc1[N+](=O)[O-]	ZINC000853789640	DF	On-Demand	Bother	PRKCQ	19	40
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC1CC(CO)C1)c1ccccc1	ZINC000853789664	FE	On-Demand	Anodyne	SOAT1	20	56
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC1CC(CO)C1)c1ccccc1	ZINC000853789664	FE	On-Demand	Anodyne	FPR1	40	35
COc1cccc(OC)c1CNc1cc2c(cc1[N+](=O)[O-])n(C)c(=O)n2C	ZINC000853789683	FE	On-Demand	Bother	TAAR1	19	40
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CC(=O)C2)c1ccccc1	ZINC000853789688	GG	On-Demand	Anodyne	FPR1	43	35
COc1cccc(OC)c1CNc1cc(Cl)nc(C)n1	ZINC000853789698	CG	On-Demand	Anodyne	EIF2AK1	57	37
COc1cccc(OC)c1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000853789709	FG	On-Demand	Bother	CACNA1C	60	38
COc1cccc(OC)c1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000853789709	FG	On-Demand	Bother	CACNA1D	89	38
COc1cccc(OC)c1CNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000853789709	FG	On-Demand	Bother	KCNMA1	22	48
COc1cccc(OC)c1CNc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-]	ZINC000853789711	GF	On-Demand	Bother	CACNA1C	50	36
COc1cccc(OC)c1CNc1c([N+](=O)[O-])cc(CO)c(C)c1[N+](=O)[O-]	ZINC000853789711	GF	On-Demand	Bother	CACNA1D	80	34
COc1cccc(OC)c1CNc1nnc(C)cc1C(F)(F)F	ZINC000853789753	EG	On-Demand	Anodyne	EIF2AK1	56	37
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N[C@H]1C[C@H](O)C1)c1ccccc1	ZINC000853789766	EE	On-Demand	Anodyne	SOAT1	21	58
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N[C@H]1C[C@H](O)C1)c1ccccc1	ZINC000853789766	EE	On-Demand	Anodyne	FPR1	44	34
CON(C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C	ZINC000853789769	EF	On-Demand	Anodyne	UTS2	43	34
CON(C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C	ZINC000853789770	EF	On-Demand	Anodyne	UTS2	43	34
CON(C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000853789771	EF	On-Demand	Anodyne	UTS2	43	34
CON(C)CCNC(=O)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C	ZINC000853789772	EF	On-Demand	Anodyne	UTS2	43	34
CN1CCN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CCC1=O	ZINC000853789776	GE	On-Demand	Anodyne	SOAT1	15	53
CN1CCN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CCC1=O	ZINC000853789777	GE	On-Demand	Anodyne	SOAT1	15	53
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCCCc1nc[nH]n1)c1ccccc1	ZINC000853789780	GE	On-Demand	Anodyne	METAP1	40	33
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCCCc1nc[nH]n1)c1ccccc1	ZINC000853789780	GE	On-Demand	Anodyne	CCKAR	48	38
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCCCc1nc[nH]n1)c1ccccc1	ZINC000853789780	GE	On-Demand	Anodyne	TACR3	21	40
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCCCc1nc[nH]n1)c1ccccc1	ZINC000853789780	GE	On-Demand	Anodyne	SOAT1	19	52
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCC2CC=CC2)CC1	ZINC000853789787	EE	On-Demand	Anodyne	P2RY12	46	36
CCOC(=O)N1CCN(C(=O)[C@H](C)SCC2CC=CC2)CC1	ZINC000853789788	EE	On-Demand	Anodyne	P2RY12	46	36
C[C@@H](CCc1cccn1C)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853789790	EF	On-Demand	Reactive	F2RL3	44	32
O=C(CCSCC[C@@H]1CCc2ccccc21)N1CCCC1	ZINC000853789796	DH	On-Demand	Anodyne	PREP	41	38
O=C(CCSCC[C@H]1CCc2ccccc21)N1CCCC1	ZINC000853789797	DH	On-Demand	Anodyne	PREP	41	38
Cc1cnc(CNC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)s1	ZINC000853789831	FF	On-Demand	Anodyne	GPR119	30	40
COc1cccc(OC)c1CNc1ncnc2sc(C)cc12	ZINC000853789843	DH	On-Demand	Anodyne	EGFR	27	56
COc1cccc(OC)c1CNc1ncnc2sc(C)cc12	ZINC000853789843	DH	On-Demand	Anodyne	PDE6A	43	33
COc1cccc(OC)c1CNc1ncnc2sc(C)cc12	ZINC000853789843	DH	On-Demand	Anodyne	EIF2AK1	40	34
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@@]2(O)C[C@H]2C1)c1ccccc1	ZINC000853789855	GE	On-Demand	Anodyne	GHRHR	51	30
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853789867	FF	On-Demand	Anodyne	MTNR1A	52	39
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853789867	FF	On-Demand	Anodyne	MTNR1B	50	39
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853789867	FF	On-Demand	Anodyne	ROCK2	47	46
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853789867	FF	On-Demand	Anodyne	FAAH	16	44
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853789867	FF	On-Demand	Anodyne	HSD17B2	27	52
COc1cccc(OC)c1CNc1cc(Cl)nc(C2CC2)n1	ZINC000853789894	DH	On-Demand	Anodyne	EIF2AK1	47	34
COc1cc(NCc2c(OC)cccc2OC)c([N+](=O)[O-])cc1OC	ZINC000853789912	EG	On-Demand	Bother	TAAR1	19	43
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1C[C@@H]2CCCC[C@@H]21)c1ccccc1	ZINC000853789913	FH	On-Demand	Anodyne	FKBP1A	15	41
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1C[C@@H]2CCCC[C@@H]21)c1ccccc1	ZINC000853789913	FH	On-Demand	Anodyne	CTSK	21	41
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1C[C@@H]2CCCC[C@@H]21)c1ccccc1	ZINC000853789913	FH	On-Demand	Anodyne	REN	56	38
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1C[C@@H]2CCCC[C@@H]21)c1ccccc1	ZINC000853789913	FH	On-Demand	Anodyne	FPR1	44	37
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2ccc(OC)cc2)cc1	ZINC000853789922	FF	On-Demand	Anodyne	CA9	15	41
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@H](O)C(F)(F)C1)c1ccccc1	ZINC000853789935	GF	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@H](O)C(F)(F)C1)c1ccccc1	ZINC000853789935	GF	On-Demand	Anodyne	SFRP1	44	37
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@H](O)C(F)(F)C1)c1ccccc1	ZINC000853789935	GF	On-Demand	Anodyne	WNT3	51	33
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@@H](O)C(F)(F)C1)c1ccccc1	ZINC000853789937	GF	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@@H](O)C(F)(F)C1)c1ccccc1	ZINC000853789937	GF	On-Demand	Anodyne	SFRP1	44	37
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@@H](O)C(F)(F)C1)c1ccccc1	ZINC000853789937	GF	On-Demand	Anodyne	WNT3	51	33
COc1cccc(OC)c1CNc1nc(C)ccc1Cl	ZINC000853789956	CH	On-Demand	Anodyne	EIF2AK1	68	43
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000853789968	JE	On-Demand	Anodyne	PPARG	40	39
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCOCC1	ZINC000853789968	JE	On-Demand	Anodyne	PDE8B	59	36
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CCC(O)(CO)CC1)c1ccccc1	ZINC000853789973	GD	On-Demand	Anodyne	GHRHR	48	33
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CCC(O)(CO)CC1)c1ccccc1	ZINC000853789973	GD	On-Demand	Anodyne	FPR1	41	32
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC(S(C)(=O)=O)C1)c1ccccc1	ZINC000853789975	GD	On-Demand	Anodyne	CTSK	24	44
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC(S(C)(=O)=O)C1)c1ccccc1	ZINC000853789975	GD	On-Demand	Anodyne	FPR1	43	34
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H]1CCO	ZINC000853790011	FH	On-Demand	Anodyne	HTR1A	15	42
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H]1CCO	ZINC000853790011	FH	On-Demand	Anodyne	HTR1D	68	38
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H]1CCO	ZINC000853790011	FH	On-Demand	Anodyne	HTR1B	52	38
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H]1CCO	ZINC000853790011	FH	On-Demand	Anodyne	MPO	57	37
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@@H]1CCO	ZINC000853790012	FH	On-Demand	Anodyne	HTR1A	15	42
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@@H]1CCO	ZINC000853790012	FH	On-Demand	Anodyne	HTR1D	68	38
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@@H]1CCO	ZINC000853790012	FH	On-Demand	Anodyne	HTR1B	52	38
C[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@@H]1CCO	ZINC000853790012	FH	On-Demand	Anodyne	MPO	57	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853790015	EF	On-Demand	Anodyne	HTR1D	64	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853790015	EF	On-Demand	Anodyne	HTR1B	49	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853790015	EF	On-Demand	Anodyne	MPO	53	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853790015	EF	On-Demand	Anodyne	MAPT	15	43
O=S1(=O)CCN(c2ccc(CNc3ncc(-c4ccccc4)s3)cc2)CC1	ZINC000853790017	GH	On-Demand	Clean	CHEK1	42	32
Cc1ccc(N2CCC[C@@H](NC(=O)NCCc3ccoc3)C2)cc1	ZINC000853790019	EG	On-Demand	Anodyne	BIRC2	32	40
CC(=O)c1c(F)cccc1NCc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000853790026	GF	On-Demand	Clean	STAT6	54	35
O=S1(=O)CCN(c2ccc(CNc3nccc4ccc(F)cc34)cc2)CC1	ZINC000853790046	GG	On-Demand	Clean	STAT6	67	36
CS(=O)(=O)C1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853790048	FD	On-Demand	Anodyne	HTR1A	19	41
CS(=O)(=O)C1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853790048	FD	On-Demand	Anodyne	HTR1D	84	39
CS(=O)(=O)C1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853790048	FD	On-Demand	Anodyne	HTR1B	64	40
CS(=O)(=O)C1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853790048	FD	On-Demand	Anodyne	NQO2	18	46
CS(=O)(=O)C1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853790048	FD	On-Demand	Anodyne	MPO	68	37
CS(=O)(=O)C1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853790048	FD	On-Demand	Anodyne	MTNR1A	20	47
CS(=O)(=O)C1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853790048	FD	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N(CCOCCO)C1CCC1	ZINC000853790084	GF	On-Demand	Anodyne	HTR1A	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N(CCOCCO)C1CCC1	ZINC000853790084	GF	On-Demand	Anodyne	MPO	58	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N(CCOCCO)C1CCC1	ZINC000853790084	GF	On-Demand	Anodyne	PYGL	33	51
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N(CCOCCO)C1CCC1	ZINC000853790084	GF	On-Demand	Anodyne	MAPT	15	44
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@H]3Cc4ccccc4N(C)C3=O)C2)cc1	ZINC000853790089	GF	On-Demand	Anodyne	PYGL	28	47
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@H]3Cc4ccccc4N(C)C3=O)C2)cc1	ZINC000853790089	GF	On-Demand	Anodyne	PYGM	28	47
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@@H]3Cc4ccccc4N(C)C3=O)C2)cc1	ZINC000853790091	GF	On-Demand	Anodyne	PYGL	28	47
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@@H]3Cc4ccccc4N(C)C3=O)C2)cc1	ZINC000853790091	GF	On-Demand	Anodyne	PYGM	28	47
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790110	EG	On-Demand	Anodyne	HTR1D	68	38
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790110	EG	On-Demand	Anodyne	HTR1B	55	38
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790110	EG	On-Demand	Anodyne	SLC6A4	15	45
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790110	EG	On-Demand	Anodyne	MPO	59	35
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790110	EG	On-Demand	Anodyne	MAPT	16	47
O=C(N[C@H](CC1CC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853790140	EF	On-Demand	Anodyne	CCR5	21	42
O=C(N[C@H](CC1CC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853790143	EF	On-Demand	Anodyne	CCR5	21	42
O=C(N[C@@H](CC1CC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853790145	EF	On-Demand	Anodyne	CCR5	21	42
O=C(N[C@@H](CC1CC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853790147	EF	On-Demand	Anodyne	CCR5	21	42
CCCCC[C@@H](C)NC(=O)CSCC1(C)COC1	ZINC000853790152	CF	On-Demand	Anodyne	NOD1	46	33
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CCC2(COC2)C1)c1ccccc1	ZINC000853790161	GF	On-Demand	Anodyne	FPR1	41	32
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC[C@@H]1CCC(=O)N1)c1ccccc1	ZINC000853790181	GD	On-Demand	Anodyne	SOAT1	20	54
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000853790236	GH	On-Demand	Anodyne	REN	16	40
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H](CC2CC2)c2ccccc2)C1	ZINC000853790238	GH	On-Demand	Anodyne	REN	16	40
COc1cccc(OC)c1CNc1nc(Cl)nc2c1COC2(C)C	ZINC000853790239	EH	On-Demand	Anodyne	EIF2AK1	56	36
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000853790240	GH	On-Demand	Anodyne	REN	16	40
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H](CC2CC2)c2ccccc2)C1	ZINC000853790242	GH	On-Demand	Anodyne	REN	16	40
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CCC(CO)(CO)C1)c1ccccc1	ZINC000853790243	GD	On-Demand	Anodyne	FPR1	40	32
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000853790261	HH	On-Demand	Anodyne	PPARG	45	38
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000853790261	HH	On-Demand	Anodyne	PPARA	44	36
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000853790261	HH	On-Demand	Anodyne	MCHR1	15	40
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000853790261	HH	On-Demand	Anodyne	PDE8B	56	32
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)Nc1ccc(N2CCCCC2)nc1	ZINC000853790261	HH	On-Demand	Anodyne	DGAT1	69	56
CN(C)c1noc(CSCC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853790268	GD	On-Demand	Anodyne	PIK3CA	36	40
CN(C)c1noc(CSCC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853790268	GD	On-Demand	Anodyne	MTOR	74	40
CN(C)c1noc(CSCC(=O)Nc2ccc(N3CCOCC3)cc2)n1	ZINC000853790268	GD	On-Demand	Anodyne	STAT6	55	34
Cc1cc(N2CCc3ccc(Cl)c(Cl)c3C2)nc(N)n1	ZINC000853790279	DG	On-Demand	Anodyne	HRH4	34	50
COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)c2nc(-c3ccccc3)oc2C)cc(C(=O)OC)c1	ZINC000853790287	JG	On-Demand	Anodyne	PPARA	36	40
COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)c2nc(-c3ccccc3)oc2C)cc(C(=O)OC)c1	ZINC000853790287	JG	On-Demand	Anodyne	PDE8B	49	34
COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)c2nc(-c3ccccc3)oc2C)cc(C(=O)OC)c1	ZINC000853790287	JG	On-Demand	Anodyne	IMDH_CRYPV	40	43
COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)c2nc(-c3ccccc3)oc2C)cc(C(=O)OC)c1	ZINC000853790288	JG	On-Demand	Anodyne	PPARA	36	40
COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)c2nc(-c3ccccc3)oc2C)cc(C(=O)OC)c1	ZINC000853790288	JG	On-Demand	Anodyne	PDE8B	49	34
COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)c2nc(-c3ccccc3)oc2C)cc(C(=O)OC)c1	ZINC000853790288	JG	On-Demand	Anodyne	IMDH_CRYPV	40	43
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C/CO)c1ccccc1	ZINC000853790291	EE	On-Demand	Anodyne	PAPA1_CARPA	35	46
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C/CO)c1ccccc1	ZINC000853790291	EE	On-Demand	Anodyne	CTSK	16	48
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C/CO)c1ccccc1	ZINC000853790291	EE	On-Demand	Anodyne	SOAT1	26	59
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C/CO)c1ccccc1	ZINC000853790291	EE	On-Demand	Anodyne	FPR1	46	36
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C\CO)c1ccccc1	ZINC000853790292	EE	On-Demand	Anodyne	PAPA1_CARPA	35	46
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C\CO)c1ccccc1	ZINC000853790292	EE	On-Demand	Anodyne	CTSK	16	48
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C\CO)c1ccccc1	ZINC000853790292	EE	On-Demand	Anodyne	SOAT1	26	59
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NC/C=C\CO)c1ccccc1	ZINC000853790292	EE	On-Demand	Anodyne	FPR1	46	36
O=C(NCCCc1nc[nH]n1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790309	EE	On-Demand	Anodyne	HTR1A	15	50
O=C(NCCCc1nc[nH]n1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790309	EE	On-Demand	Anodyne	HTR1D	45	50
O=C(NCCCc1nc[nH]n1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790309	EE	On-Demand	Anodyne	HTR1B	35	49
O=C(NCCCc1nc[nH]n1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790309	EE	On-Demand	Anodyne	MPO	67	39
O=C(NCCCc1nc[nH]n1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790309	EE	On-Demand	Anodyne	MTNR1A	20	54
O=C(NCCCc1nc[nH]n1)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790309	EE	On-Demand	Anodyne	MAPT	16	49
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@]1(OCCO)CCOC1	ZINC000853790328	GD	On-Demand	Anodyne	HTR1B	19	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@]1(OCCO)CCOC1	ZINC000853790329	GD	On-Demand	Anodyne	HTR1B	19	43
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790335	EF	On-Demand	Anodyne	HTR1A	19	42
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790335	EF	On-Demand	Anodyne	HTR1D	45	42
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790335	EF	On-Demand	Anodyne	HTR1B	33	42
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790335	EF	On-Demand	Anodyne	MPO	83	40
COCCN(CCF)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790335	EF	On-Demand	Anodyne	MAPT	16	46
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@H](c3nccn3C)C(C)(C)CO)C2)cc1	ZINC000853790343	GF	On-Demand	Anodyne	BIRC2	27	40
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@@H](c3nccn3C)C(C)(C)CO)C2)cc1	ZINC000853790344	GF	On-Demand	Anodyne	BIRC2	27	40
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@@H](CO)Cc3ccccc3)C2)cc1	ZINC000853790384	GG	On-Demand	Anodyne	ACE	48	38
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@@H](CO)Cc3ccccc3)C2)cc1	ZINC000853790384	GG	On-Demand	Anodyne	ITGA4	31	40
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@H](CO)Cc3ccccc3)C2)cc1	ZINC000853790385	GG	On-Demand	Anodyne	ACE	48	38
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@H](CO)Cc3ccccc3)C2)cc1	ZINC000853790385	GG	On-Demand	Anodyne	ITGA4	31	40
Cc1ccc(N2CCC[C@@H](NC(=O)NC[C@@H]3CCCN(CC4CC4)C3)C2)cc1	ZINC000853790392	GG	On-Demand	Anodyne	CCR3	60	39
Cc1ccc(N2CCC[C@@H](NC(=O)NC[C@H]3CCCN(CC4CC4)C3)C2)cc1	ZINC000853790394	GG	On-Demand	Anodyne	CCR3	60	39
Cc1cc(N2CCc3ccc(C(C)C)cc3C2)nc(N)n1	ZINC000853790407	CG	On-Demand	Anodyne	HRH4	31	51
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)C1	ZINC000853790410	FD	On-Demand	Anodyne	EPHX2	29	46
CC(=O)c1ccc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc1	ZINC000853790417	FE	On-Demand	Clean	STAT6	41	38
COc1ccc2c(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccnc2c1	ZINC000853790421	GG	On-Demand	Clean	HRP1_PLAFA	114	49
COc1ccc2c(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccnc2c1	ZINC000853790421	GG	On-Demand	Clean	HNMT	58	37
COc1ccc2c(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)ccnc2c1	ZINC000853790421	GG	On-Demand	Clean	MET	41	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)OC(=O)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000853790426	JI	On-Demand	Bother	TAAR1	15	41
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(Br)c([N+](=O)[O-])c1	ZINC000853790428	JI	On-Demand	Bother	TAAR1	15	41
O=C(CSCC1CC=CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853790468	EG	On-Demand	Anodyne	MTOR	66	36
O=C(CSCC1CC=CC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853790468	EG	On-Demand	Anodyne	STAT6	53	32
COc1cccc(OC)c1CNc1nccc(N2CCCC2)n1	ZINC000853790513	DF	On-Demand	Anodyne	SORD	47	35
COc1cccc(OC)c1CNc1nccc(N2CCCC2)n1	ZINC000853790513	DF	On-Demand	Anodyne	GALR2	45	36
CN(C)c1ccc(N2CCC(NC(=O)N[C@@]3(C)CC3(C)C)CC2)cc1	ZINC000853790547	EG	On-Demand	Anodyne	EPHX2	24	40
CN(C)c1ccc(N2CCC(NC(=O)N[C@]3(C)CC3(C)C)CC2)cc1	ZINC000853790549	EG	On-Demand	Anodyne	EPHX2	24	40
CN1C[C@@H](CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CC1=O	ZINC000853790585	GE	On-Demand	Anodyne	SOAT1	20	55
CN1C[C@H](CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccccc2)CC1=O	ZINC000853790586	GE	On-Demand	Anodyne	SOAT1	20	55
CN1C[C@H](CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CC1=O	ZINC000853790587	GE	On-Demand	Anodyne	SOAT1	20	55
CN1C[C@@H](CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccccc2)CC1=O	ZINC000853790588	GE	On-Demand	Anodyne	SOAT1	20	55
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC2CC1(C)C2)c1ccccc1	ZINC000853790590	FG	On-Demand	Anodyne	CTSK	25	41
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC2CC1(C)C2)c1ccccc1	ZINC000853790590	FG	On-Demand	Anodyne	FPR1	43	34
C#CCCCOc1cccnc1NCc1c(OC)cccc1OC	ZINC000853790591	EH	On-Demand	Mild	EIF2AK1	47	33
COc1cccc(OC)c1CNc1cc(C)nc(N)n1	ZINC000853790605	CD	On-Demand	Anodyne	DHFR	35	41
COc1cccc(OC)c1CNc1cc(C)nc(N)n1	ZINC000853790605	CD	On-Demand	Anodyne	HRH4	15	42
COc1cccc(OC)c1CNc1cc(C)nc(N)n1	ZINC000853790605	CD	On-Demand	Anodyne	DRTS_TOXGO	57	42
CON(C)CCNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790606	FE	On-Demand	Anodyne	PAPA1_CARPA	35	41
CON(C)CCNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790606	FE	On-Demand	Anodyne	SOAT1	21	58
CON(C)CCNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790606	FE	On-Demand	Anodyne	FPR1	40	34
CON(C)CCNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790607	FE	On-Demand	Anodyne	PAPA1_CARPA	35	41
CON(C)CCNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790607	FE	On-Demand	Anodyne	SOAT1	21	58
CON(C)CCNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790607	FE	On-Demand	Anodyne	FPR1	40	34
O=S1(=O)CCN(c2ccc(CNc3ncc(Cl)cc3Cl)cc2)CC1	ZINC000853790631	GG	On-Demand	Clean	STAT6	41	35
O=C1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@@H]2N1	ZINC000853790633	FF	On-Demand	Anodyne	HTR1D	67	42
O=C1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@@H]2N1	ZINC000853790633	FF	On-Demand	Anodyne	HTR1B	54	42
O=C1CC[C@@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@@H]2N1	ZINC000853790634	FF	On-Demand	Anodyne	HTR1D	67	42
O=C1CC[C@@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@@H]2N1	ZINC000853790634	FF	On-Demand	Anodyne	HTR1B	54	42
O=C1CC[C@@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@H]2N1	ZINC000853790635	FF	On-Demand	Anodyne	HTR1D	67	42
O=C1CC[C@@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@H]2N1	ZINC000853790635	FF	On-Demand	Anodyne	HTR1B	54	42
O=C1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@H]2N1	ZINC000853790636	FF	On-Demand	Anodyne	HTR1D	67	42
O=C1CC[C@H]2CN(C(=O)NCCc3c[nH]c4ccc(Cl)cc34)CC[C@H]2N1	ZINC000853790636	FF	On-Demand	Anodyne	HTR1B	54	42
NC(=O)c1cc(Cl)nnc1NCc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000853790638	GD	On-Demand	Clean	STAT6	85	43
C[C@@H]1CN(CCNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H](C)CO1	ZINC000853790643	GF	On-Demand	Anodyne	HTR1D	46	41
C[C@@H]1CN(CCNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H](C)CO1	ZINC000853790643	GF	On-Demand	Anodyne	HTR1B	35	41
C[C@@H]1CN(CCNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H](C)CO1	ZINC000853790643	GF	On-Demand	Anodyne	MPO	46	34
C[C@@H]1CN(CCNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)[C@H](C)CO1	ZINC000853790643	GF	On-Demand	Anodyne	MAPT	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(n2cnnc2O)CC1	ZINC000853790644	GF	On-Demand	Anodyne	HTR1D	101	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(n2cnnc2O)CC1	ZINC000853790644	GF	On-Demand	Anodyne	HTR1B	79	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853790653	FE	On-Demand	Anodyne	HTR1D	44	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853790653	FE	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@](O)(C2CC2)C1	ZINC000853790654	FG	On-Demand	Anodyne	HTR1D	68	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@](O)(C2CC2)C1	ZINC000853790654	FG	On-Demand	Anodyne	HTR1B	52	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@](O)(C2CC2)C1	ZINC000853790654	FG	On-Demand	Anodyne	EPHX2	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@](O)(C2CC2)C1	ZINC000853790654	FG	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@](O)(C2CC2)C1	ZINC000853790655	FG	On-Demand	Anodyne	HTR1D	68	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@](O)(C2CC2)C1	ZINC000853790655	FG	On-Demand	Anodyne	HTR1B	52	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@](O)(C2CC2)C1	ZINC000853790655	FG	On-Demand	Anodyne	EPHX2	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@](O)(C2CC2)C1	ZINC000853790655	FG	On-Demand	Anodyne	MAPT	15	43
Cc1nnc(CN(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)o1	ZINC000853790656	EF	On-Demand	Anodyne	MPO	64	37
Cc1nnc(CN(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)o1	ZINC000853790656	EF	On-Demand	Anodyne	MAPT	15	43
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	HTR1A	18	49
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	HTR1D	63	49
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	HTR1B	39	49
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	NQO2	31	52
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	MPO	77	42
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	HTR5A	20	40
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	MTNR1A	34	62
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	MTNR1B	20	52
CON(C)CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853790668	DE	On-Demand	Anodyne	MAPT	16	48
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@H]3C[C@H](O)C3)C2)cc1	ZINC000853790715	DD	On-Demand	Anodyne	EPHX2	16	40
C[C@@H](CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12)N(C)C	ZINC000853790738	EG	On-Demand	Anodyne	HTR1A	15	46
C[C@@H](CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12)N(C)C	ZINC000853790738	EG	On-Demand	Anodyne	HTR1D	61	46
C[C@@H](CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12)N(C)C	ZINC000853790738	EG	On-Demand	Anodyne	HTR1B	40	46
C[C@@H](CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12)N(C)C	ZINC000853790738	EG	On-Demand	Anodyne	MPO	75	42
C[C@@H](CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12)N(C)C	ZINC000853790738	EG	On-Demand	Anodyne	BRS3	23	40
C[C@@H](CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12)N(C)C	ZINC000853790738	EG	On-Demand	Anodyne	MTNR1A	15	55
C[C@@H](CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12)N(C)C	ZINC000853790738	EG	On-Demand	Anodyne	MAPT	16	47
COCCN(CCF)C(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000853790742	DG	On-Demand	Anodyne	AMY2	44	30
C=CCCNc1nccc(N2CCCC2)n1	ZINC000853790785	BE	On-Demand	Mild	SORD	42	39
CN(C)c1ccc(N2CCC(NC(=O)NC(C)(C3CC3)C3CC3)CC2)cc1	ZINC000853790793	FH	On-Demand	Anodyne	EPHX2	24	41
C[C@@H](CCNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)N(C)C	ZINC000853790802	GF	On-Demand	Anodyne	CTSK	21	44
C[C@@H](CCNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)N(C)C	ZINC000853790802	GF	On-Demand	Anodyne	SOAT1	27	60
C[C@@H](CCNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1)N(C)C	ZINC000853790802	GF	On-Demand	Anodyne	FPR1	45	36
C[C@@H](CCNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)N(C)C	ZINC000853790805	GF	On-Demand	Anodyne	CTSK	21	44
C[C@@H](CCNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)N(C)C	ZINC000853790805	GF	On-Demand	Anodyne	SOAT1	27	60
C[C@@H](CCNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1)N(C)C	ZINC000853790805	GF	On-Demand	Anodyne	FPR1	45	36
COc1cccc(OC)c1CNc1nccc2c1C(=O)OC2(C)C	ZINC000853790844	EG	On-Demand	Anodyne	EIF2AK1	41	37
CN(C)c1ccc(N2CCC(NC(=O)NCC(O)(C3CC3)C3CC3)CC2)cc1	ZINC000853790851	GF	On-Demand	Anodyne	EPHX2	27	40
CN(C)c1ccc(N2CCC(NC(=O)NC3CC(CO)C3)CC2)cc1	ZINC000853790853	ED	On-Demand	Anodyne	EPHX2	26	45
COCC1(NC(=O)NC2CCN(c3ccc(N(C)C)cc3)CC2)CCCC1	ZINC000853790858	FF	On-Demand	Anodyne	EPHX2	29	40
COCCN(CCF)C(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853790863	FG	On-Demand	Anodyne	DRD4	40	32
COCCN(CCF)C(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853790863	FG	On-Demand	Anodyne	ROCK2	47	38
COCCN(CCF)C(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853790863	FG	On-Demand	Anodyne	HSD17B2	21	45
C[C@@H](CNC(=O)NC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C)c1ccccn1	ZINC000853790889	GG	On-Demand	Anodyne	GPR119	18	41
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790907	FE	On-Demand	Anodyne	PAPA1_CARPA	38	41
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790907	FE	On-Demand	Anodyne	CTSK	21	48
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790907	FE	On-Demand	Anodyne	TACR3	50	37
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790907	FE	On-Demand	Anodyne	SOAT1	29	62
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790907	FE	On-Demand	Anodyne	FPR1	44	36
CC[C@@H](O)CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790908	FE	On-Demand	Anodyne	PAPA1_CARPA	38	41
CC[C@@H](O)CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790908	FE	On-Demand	Anodyne	CTSK	21	48
CC[C@@H](O)CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790908	FE	On-Demand	Anodyne	TACR3	50	37
CC[C@@H](O)CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790908	FE	On-Demand	Anodyne	SOAT1	29	62
CC[C@@H](O)CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853790908	FE	On-Demand	Anodyne	FPR1	44	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCN([C@H]2CCOC2)CC1	ZINC000853790925	GE	On-Demand	Anodyne	HTR1D	70	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCN([C@H]2CCOC2)CC1	ZINC000853790925	GE	On-Demand	Anodyne	HTR1B	54	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCN([C@@H]2CCOC2)CC1	ZINC000853790926	GE	On-Demand	Anodyne	HTR1D	70	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCN([C@@H]2CCOC2)CC1	ZINC000853790926	GE	On-Demand	Anodyne	HTR1B	54	38
O=S1(=O)CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853790928	GH	On-Demand	Clean	ROCK1	15	42
O=S1(=O)CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853790928	GH	On-Demand	Clean	SPHK2	50	33
O=S1(=O)CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853790928	GH	On-Demand	Clean	SPHK1	49	41
N#Cc1ccnc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c1	ZINC000853790933	ED	On-Demand	Mild	MAP3K12	50	35
Cc1ccc(N2CCC[C@@H](NC(=O)N3CCC(N4CC[C@H](O)C4)CC3)C2)cc1	ZINC000853790964	GE	On-Demand	Anodyne	L3MBTL3	60	38
Cc1ccc(N2CCC[C@@H](NC(=O)N3CCC(N4CC[C@@H](O)C4)CC3)C2)cc1	ZINC000853790968	GE	On-Demand	Anodyne	L3MBTL3	60	38
CC(=O)c1ccc(C#N)cc1NCc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000853790971	GF	On-Demand	Mild	CSF1R	16	42
C#CCCN(CCOC)C(=O)NCC1(N2CCCCC2)CCN(C)CC1	ZINC000853790972	FD	On-Demand	Mild	HCN1	60	39
C#CCCN(CCOC)C(=O)NCC1(N2CCCCC2)CCN(C)CC1	ZINC000853790972	FD	On-Demand	Mild	HCN4	49	32
Cc1ccc(N2CCC[C@@H](NC(=O)NCC3CCN(CC4CC4)CC3)C2)cc1	ZINC000853790990	GG	On-Demand	Anodyne	CACNA1I	55	39
CN(C[C@@H]1COCCO1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791000	FE	On-Demand	Anodyne	HTR1A	15	43
CN(C[C@@H]1COCCO1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791000	FE	On-Demand	Anodyne	SLC6A4	15	43
CN(C[C@@H]1COCCO1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791000	FE	On-Demand	Anodyne	MPO	72	38
CN(C[C@@H]1COCCO1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791000	FE	On-Demand	Anodyne	MAPT	15	43
O=C(NC/C=C/CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791002	DE	On-Demand	Anodyne	HTR1D	43	50
O=C(NC/C=C/CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791002	DE	On-Demand	Anodyne	HTR1B	34	50
O=C(NC/C=C/CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791002	DE	On-Demand	Anodyne	MPO	77	40
O=C(NC/C=C/CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791002	DE	On-Demand	Anodyne	MAPT	17	51
O=C(NC/C=C\CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791004	DE	On-Demand	Anodyne	HTR1D	43	50
O=C(NC/C=C\CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791004	DE	On-Demand	Anodyne	HTR1B	34	50
O=C(NC/C=C\CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791004	DE	On-Demand	Anodyne	MPO	77	40
O=C(NC/C=C\CO)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791004	DE	On-Demand	Anodyne	MAPT	17	51
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000853791024	IK	On-Demand	Anodyne	PPARG	43	37
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000853791024	IK	On-Demand	Anodyne	PPARA	44	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H](CO)C1CCC1	ZINC000853791026	EF	On-Demand	Anodyne	HTR1D	45	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H](CO)C1CCC1	ZINC000853791026	EF	On-Demand	Anodyne	HTR1B	32	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H](CO)C1CCC1	ZINC000853791026	EF	On-Demand	Anodyne	MPO	50	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H](CO)C1CCC1	ZINC000853791026	EF	On-Demand	Anodyne	MAPT	16	49
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H](CO)C1CCC1	ZINC000853791027	EF	On-Demand	Anodyne	HTR1D	45	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H](CO)C1CCC1	ZINC000853791027	EF	On-Demand	Anodyne	HTR1B	32	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H](CO)C1CCC1	ZINC000853791027	EF	On-Demand	Anodyne	MPO	50	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H](CO)C1CCC1	ZINC000853791027	EF	On-Demand	Anodyne	MAPT	16	49
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000853791028	IK	On-Demand	Anodyne	PPARG	43	37
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000853791028	IK	On-Demand	Anodyne	PPARA	44	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000853791030	IK	On-Demand	Anodyne	PPARG	43	37
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000853791030	IK	On-Demand	Anodyne	PPARA	44	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000853791031	IK	On-Demand	Anodyne	PPARG	43	37
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000853791031	IK	On-Demand	Anodyne	PPARA	44	42
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(Cl)c1	ZINC000853791032	DD	On-Demand	Anodyne	MTNR1A	27	48
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(Cl)c1	ZINC000853791032	DD	On-Demand	Anodyne	MTNR1B	20	48
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(Cl)c1	ZINC000853791033	DD	On-Demand	Anodyne	MTNR1A	27	48
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(Cl)c1	ZINC000853791033	DD	On-Demand	Anodyne	MTNR1B	20	48
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853791037	FG	On-Demand	Anodyne	HTR1A	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853791037	FG	On-Demand	Anodyne	HTR1D	58	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853791037	FG	On-Demand	Anodyne	HTR1B	46	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853791037	FG	On-Demand	Anodyne	MPO	42	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853791037	FG	On-Demand	Anodyne	CPT1A	51	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853791039	FG	On-Demand	Anodyne	HTR1A	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853791039	FG	On-Demand	Anodyne	HTR1D	58	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853791039	FG	On-Demand	Anodyne	HTR1B	46	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853791039	FG	On-Demand	Anodyne	MPO	42	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853791039	FG	On-Demand	Anodyne	CPT1A	51	34
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@H](C3CC3)C(C)(C)CO)C2)cc1	ZINC000853791051	FG	On-Demand	Anodyne	BIRC2	34	40
Cc1ccc(N2CCC[C@@H](NC(=O)N[C@@H](C3CC3)C(C)(C)CO)C2)cc1	ZINC000853791053	FG	On-Demand	Anodyne	BIRC2	34	40
O=S1(=O)CCN(c2ccc(CNc3nc4ccccc4[nH]3)cc2)CC1	ZINC000853791062	FE	On-Demand	Clean	KCNN3	36	57
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H](CCF)C1	ZINC000853791063	FI	On-Demand	Anodyne	HTR1A	20	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H](CCF)C1	ZINC000853791063	FI	On-Demand	Anodyne	HTR1D	95	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H](CCF)C1	ZINC000853791063	FI	On-Demand	Anodyne	HTR1B	73	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H](CCF)C1	ZINC000853791063	FI	On-Demand	Anodyne	SLC6A4	17	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H](CCF)C1	ZINC000853791063	FI	On-Demand	Anodyne	MPO	66	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H](CCF)C1	ZINC000853791063	FI	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H](CCF)C1	ZINC000853791065	FI	On-Demand	Anodyne	HTR1A	20	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H](CCF)C1	ZINC000853791065	FI	On-Demand	Anodyne	HTR1D	95	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H](CCF)C1	ZINC000853791065	FI	On-Demand	Anodyne	HTR1B	73	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H](CCF)C1	ZINC000853791065	FI	On-Demand	Anodyne	SLC6A4	17	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H](CCF)C1	ZINC000853791065	FI	On-Demand	Anodyne	MPO	66	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H](CCF)C1	ZINC000853791065	FI	On-Demand	Anodyne	MAPT	15	43
CN(Cc1cnc[nH]1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791093	EF	On-Demand	Anodyne	HTR1D	44	37
CN(Cc1cnc[nH]1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791093	EF	On-Demand	Anodyne	MPO	69	38
CN(Cc1cnc[nH]1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791093	EF	On-Demand	Anodyne	MAPT	15	44
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(F)c1	ZINC000853791107	CD	On-Demand	Anodyne	MTNR1A	25	48
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(F)c1	ZINC000853791107	CD	On-Demand	Anodyne	MTNR1B	19	48
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(F)c1	ZINC000853791108	CD	On-Demand	Anodyne	MTNR1A	25	48
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(F)c1	ZINC000853791108	CD	On-Demand	Anodyne	MTNR1B	19	48
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCC1CCC(O)CC1)c1ccccc1	ZINC000853791118	GG	On-Demand	Anodyne	SOAT1	20	57
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCC1CCC(O)CC1)c1ccccc1	ZINC000853791118	GG	On-Demand	Anodyne	REN	40	36
CC(C)(C)OC(=O)N[C@@H](CNC(=O)NCC1CCC(O)CC1)c1ccccc1	ZINC000853791118	GG	On-Demand	Anodyne	FPR1	41	37
COc1cccc(OC)c1CNc1ncnc2c1CCC2	ZINC000853791120	CF	On-Demand	Anodyne	EIF2AK1	55	37
C#CCCN(CCOC)C(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853791133	FH	On-Demand	Mild	DRD4	40	31
C#CCCN(CCOC)C(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853791133	FH	On-Demand	Mild	ROCK2	49	37
C#CCCN(CCOC)C(=O)NCc1ccc(-c2cccc(OC)c2)cc1	ZINC000853791133	FH	On-Demand	Mild	HSD17B2	15	43
Fc1cccc(-c2nnc(CSCC3CC=CC3)o2)c1	ZINC000853791137	CI	On-Demand	Anodyne	CYP73A16	15	46
C[C@@H](CCNC(=O)NC1CCN(c2ccc(N(C)C)cc2)CC1)N(C)C	ZINC000853791219	FE	On-Demand	Anodyne	EPHX2	21	41
CSC1(CNC(=O)NNc2nc3ccc(Cl)cc3s2)CCOCC1	ZINC000853791235	GG	On-Demand	Reactive	CSNK1D	34	41
O=S1(=O)CCN(c2ccc(CNc3ccnc4cc(F)ccc34)cc2)CC1	ZINC000853791315	GG	On-Demand	Clean	HRP1_PLAFA	94	36
O=S1(=O)CCN(c2ccc(CNc3ccnc4cc(F)ccc34)cc2)CC1	ZINC000853791315	GG	On-Demand	Clean	HNMT	53	34
CN1CCC(CNC(=O)NNc2cc(F)cc(Cl)c2)(N2CCCCC2)CC1	ZINC000853791321	GG	On-Demand	Reactive	HCN1	60	38
CN1CCC(CNC(=O)NNc2cc(F)cc(Cl)c2)(N2CCCCC2)CC1	ZINC000853791321	GG	On-Demand	Reactive	HCN4	49	33
Cc1ccc(N2CCC[C@@H](NC(=O)N3CCC(c4ccon4)CC3)C2)cc1	ZINC000853791368	FH	On-Demand	Anodyne	SMO	23	40
COc1ccc(N2CCN(C(=O)CSC[C@H](OC)C3CCC3)CC2)cc1	ZINC000853791371	GF	On-Demand	Clean	NPBWR1	43	30
COc1ccc(N2CCN(C(=O)CSC[C@@H](OC)C3CCC3)CC2)cc1	ZINC000853791372	GF	On-Demand	Clean	NPBWR1	43	30
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](O)C(F)(F)C1	ZINC000853791448	FF	On-Demand	Anodyne	HTR1A	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](O)C(F)(F)C1	ZINC000853791448	FF	On-Demand	Anodyne	HTR1D	97	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](O)C(F)(F)C1	ZINC000853791448	FF	On-Demand	Anodyne	HTR1B	77	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](O)C(F)(F)C1	ZINC000853791448	FF	On-Demand	Anodyne	MPO	73	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](O)C(F)(F)C1	ZINC000853791448	FF	On-Demand	Anodyne	MAPT	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](O)C(F)(F)C1	ZINC000853791450	FF	On-Demand	Anodyne	HTR1A	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](O)C(F)(F)C1	ZINC000853791450	FF	On-Demand	Anodyne	HTR1D	97	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](O)C(F)(F)C1	ZINC000853791450	FF	On-Demand	Anodyne	HTR1B	77	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](O)C(F)(F)C1	ZINC000853791450	FF	On-Demand	Anodyne	MPO	73	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](O)C(F)(F)C1	ZINC000853791450	FF	On-Demand	Anodyne	MAPT	15	44
O=C(CSCC[C@@H]1CCc2ccccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853791461	GI	On-Demand	Anodyne	MTOR	51	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(O)(CO)CC1	ZINC000853791474	FD	On-Demand	Anodyne	HTR1D	77	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(O)(CO)CC1	ZINC000853791474	FD	On-Demand	Anodyne	HTR1B	58	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(O)(CO)CC1	ZINC000853791474	FD	On-Demand	Anodyne	MPO	65	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(O)(CO)CC1	ZINC000853791474	FD	On-Demand	Anodyne	MAPT	16	47
CON(C)CCNC(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000853791570	CE	On-Demand	Anodyne	SOAT1	17	40
CON(C)CCNC(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000853791571	CE	On-Demand	Anodyne	SOAT1	17	40
C#CCCN(CCOC)C(=O)N[C@H](CC1CC1)c1ccccc1	ZINC000853791572	DG	On-Demand	Mild	AMY2	42	29
C#CCCN(CCOC)C(=O)N[C@@H](CC1CC1)c1ccccc1	ZINC000853791573	DG	On-Demand	Mild	AMY2	42	29
O=C(CSCC[C@H]1CCc2ccccc21)Nc1ccc(N2CCOCC2)cc1	ZINC000853791595	GI	On-Demand	Anodyne	MTOR	51	36
C=CCN(CC=C)C(=O)[C@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791597	FG	On-Demand	Mild	PPARG	49	37
C=CCN(CC=C)C(=O)[C@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791597	FG	On-Demand	Mild	PPARA	52	44
C=CCN(CC=C)C(=O)[C@@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791598	FG	On-Demand	Mild	PPARG	49	37
C=CCN(CC=C)C(=O)[C@@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791598	FG	On-Demand	Mild	PPARA	52	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000853791615	FE	On-Demand	Mild	COLA	112	38
CN1CCC(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791616	GE	On-Demand	Anodyne	HCN1	82	44
CN1CCC(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791616	GE	On-Demand	Anodyne	HCN4	57	36
CN1CCC(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791617	GE	On-Demand	Anodyne	HCN1	82	44
CN1CCC(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791617	GE	On-Demand	Anodyne	HCN4	57	36
CN1CCC(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791618	GE	On-Demand	Anodyne	HCN1	82	44
CN1CCC(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791618	GE	On-Demand	Anodyne	HCN4	57	36
CN1CCC(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791619	GE	On-Demand	Anodyne	HCN1	82	44
CN1CCC(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)(N2CCCCC2)CC1	ZINC000853791619	GE	On-Demand	Anodyne	HCN4	57	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000853791627	IG	On-Demand	Anodyne	PPARG	58	43
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000853791627	IG	On-Demand	Anodyne	PPARA	62	43
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000853791627	IG	On-Demand	Anodyne	PDE8B	57	33
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000853791628	IG	On-Demand	Anodyne	PPARG	58	43
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000853791628	IG	On-Demand	Anodyne	PPARA	62	43
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000853791628	IG	On-Demand	Anodyne	PDE8B	57	33
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853791636	GF	On-Demand	Anodyne	HTR1D	54	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853791636	GF	On-Demand	Anodyne	HTR1B	40	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853791636	GF	On-Demand	Anodyne	MAPT	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853791639	GF	On-Demand	Anodyne	HTR1D	54	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853791639	GF	On-Demand	Anodyne	HTR1B	40	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853791639	GF	On-Demand	Anodyne	MAPT	15	42
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791641	GE	On-Demand	Anodyne	HTR1D	53	43
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791641	GE	On-Demand	Anodyne	HTR1B	38	43
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791641	GE	On-Demand	Anodyne	MPO	61	36
Cn1c(S)nnc1CCNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791641	GE	On-Demand	Anodyne	MAPT	15	46
O=C(CSCCC1CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853791642	EG	On-Demand	Anodyne	MTOR	74	38
O=C(CSCCC1CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853791642	EG	On-Demand	Anodyne	EPHX2	23	45
O=C(CSCCC1CCC1)Nc1ccc(N2CCOCC2)cc1	ZINC000853791642	EG	On-Demand	Anodyne	STAT6	51	32
c1ccc2c(CCNc3nccc(N4CCCC4)n3)ccnc2c1	ZINC000853791644	DG	On-Demand	Anodyne	HNMT	101	45
c1ccc2c(CCNc3nccc(N4CCCC4)n3)ccnc2c1	ZINC000853791644	DG	On-Demand	Anodyne	SORD	45	42
c1ccc2c(CCNc3nccc(N4CCCC4)n3)ccnc2c1	ZINC000853791644	DG	On-Demand	Anodyne	MRGPRX1	41	39
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000853791648	GF	On-Demand	Bother	COLA	43	34
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000853791650	GF	On-Demand	Bother	COLA	43	34
Cc1nc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)sc1C	ZINC000853791653	FF	On-Demand	Clean	SLC27A1	15	45
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791673	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791673	FD	On-Demand	Anodyne	NQO2	23	40
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791673	FD	On-Demand	Anodyne	MTNR1A	66	53
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791673	FD	On-Demand	Anodyne	MTNR1B	62	53
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791675	FD	On-Demand	Anodyne	DRD4	40	31
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791675	FD	On-Demand	Anodyne	NQO2	23	40
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791675	FD	On-Demand	Anodyne	MTNR1A	66	53
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853791675	FD	On-Demand	Anodyne	MTNR1B	62	53
COc1cccc(O[C@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791680	DD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791680	DD	On-Demand	Anodyne	NQO2	26	44
COc1cccc(O[C@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791680	DD	On-Demand	Anodyne	MTNR1A	85	63
COc1cccc(O[C@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791680	DD	On-Demand	Anodyne	MTNR1B	75	63
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791681	DE	On-Demand	Anodyne	HTR1D	37	47
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791681	DE	On-Demand	Anodyne	HTR1B	31	47
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791681	DE	On-Demand	Anodyne	MPO	87	43
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791681	DE	On-Demand	Anodyne	BRS3	23	41
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791681	DE	On-Demand	Anodyne	MTNR1A	15	56
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791681	DE	On-Demand	Anodyne	MAPT	16	48
COc1cccc(O[C@@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791682	DD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(O[C@@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791682	DD	On-Demand	Anodyne	NQO2	26	44
COc1cccc(O[C@@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791682	DD	On-Demand	Anodyne	MTNR1A	85	63
COc1cccc(O[C@@H](C)CNC(=O)NCCN(C)OC)c1	ZINC000853791682	DD	On-Demand	Anodyne	MTNR1B	75	63
N#Cc1ccc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(F)c1	ZINC000853791703	FF	On-Demand	Mild	CSF1R	16	45
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853791712	JF	On-Demand	Anodyne	PDE8B	50	31
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853791714	JF	On-Demand	Anodyne	PDE8B	50	31
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853791716	JF	On-Demand	Anodyne	PDE8B	50	31
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853791718	JF	On-Demand	Anodyne	PDE8B	50	31
CCN1CC[C@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791735	FG	On-Demand	Anodyne	HTR1A	21	41
CCN1CC[C@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791735	FG	On-Demand	Anodyne	HTR1D	111	41
CCN1CC[C@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791735	FG	On-Demand	Anodyne	HTR1B	86	41
CCN1CC[C@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791735	FG	On-Demand	Anodyne	SLC6A4	20	41
CCN1CC[C@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791735	FG	On-Demand	Anodyne	MPO	70	37
CCN1CC[C@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791735	FG	On-Demand	Anodyne	MAPT	15	43
CCN1CC[C@@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791742	FG	On-Demand	Anodyne	HTR1A	21	41
CCN1CC[C@@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791742	FG	On-Demand	Anodyne	HTR1D	111	41
CCN1CC[C@@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791742	FG	On-Demand	Anodyne	HTR1B	86	41
CCN1CC[C@@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791742	FG	On-Demand	Anodyne	SLC6A4	20	41
CCN1CC[C@@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791742	FG	On-Demand	Anodyne	MPO	70	37
CCN1CC[C@@H](N(CC)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791742	FG	On-Demand	Anodyne	MAPT	15	43
N#Cc1ccc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1Cl	ZINC000853791774	GG	On-Demand	Mild	MAP3K8	70	37
O=S1(=O)CCN(c2ccc(CNc3nccc(N4CCCC4)n3)cc2)CC1	ZINC000853791776	GD	On-Demand	Clean	STAT6	21	40
O=S1(=O)CCN(c2ccc(CNc3nccc(N4CCCC4)n3)cc2)CC1	ZINC000853791776	GD	On-Demand	Clean	MRGPRX1	40	34
O=S1(=O)CCN(c2ccc(CNc3ncccc3F)cc2)CC1	ZINC000853791794	EE	On-Demand	Clean	STAT6	57	36
C=CCCNc1ccc(C(=O)OC)cn1	ZINC000853791833	BD	On-Demand	Mild	HCAR3	15	52
C=CCCNc1c(C(=O)OC)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853791843	CE	On-Demand	Mild	CACNA1D	46	38
O=C(N[C@H](CC1CC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853791844	FG	On-Demand	Anodyne	CCR5	17	42
O=C(N[C@@H](CC1CC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853791845	FG	On-Demand	Anodyne	CCR5	17	42
CN(C)c1ccc(N2CCC(NC(=O)N[C@@H]3C[C@H](O)C34CCC4)CC2)cc1	ZINC000853791858	FE	On-Demand	Anodyne	EPHX2	19	42
CN(C)c1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)C34CCC4)CC2)cc1	ZINC000853791860	FE	On-Demand	Anodyne	EPHX2	19	42
CN(C)c1ccc(N2CCC(NC(=O)N[C@H]3C[C@@H](O)C34CCC4)CC2)cc1	ZINC000853791862	FE	On-Demand	Anodyne	EPHX2	19	42
CN(C)c1ccc(N2CCC(NC(=O)N[C@@H]3C[C@@H](O)C34CCC4)CC2)cc1	ZINC000853791864	FE	On-Demand	Anodyne	EPHX2	19	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCCCO2	ZINC000853791897	HH	On-Demand	Anodyne	PDE8B	47	32
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCCCO2	ZINC000853791897	HH	On-Demand	Anodyne	IMDH_CRYPV	44	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCCCO2	ZINC000853791902	HH	On-Demand	Anodyne	PDE8B	47	32
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCCCO2	ZINC000853791902	HH	On-Demand	Anodyne	IMDH_CRYPV	44	44
C=C(C)CN(CC)C(=O)[C@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791910	FH	On-Demand	Mild	PPARG	51	37
C=C(C)CN(CC)C(=O)[C@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791910	FH	On-Demand	Mild	PPARA	54	42
C=C(C)CN(CC)C(=O)[C@@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791912	FH	On-Demand	Mild	PPARG	51	37
C=C(C)CN(CC)C(=O)[C@@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853791912	FH	On-Demand	Mild	PPARA	54	42
CN1CCC(CNC(=O)NCCc2nnc(S)n2C)(N2CCCCC2)CC1	ZINC000853791925	GC	On-Demand	Anodyne	HCN1	56	38
CN1CCC(CNC(=O)NCCc2nnc(S)n2C)(N2CCCCC2)CC1	ZINC000853791925	GC	On-Demand	Anodyne	HCN4	49	32
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000853791957	IH	On-Demand	Anodyne	PDE8B	43	31
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000853791958	IH	On-Demand	Anodyne	PDE8B	43	31
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000853791959	IH	On-Demand	Anodyne	PDE8B	43	31
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000853791960	IH	On-Demand	Anodyne	PDE8B	43	31
O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853791966	EF	On-Demand	Bother	COLA	89	33
O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853791968	EF	On-Demand	Bother	COLA	89	33
O=C(NCCc1ccccc1[N+](=O)[O-])N[C@H]1C[C@H](O)c2ccccc21	ZINC000853791970	EF	On-Demand	Bother	COLA	89	33
N#CC[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791971	EH	On-Demand	Mild	HTR1A	16	43
N#CC[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791971	EH	On-Demand	Mild	HTR1D	68	39
N#CC[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791971	EH	On-Demand	Mild	HTR1B	52	39
N#CC[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791971	EH	On-Demand	Mild	MPO	40	34
N#CC[C@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791971	EH	On-Demand	Mild	MAPT	16	47
O=C(NCCc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853791972	EF	On-Demand	Bother	COLA	89	33
N#CC[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791973	EH	On-Demand	Mild	HTR1A	16	43
N#CC[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791973	EH	On-Demand	Mild	HTR1D	68	39
N#CC[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791973	EH	On-Demand	Mild	HTR1B	52	39
N#CC[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791973	EH	On-Demand	Mild	MPO	40	34
N#CC[C@@H]1CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853791973	EH	On-Demand	Mild	MAPT	16	47
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@@H]2CCCC[C@@H]21	ZINC000853791984	EH	On-Demand	Anodyne	HTR1A	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@@H]2CCCC[C@@H]21	ZINC000853791984	EH	On-Demand	Anodyne	HTR1D	66	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@@H]2CCCC[C@@H]21	ZINC000853791984	EH	On-Demand	Anodyne	HTR1B	50	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@@H]2CCCC[C@@H]21	ZINC000853791984	EH	On-Demand	Anodyne	MPO	55	35
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@@H]2CCCC[C@@H]21	ZINC000853791984	EH	On-Demand	Anodyne	MAPT	15	45
Nc1nc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc(-n2cccn2)n1	ZINC000853791994	GD	On-Demand	Clean	HRH4	18	51
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853791996	GF	On-Demand	Anodyne	ACE	51	44
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853791996	GF	On-Demand	Anodyne	MME	41	44
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853791996	GF	On-Demand	Anodyne	BIRC2	40	35
CN(CC1=CCCOC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791997	EG	On-Demand	Anodyne	HTR1D	52	36
CN(CC1=CCCOC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791997	EG	On-Demand	Anodyne	HTR1B	41	36
CN(CC1=CCCOC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791997	EG	On-Demand	Anodyne	MPO	70	38
CN(CC1=CCCOC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853791997	EG	On-Demand	Anodyne	MAPT	15	42
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853791998	GF	On-Demand	Anodyne	ACE	51	44
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853791998	GF	On-Demand	Anodyne	MME	41	44
Cc1ccc(N2CCC[C@@H](NC(=O)N(C)[C@@H](CO)Cc3ccccc3)C2=O)cc1	ZINC000853791998	GF	On-Demand	Anodyne	BIRC2	40	35
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	HTR1D	71	38
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	HTR1B	46	38
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	EDNRB	44	36
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	MC4R	31	40
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	CCKAR	61	42
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	MPO	69	38
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	BRS3	28	46
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	MC3R	48	39
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	MMP11	60	36
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	CCKBR	45	37
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	MC1R	60	40
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	KISS1R	58	35
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](CO)Cc1ccccc1	ZINC000853792026	GH	On-Demand	Anodyne	MAPT	16	49
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	HTR1D	71	38
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	HTR1B	46	38
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	EDNRB	44	36
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	MC4R	31	40
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	CCKAR	61	42
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	MPO	69	38
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	BRS3	28	46
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	MC3R	48	39
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	MMP11	60	36
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	CCKBR	45	37
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	MC1R	60	40
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	KISS1R	58	35
CN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](CO)Cc1ccccc1	ZINC000853792027	GH	On-Demand	Anodyne	MAPT	16	49
CS(=O)(=O)c1ccc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)cc1	ZINC000853792028	GD	On-Demand	Clean	GHSR	23	44
Cc1ccc(N2CCC[C@@H](NC(=O)NCc3cccnc3N3CCCC3)C2)cc1	ZINC000853792030	GG	On-Demand	Anodyne	SCN2A	18	43
Cc1ccc(N2CCC[C@@H](NC(=O)NCc3cccnc3N3CCCC3)C2)cc1	ZINC000853792030	GG	On-Demand	Anodyne	EPHX2	17	40
Cc1ccc(N2CCC[C@@H](NC(=O)NCc3cccnc3N3CCCC3)C2)cc1	ZINC000853792030	GG	On-Demand	Anodyne	SCN10A	19	43
O=S1(=O)CCN(c2ccc(CNc3ccccn3)cc2)CC1	ZINC000853792032	DD	On-Demand	Clean	CXCR4	15	59
CO[C@]1(CO)CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792035	FF	On-Demand	Anodyne	HTR1D	60	38
CO[C@]1(CO)CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792035	FF	On-Demand	Anodyne	HTR1B	44	39
CO[C@]1(CO)CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792035	FF	On-Demand	Anodyne	MPO	42	34
CO[C@]1(CO)CCCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792035	FF	On-Demand	Anodyne	EPHX2	15	45
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](C)COC	ZINC000853792043	EH	On-Demand	Mild	HTR1D	28	41
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](C)COC	ZINC000853792043	EH	On-Demand	Mild	MPO	65	39
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](C)COC	ZINC000853792043	EH	On-Demand	Mild	HTR1E	15	41
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@H](C)COC	ZINC000853792043	EH	On-Demand	Mild	MAPT	15	45
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](C)COC	ZINC000853792045	EH	On-Demand	Mild	HTR1D	28	41
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](C)COC	ZINC000853792045	EH	On-Demand	Mild	MPO	65	39
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](C)COC	ZINC000853792045	EH	On-Demand	Mild	HTR1E	15	41
C=CCN(C(=O)NCCc1c[nH]c2ccc(Cl)cc12)[C@@H](C)COC	ZINC000853792045	EH	On-Demand	Mild	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853792073	FF	On-Demand	Anodyne	HTR1D	73	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853792073	FF	On-Demand	Anodyne	HTR1B	57	38
CN(C)c1ccc(N2CCC(NC(=O)N[C@H]3C[C@H](O)C3)CC2)cc1	ZINC000853792074	ED	On-Demand	Anodyne	EPHX2	35	52
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](Cn2ccnn2)C1	ZINC000853792075	FF	On-Demand	Anodyne	HTR1D	73	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H](Cn2ccnn2)C1	ZINC000853792075	FF	On-Demand	Anodyne	HTR1B	57	38
O=S1(=O)CCN(c2ccc(CNc3nccc(CO)n3)cc2)CC1	ZINC000853792095	EC	On-Demand	Clean	EPHB4	46	32
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCn2c(O)nnc2C1	ZINC000853792096	FD	On-Demand	Anodyne	HTR1D	47	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCn2c(O)nnc2C1	ZINC000853792096	FD	On-Demand	Anodyne	HTR1B	32	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCn2c(O)nnc2C1	ZINC000853792096	FD	On-Demand	Anodyne	MPO	40	33
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCn2c(O)nnc2C1	ZINC000853792096	FD	On-Demand	Anodyne	MAPT	15	42
COc1cc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)ccc1[N+](=O)[O-]	ZINC000853792097	GE	On-Demand	Clean	DRTS_TRYCR	46	34
Cn1c(S)nnc1CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000853792145	FD	On-Demand	Bother	COLA	103	35
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000853792159	JG	On-Demand	Anodyne	PPARG	43	40
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000853792159	JG	On-Demand	Anodyne	PPARA	40	40
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000853792159	JG	On-Demand	Anodyne	LPL	46	37
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000853792159	JG	On-Demand	Anodyne	PDE8B	61	35
CON(C)CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000853792167	CC	On-Demand	Bother	COLA	124	41
CON(C)CCNC(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000853792167	CC	On-Demand	Bother	MTNR1A	32	45
COc1cccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853792168	FF	On-Demand	Anodyne	MTNR1A	47	57
COc1cccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853792168	FF	On-Demand	Anodyne	MTNR1B	42	57
COc1cccc(O[C@H](C)CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853792169	FF	On-Demand	Anodyne	MTNR1A	47	57
COc1cccc(O[C@H](C)CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853792169	FF	On-Demand	Anodyne	MTNR1B	42	57
COc1cccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853792170	FF	On-Demand	Anodyne	MTNR1A	47	57
COc1cccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853792170	FF	On-Demand	Anodyne	MTNR1B	42	57
COc1cccc(O[C@H](C)CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853792171	FF	On-Demand	Anodyne	MTNR1A	47	57
COc1cccc(O[C@H](C)CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853792171	FF	On-Demand	Anodyne	MTNR1B	42	57
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000853792203	GE	On-Demand	Mild	DRD4	40	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000853792203	GE	On-Demand	Mild	MTNR1A	28	56
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000853792203	GE	On-Demand	Mild	MTNR1B	28	56
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000853792204	GE	On-Demand	Mild	DRD4	40	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000853792204	GE	On-Demand	Mild	MTNR1A	28	56
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000853792204	GE	On-Demand	Mild	MTNR1B	28	56
C#CCCN(CCOC)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000853792207	EE	On-Demand	Mild	DRD4	40	31
C#CCCN(CCOC)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000853792207	EE	On-Demand	Mild	MTNR1A	31	55
C#CCCN(CCOC)C(=O)NC[C@H](C)Oc1cccc(OC)c1	ZINC000853792207	EE	On-Demand	Mild	MTNR1B	30	55
C#CCCN(CCOC)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000853792208	EE	On-Demand	Mild	DRD4	40	31
C#CCCN(CCOC)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000853792208	EE	On-Demand	Mild	MTNR1A	31	55
C#CCCN(CCOC)C(=O)NC[C@@H](C)Oc1cccc(OC)c1	ZINC000853792208	EE	On-Demand	Mild	MTNR1B	30	55
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853792210	IJ	On-Demand	Anodyne	PDE8B	48	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)OC(=O)c1nc(-c2ccccc2)oc1C	ZINC000853792211	IJ	On-Demand	Anodyne	PDE8B	48	33
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853792252	FF	On-Demand	Anodyne	HTR1D	15	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853792252	FF	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853792253	FF	On-Demand	Anodyne	HTR1D	15	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853792253	FF	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853792256	FH	On-Demand	Anodyne	HTR1D	50	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853792256	FH	On-Demand	Anodyne	HTR1B	40	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853792256	FH	On-Demand	Anodyne	MPO	48	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853792256	FH	On-Demand	Anodyne	MAPT	17	49
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853792257	FH	On-Demand	Anodyne	HTR1D	50	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853792257	FH	On-Demand	Anodyne	HTR1B	40	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853792257	FH	On-Demand	Anodyne	MPO	48	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853792257	FH	On-Demand	Anodyne	MAPT	17	49
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853792258	FH	On-Demand	Anodyne	HTR1D	50	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853792258	FH	On-Demand	Anodyne	HTR1B	40	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853792258	FH	On-Demand	Anodyne	MPO	48	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853792258	FH	On-Demand	Anodyne	MAPT	17	49
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853792259	FH	On-Demand	Anodyne	HTR1D	50	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853792259	FH	On-Demand	Anodyne	HTR1B	40	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853792259	FH	On-Demand	Anodyne	MPO	48	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853792259	FH	On-Demand	Anodyne	MAPT	17	49
CNS(=O)(=O)c1ccc(CSCC(=O)NC2CCCCCCC2)cc1	ZINC000853792260	GG	On-Demand	Anodyne	EPHX2	26	42
CC(C)(CO)[C@H](NC(=O)NCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000853792298	FG	On-Demand	Anodyne	HTR1D	39	41
CC(C)(CO)[C@H](NC(=O)NCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000853792298	FG	On-Demand	Anodyne	HTR1B	32	41
CC(C)(CO)[C@H](NC(=O)NCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000853792298	FG	On-Demand	Anodyne	MPO	44	35
CC(C)(CO)[C@H](NC(=O)NCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000853792298	FG	On-Demand	Anodyne	BRS3	25	42
CC(C)(CO)[C@H](NC(=O)NCCc1c[nH]c2ccc(Cl)cc12)C1CC1	ZINC000853792298	FG	On-Demand	Anodyne	MAPT	16	47
Cc1ccc(N2CCC[C@@H](NC(=O)N3CCC[C@H](C(=O)NC(C)C)C3)C2)cc1	ZINC000853792323	GF	On-Demand	Anodyne	EPHX2	17	42
Cc1ccc(N2CCC[C@@H](NC(=O)N3CCC[C@@H](C(=O)NC(C)C)C3)C2)cc1	ZINC000853792324	GF	On-Demand	Anodyne	EPHX2	17	42
N#C[C@@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792334	EH	On-Demand	Mild	HTR1D	29	40
N#C[C@@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792334	EH	On-Demand	Mild	HTR1B	22	40
N#C[C@@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792334	EH	On-Demand	Mild	MPO	45	33
N#C[C@@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792334	EH	On-Demand	Mild	MAPT	17	49
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792335	EH	On-Demand	Mild	HTR1D	29	40
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792335	EH	On-Demand	Mild	HTR1B	22	40
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792335	EH	On-Demand	Mild	MPO	45	33
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792335	EH	On-Demand	Mild	MAPT	17	49
N#C[C@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792336	EH	On-Demand	Mild	HTR1D	29	40
N#C[C@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792336	EH	On-Demand	Mild	HTR1B	22	40
N#C[C@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792336	EH	On-Demand	Mild	MPO	45	33
N#C[C@H]1CCCC[C@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792336	EH	On-Demand	Mild	MAPT	17	49
N#C[C@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792337	EH	On-Demand	Mild	HTR1D	29	40
N#C[C@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792337	EH	On-Demand	Mild	HTR1B	22	40
N#C[C@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792337	EH	On-Demand	Mild	MPO	45	33
N#C[C@H]1CCCC[C@@H]1NC(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792337	EH	On-Demand	Mild	MAPT	17	49
NC(=O)c1ccc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nn1	ZINC000853792338	FC	On-Demand	Clean	STAT6	66	39
COCc1n[nH]c(CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)n1	ZINC000853792343	FE	On-Demand	Anodyne	HTR1D	26	42
COCc1n[nH]c(CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)n1	ZINC000853792343	FE	On-Demand	Anodyne	MAPT	15	43
O=S1(=O)CCN(c2ccc(CNc3nc4ccccc4cc3CO)cc2)CC1	ZINC000853792353	GF	On-Demand	Clean	STAT6	47	36
C[C@H]1CC[C@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CS1(=O)=O	ZINC000853792360	GF	On-Demand	Anodyne	MPO	48	34
C[C@H]1CC[C@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CS1(=O)=O	ZINC000853792360	GF	On-Demand	Anodyne	MAPT	15	45
C[C@@H]1CC[C@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CS1(=O)=O	ZINC000853792361	GF	On-Demand	Anodyne	MPO	48	34
C[C@@H]1CC[C@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CS1(=O)=O	ZINC000853792361	GF	On-Demand	Anodyne	MAPT	15	45
C[C@H]1CC[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CS1(=O)=O	ZINC000853792362	GF	On-Demand	Anodyne	MPO	48	34
C[C@H]1CC[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CS1(=O)=O	ZINC000853792362	GF	On-Demand	Anodyne	MAPT	15	45
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853792370	GE	On-Demand	Anodyne	MTNR1A	61	52
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853792370	GE	On-Demand	Anodyne	MTNR1B	56	52
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853792371	GE	On-Demand	Anodyne	MTNR1A	61	52
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853792371	GE	On-Demand	Anodyne	MTNR1B	56	52
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000853792378	JF	On-Demand	Anodyne	PPARG	51	42
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000853792378	JF	On-Demand	Anodyne	PPARA	52	37
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000853792378	JF	On-Demand	Anodyne	PDE8B	59	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000853792433	GE	On-Demand	Bother	COLA	73	32
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCc2ccccc2[N+](=O)[O-])C1	ZINC000853792434	GE	On-Demand	Bother	COLA	73	32
C#CCCN(CCOC)C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000853792471	DD	On-Demand	Mild	COLA	112	35
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853792476	GE	On-Demand	Anodyne	MTNR1A	58	52
COc1cccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853792476	GE	On-Demand	Anodyne	MTNR1B	49	52
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853792477	GE	On-Demand	Anodyne	MTNR1A	58	52
COc1cccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853792477	GE	On-Demand	Anodyne	MTNR1B	49	52
Cc1ccc(N2CCC[C@@H](NC(=O)NC[C@@H]3CCCN(CC4CC4)C3)C2=O)cc1	ZINC000853792491	GF	On-Demand	Anodyne	CCR3	46	38
Cc1ccc(N2CCC[C@@H](NC(=O)NC[C@H]3CCCN(CC4CC4)C3)C2=O)cc1	ZINC000853792492	GF	On-Demand	Anodyne	CCR3	46	38
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCCc1cnn(-c2ccccc2)c1	ZINC000853792495	IG	On-Demand	Anodyne	PPARG	47	42
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCCc1cnn(-c2ccccc2)c1	ZINC000853792495	IG	On-Demand	Anodyne	PPARA	47	42
Cc1oc(-c2ccccc2)nc1C(=O)OCC(=O)NCCc1cnn(-c2ccccc2)c1	ZINC000853792495	IG	On-Demand	Anodyne	PDE8B	55	31
CN1CCC(CNC(=O)N2CC[C@H](N3CCOC3=O)C2)(N2CCCCC2)CC1	ZINC000853792550	GD	On-Demand	Anodyne	SMO	15	42
CN1CCC(CNC(=O)N2CC[C@H](N3CCOC3=O)C2)(N2CCCCC2)CC1	ZINC000853792550	GD	On-Demand	Anodyne	HCN1	53	35
CN1CCC(CNC(=O)N2CC[C@H](N3CCOC3=O)C2)(N2CCCCC2)CC1	ZINC000853792550	GD	On-Demand	Anodyne	HCN4	42	34
CN1CCC(CNC(=O)N2CC[C@@H](N3CCOC3=O)C2)(N2CCCCC2)CC1	ZINC000853792551	GD	On-Demand	Anodyne	SMO	15	42
CN1CCC(CNC(=O)N2CC[C@@H](N3CCOC3=O)C2)(N2CCCCC2)CC1	ZINC000853792551	GD	On-Demand	Anodyne	HCN1	53	35
CN1CCC(CNC(=O)N2CC[C@@H](N3CCOC3=O)C2)(N2CCCCC2)CC1	ZINC000853792551	GD	On-Demand	Anodyne	HCN4	42	34
COCCN(CCF)C(=O)NCC1(N2CCCCC2)CCN(C)CC1	ZINC000853792559	FD	On-Demand	Anodyne	HCN1	63	40
COCCN(CCF)C(=O)NCC1(N2CCCCC2)CCN(C)CC1	ZINC000853792559	FD	On-Demand	Anodyne	HCN4	48	32
c1ccc2c(CCNc3ncnc4c3CCC4)ccnc2c1	ZINC000853792577	CG	On-Demand	Anodyne	ACHE	33	43
c1ccc2c(CCNc3ncnc4c3CCC4)ccnc2c1	ZINC000853792577	CG	On-Demand	Anodyne	BCHE	40	43
c1ccc2c(CCNc3ncnc4c3CCC4)ccnc2c1	ZINC000853792577	CG	On-Demand	Anodyne	HNMT	74	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	DRD4	43	49
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	ACHE	22	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	PPARG	49	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	PPARA	49	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	CHRM3	15	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	SIGMAR1	28	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	SSTR5	46	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	CCR3	26	41
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	PDK1	40	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	MCHR1	30	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	PDE8B	68	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792596	IH	On-Demand	Anodyne	BIRC2	32	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	DRD4	43	49
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	ACHE	22	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	PPARG	49	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	PPARA	49	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	CHRM3	15	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	SIGMAR1	28	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	SSTR5	46	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	CCR3	26	41
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	PDK1	40	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	MCHR1	30	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	PDE8B	68	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792597	IH	On-Demand	Anodyne	BIRC2	32	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	DRD4	43	49
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	ACHE	22	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	PPARG	49	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	PPARA	49	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	CHRM3	15	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	SIGMAR1	28	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	SSTR5	46	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	CCR3	26	41
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	PDK1	40	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	MCHR1	30	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	PDE8B	68	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853792598	IH	On-Demand	Anodyne	BIRC2	32	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	DRD4	43	49
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	ACHE	22	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	PPARG	49	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	PPARA	49	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	CHRM3	15	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	SIGMAR1	28	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	SSTR5	46	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	CCR3	26	41
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	PDK1	40	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	MCHR1	30	44
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	PDE8B	68	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853792599	IH	On-Demand	Anodyne	BIRC2	32	42
CO[C@@H](CSCC(=O)Nc1ccc2ccccc2c1)C1CCC1	ZINC000853792603	EI	On-Demand	Anodyne	ENPP1	74	37
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853792616	IH	On-Demand	Anodyne	PPARG	46	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853792616	IH	On-Demand	Anodyne	PPARA	45	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853792616	IH	On-Demand	Anodyne	DGAT1	18	45
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853792617	IH	On-Demand	Anodyne	PPARG	46	38
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853792617	IH	On-Demand	Anodyne	PPARA	45	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853792617	IH	On-Demand	Anodyne	DGAT1	18	45
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000853792640	JI	On-Demand	Anodyne	PDE8B	51	32
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)Nc1ccccc1C(=O)NCc1ccco1	ZINC000853792641	JI	On-Demand	Anodyne	PDE8B	51	32
CO[C@@H](CSCC(=O)Nc1ccc(N2CCOCC2)cc1)C1CCC1	ZINC000853792647	FG	On-Demand	Anodyne	MTOR	60	36
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000853792652	JG	On-Demand	Anodyne	PPARG	48	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000853792652	JG	On-Demand	Anodyne	PPARA	48	37
Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000853792652	JG	On-Demand	Anodyne	PDE8B	67	40
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000853792653	JG	On-Demand	Anodyne	PPARG	48	42
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000853792653	JG	On-Demand	Anodyne	PPARA	48	37
Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C)C(=O)NCc1ccc(CN2CCOCC2)cc1	ZINC000853792653	JG	On-Demand	Anodyne	PDE8B	67	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC2(COC2)C1	ZINC000853792697	EF	On-Demand	Anodyne	HTR1D	47	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC2(COC2)C1	ZINC000853792697	EF	On-Demand	Anodyne	MPO	51	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC2(COC2)C1	ZINC000853792697	EF	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1CCC(O)CC1	ZINC000853792702	EG	On-Demand	Anodyne	HTR1A	18	48
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1CCC(O)CC1	ZINC000853792702	EG	On-Demand	Anodyne	HTR1D	77	48
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1CCC(O)CC1	ZINC000853792702	EG	On-Demand	Anodyne	HTR1B	62	48
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1CCC(O)CC1	ZINC000853792702	EG	On-Demand	Anodyne	MPO	67	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1CCC(O)CC1	ZINC000853792702	EG	On-Demand	Anodyne	MTNR1A	17	55
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1CCC(O)CC1	ZINC000853792702	EG	On-Demand	Anodyne	MAPT	16	47
O=C(CSCC1C[C@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792710	EG	On-Demand	Anodyne	MTOR	61	36
O=C(CSCC1C[C@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792710	EG	On-Demand	Anodyne	EPHX2	15	47
O=C(CSCC1C[C@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792710	EG	On-Demand	Anodyne	STAT6	52	32
O=C(CSCC1C[C@@H]2C[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792711	EG	On-Demand	Anodyne	MTOR	61	36
O=C(CSCC1C[C@@H]2C[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792711	EG	On-Demand	Anodyne	EPHX2	15	47
O=C(CSCC1C[C@@H]2C[C@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792711	EG	On-Demand	Anodyne	STAT6	52	32
O=C(CSC[C@H]1C[C@@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792712	EG	On-Demand	Anodyne	MTOR	61	36
O=C(CSC[C@H]1C[C@@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792712	EG	On-Demand	Anodyne	EPHX2	15	47
O=C(CSC[C@H]1C[C@@H]2C[C@@H]2C1)Nc1ccc(N2CCOCC2)cc1	ZINC000853792712	EG	On-Demand	Anodyne	STAT6	52	32
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792730	EI	On-Demand	Mild	HTR1D	55	38
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792730	EI	On-Demand	Mild	HTR1B	44	38
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792730	EI	On-Demand	Mild	MPO	54	35
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792730	EI	On-Demand	Mild	MAPT	16	46
CO[C@]1(CO)CCCN(C(=O)NCc2c(C)cccc2F)C1	ZINC000853792743	DD	On-Demand	Anodyne	EPHX2	15	40
CC(C)(C)N1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853792744	GG	On-Demand	Anodyne	HTR1D	49	41
CC(C)(C)N1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853792744	GG	On-Demand	Anodyne	HTR1B	41	41
CC(C)(C)N1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853792744	GG	On-Demand	Anodyne	MAPT	15	42
CC(C)(C)N1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853792745	GG	On-Demand	Anodyne	HTR1D	49	41
CC(C)(C)N1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853792745	GG	On-Demand	Anodyne	HTR1B	41	41
CC(C)(C)N1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853792745	GG	On-Demand	Anodyne	MAPT	15	42
CN1[C@H]2CCC[C@H]1CC(NC(=O)NNc1ccc([N+](=O)[O-])cc1F)C2	ZINC000853792750	FE	On-Demand	Reactive	HTR3A	31	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1CCc2ccc(O)cc21	ZINC000853792755	FI	On-Demand	Anodyne	HTR1D	23	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1CCc2ccc(O)cc21	ZINC000853792755	FI	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1CCc2ccc(O)cc21	ZINC000853792756	FI	On-Demand	Anodyne	HTR1D	23	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1CCc2ccc(O)cc21	ZINC000853792756	FI	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCc2nccnc2C1	ZINC000853792766	FF	On-Demand	Anodyne	HTR1A	17	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCc2nccnc2C1	ZINC000853792766	FF	On-Demand	Anodyne	HTR1D	88	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCc2nccnc2C1	ZINC000853792766	FF	On-Demand	Anodyne	HTR1B	66	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCc2nccnc2C1	ZINC000853792766	FF	On-Demand	Anodyne	MPO	53	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCc2nccnc2C1	ZINC000853792766	FF	On-Demand	Anodyne	MAPT	15	45
COc1c(C)ncnc1NCc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000853792772	FD	On-Demand	Clean	PDE5A	17	41
COc1c(C)ncnc1NCc1ccc(N2CCS(=O)(=O)CC2)cc1	ZINC000853792772	FD	On-Demand	Clean	PDE6A	44	33
CN1[C@H]2CCC[C@H]1CC(NC(=O)NNc1nc3ccc(Cl)cc3s1)C2	ZINC000853792791	GH	On-Demand	Reactive	HTR3A	33	45
CN1[C@H]2CCC[C@H]1CC(NC(=O)NCCc1nnc(S)n1C)C2	ZINC000853792799	EC	On-Demand	Anodyne	HTR3A	33	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(CO)(CO)C1	ZINC000853792801	FD	On-Demand	Anodyne	HTR1D	70	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(CO)(CO)C1	ZINC000853792801	FD	On-Demand	Anodyne	HTR1B	52	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(CO)(CO)C1	ZINC000853792801	FD	On-Demand	Anodyne	MPO	55	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(CO)(CO)C1	ZINC000853792801	FD	On-Demand	Anodyne	MAPT	16	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@@H]2C1	ZINC000853792809	EG	On-Demand	Anodyne	HTR1A	19	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@@H]2C1	ZINC000853792809	EG	On-Demand	Anodyne	HTR1D	92	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@@H]2C1	ZINC000853792809	EG	On-Demand	Anodyne	HTR1B	73	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@@H]2C1	ZINC000853792809	EG	On-Demand	Anodyne	SLC6A4	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@@H]2C1	ZINC000853792809	EG	On-Demand	Anodyne	MPO	54	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@@H]2C1	ZINC000853792809	EG	On-Demand	Anodyne	MAPT	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853792810	EG	On-Demand	Anodyne	HTR1A	19	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853792810	EG	On-Demand	Anodyne	HTR1D	92	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853792810	EG	On-Demand	Anodyne	HTR1B	73	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853792810	EG	On-Demand	Anodyne	SLC6A4	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853792810	EG	On-Demand	Anodyne	MPO	54	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853792810	EG	On-Demand	Anodyne	MAPT	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@H]2C1	ZINC000853792811	EG	On-Demand	Anodyne	HTR1A	19	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@H]2C1	ZINC000853792811	EG	On-Demand	Anodyne	HTR1D	92	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@H]2C1	ZINC000853792811	EG	On-Demand	Anodyne	HTR1B	73	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@H]2C1	ZINC000853792811	EG	On-Demand	Anodyne	SLC6A4	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@H]2C1	ZINC000853792811	EG	On-Demand	Anodyne	MPO	54	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2COC[C@H]2C1	ZINC000853792811	EG	On-Demand	Anodyne	MAPT	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@H]2C1	ZINC000853792812	EG	On-Demand	Anodyne	HTR1A	19	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@H]2C1	ZINC000853792812	EG	On-Demand	Anodyne	HTR1D	92	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@H]2C1	ZINC000853792812	EG	On-Demand	Anodyne	HTR1B	73	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@H]2C1	ZINC000853792812	EG	On-Demand	Anodyne	SLC6A4	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@H]2C1	ZINC000853792812	EG	On-Demand	Anodyne	MPO	54	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2COC[C@H]2C1	ZINC000853792812	EG	On-Demand	Anodyne	MAPT	15	44
O=S1(=O)CCN(c2ccc(CNc3ncc(C(F)F)cn3)cc2)CC1	ZINC000853792813	FE	On-Demand	Clean	STAT6	58	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853792852	EH	On-Demand	Anodyne	HTR1A	18	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853792852	EH	On-Demand	Anodyne	HTR1D	85	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853792852	EH	On-Demand	Anodyne	HTR1B	66	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853792852	EH	On-Demand	Anodyne	SLC6A4	15	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853792852	EH	On-Demand	Anodyne	MPO	69	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853792852	EH	On-Demand	Anodyne	CCKBR	15	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853792852	EH	On-Demand	Anodyne	MAPT	16	46
CN(CC(=O)N1CCCC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792871	FF	On-Demand	Anodyne	HTR1A	19	42
CN(CC(=O)N1CCCC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792871	FF	On-Demand	Anodyne	HTR1D	99	42
CN(CC(=O)N1CCCC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792871	FF	On-Demand	Anodyne	HTR1B	70	42
CN(CC(=O)N1CCCC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792871	FF	On-Demand	Anodyne	MPO	82	39
CN(CC(=O)N1CCCC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792871	FF	On-Demand	Anodyne	MAPT	15	45
Cc1cc(CO)cc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1	ZINC000853792882	FD	On-Demand	Clean	NPY1R	18	42
O=S1(=O)CCN(c2ccc(CNc3ccnc4cc(F)cnc34)cc2)CC1	ZINC000853792894	GF	On-Demand	Clean	STAT6	51	33
O=S1(=O)CCN(c2ccc(CNc3ncc4c(n3)CCCC4)cc2)CC1	ZINC000853792920	FE	On-Demand	Clean	STAT6	43	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853792923	GI	On-Demand	Anodyne	HTR1D	65	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853792923	GI	On-Demand	Anodyne	HTR1B	50	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853792923	GI	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC([C@H]2CCCCO2)CC1	ZINC000853792924	GI	On-Demand	Anodyne	HTR1D	65	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC([C@H]2CCCCO2)CC1	ZINC000853792924	GI	On-Demand	Anodyne	HTR1B	50	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC([C@H]2CCCCO2)CC1	ZINC000853792924	GI	On-Demand	Anodyne	MAPT	15	43
CCOc1cc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)c(F)cn1	ZINC000853792935	GE	On-Demand	Clean	STAT6	46	32
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853792946	EF	On-Demand	Anodyne	HTR1D	26	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853792946	EF	On-Demand	Anodyne	HTR1B	18	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853792946	EF	On-Demand	Anodyne	MPO	44	35
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853792946	EF	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C12CCC2	ZINC000853792947	EF	On-Demand	Anodyne	HTR1D	26	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C12CCC2	ZINC000853792947	EF	On-Demand	Anodyne	HTR1B	18	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C12CCC2	ZINC000853792947	EF	On-Demand	Anodyne	MPO	44	35
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C12CCC2	ZINC000853792947	EF	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853792948	EF	On-Demand	Anodyne	HTR1D	26	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853792948	EF	On-Demand	Anodyne	HTR1B	18	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853792948	EF	On-Demand	Anodyne	MPO	44	35
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853792948	EF	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853792949	EF	On-Demand	Anodyne	HTR1D	26	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853792949	EF	On-Demand	Anodyne	HTR1B	18	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853792949	EF	On-Demand	Anodyne	MPO	44	35
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853792949	EF	On-Demand	Anodyne	MAPT	15	45
COC[C@@H](NC(=O)NCc1c(C)cccc1F)c1cccc(OC)c1	ZINC000853792954	EG	On-Demand	Anodyne	GNRHR	22	41
COC[C@H](NC(=O)NCc1c(C)cccc1F)c1cccc(OC)c1	ZINC000853792955	EG	On-Demand	Anodyne	GNRHR	22	41
O=C1CCCN1C[C@@H]1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792966	GG	On-Demand	Anodyne	HTR1D	64	39
O=C1CCCN1C[C@@H]1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792966	GG	On-Demand	Anodyne	HTR1B	50	39
O=C1CCCN1C[C@H]1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792967	GG	On-Demand	Anodyne	HTR1D	64	39
O=C1CCCN1C[C@H]1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853792967	GG	On-Demand	Anodyne	HTR1B	50	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853792968	GH	On-Demand	Anodyne	HTR1D	66	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853792968	GH	On-Demand	Anodyne	HTR1B	53	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853792968	GH	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853792969	GH	On-Demand	Anodyne	HTR1D	66	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853792969	GH	On-Demand	Anodyne	HTR1B	53	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853792969	GH	On-Demand	Anodyne	MAPT	15	43
CN1[C@H]2CCC[C@H]1CC(NC(=O)NNc1cccc3c1OC(F)(F)O3)C2	ZINC000853792976	FF	On-Demand	Reactive	HTR3A	33	41
CN(CC1=CCSC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792992	EH	On-Demand	Anodyne	HTR1D	54	37
CN(CC1=CCSC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792992	EH	On-Demand	Anodyne	MPO	74	38
CN(CC1=CCSC1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853792992	EH	On-Demand	Anodyne	MAPT	15	44
CN1[C@H]2CCC[C@H]1CC(NC(=O)NNc1cc(C#N)ccc1Br)C2	ZINC000853793005	GF	On-Demand	Reactive	HTR3A	30	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853793029	GI	On-Demand	Anodyne	HTR1D	50	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853793029	GI	On-Demand	Anodyne	HTR1B	40	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853793030	GI	On-Demand	Anodyne	HTR1D	50	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853793030	GI	On-Demand	Anodyne	HTR1B	40	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853793031	GI	On-Demand	Anodyne	HTR1D	50	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853793031	GI	On-Demand	Anodyne	HTR1B	40	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853793032	GI	On-Demand	Anodyne	HTR1D	50	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853793032	GI	On-Demand	Anodyne	HTR1B	40	39
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1(O)CCC(F)(F)CC1	ZINC000853793035	GH	On-Demand	Anodyne	HTR1D	34	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1(O)CCC(F)(F)CC1	ZINC000853793035	GH	On-Demand	Anodyne	HTR1B	30	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1(O)CCC(F)(F)CC1	ZINC000853793035	GH	On-Demand	Anodyne	MPO	77	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC1(O)CCC(F)(F)CC1	ZINC000853793035	GH	On-Demand	Anodyne	MAPT	17	48
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853793042	EG	On-Demand	Mild	HTR1D	33	41
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853793042	EG	On-Demand	Mild	MPO	72	37
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853793042	EG	On-Demand	Mild	MAPT	16	47
CN1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793043	EE	On-Demand	Anodyne	HTR1A	19	45
CN1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793043	EE	On-Demand	Anodyne	HTR1D	73	42
CN1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793043	EE	On-Demand	Anodyne	HTR1B	59	44
CN1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793043	EE	On-Demand	Anodyne	SLC6A4	15	45
CN1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793043	EE	On-Demand	Anodyne	MPO	54	35
CN1C[C@@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793043	EE	On-Demand	Anodyne	MAPT	15	43
CN1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793044	EE	On-Demand	Anodyne	HTR1A	19	45
CN1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793044	EE	On-Demand	Anodyne	HTR1D	73	42
CN1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793044	EE	On-Demand	Anodyne	HTR1B	59	44
CN1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793044	EE	On-Demand	Anodyne	SLC6A4	15	45
CN1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793044	EE	On-Demand	Anodyne	MPO	54	35
CN1C[C@H](CNC(=O)NCCc2c[nH]c3ccc(Cl)cc23)CC1=O	ZINC000853793044	EE	On-Demand	Anodyne	MAPT	15	43
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793053	FF	On-Demand	Anodyne	HTR1A	20	41
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793053	FF	On-Demand	Anodyne	HTR1D	64	39
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793053	FF	On-Demand	Anodyne	HTR1B	49	40
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793053	FF	On-Demand	Anodyne	SLC6A4	18	45
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793053	FF	On-Demand	Anodyne	MPO	83	39
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793053	FF	On-Demand	Anodyne	MTNR1A	17	47
COC(=O)[C@@H]1C[C@H](N(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793053	FF	On-Demand	Anodyne	MAPT	15	45
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2c(C)cccc2F)cc1	ZINC000853793067	GF	On-Demand	Anodyne	ADRB2	35	51
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2c(C)cccc2F)cc1	ZINC000853793067	GF	On-Demand	Anodyne	ADRB1	67	51
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2c(C)cccc2F)cc1	ZINC000853793067	GF	On-Demand	Anodyne	ADRB3	39	43
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2c(C)cccc2F)cc1	ZINC000853793068	GF	On-Demand	Anodyne	ADRB2	35	51
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2c(C)cccc2F)cc1	ZINC000853793068	GF	On-Demand	Anodyne	ADRB1	67	51
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2c(C)cccc2F)cc1	ZINC000853793068	GF	On-Demand	Anodyne	ADRB3	39	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	HTR1A	17	44
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	HTR1D	58	44
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	HTR1B	47	44
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	NQO2	26	48
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	MPO	66	37
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	MTNR1A	33	54
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	MTNR1B	20	51
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793070	EF	On-Demand	Anodyne	MAPT	15	45
CN(Cc1cn(C)nn1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853793079	EE	On-Demand	Anodyne	HTR1D	56	36
CN(Cc1cn(C)nn1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853793079	EE	On-Demand	Anodyne	MPO	69	36
CN(Cc1cn(C)nn1)C(=O)NCCc1c[nH]c2ccc(Cl)cc12	ZINC000853793079	EE	On-Demand	Anodyne	MAPT	15	42
CN(C)CCC[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000853793083	GG	On-Demand	Anodyne	HTR1A	17	40
CN(C)CCC[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000853793083	GG	On-Demand	Anodyne	HTR1D	85	40
CN(C)CCC[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000853793083	GG	On-Demand	Anodyne	HTR1B	61	37
CN(C)CCC[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000853793083	GG	On-Demand	Anodyne	MPO	47	38
CN(C)CCC[C@@H]1CN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCO1	ZINC000853793083	GG	On-Demand	Anodyne	HTR5A	20	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCO[C@H](CC(F)(F)F)C1	ZINC000853793111	GH	On-Demand	Anodyne	HTR1A	17	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCO[C@H](CC(F)(F)F)C1	ZINC000853793111	GH	On-Demand	Anodyne	HTR1D	51	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCO[C@H](CC(F)(F)F)C1	ZINC000853793111	GH	On-Demand	Anodyne	MPO	50	34
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCO[C@@H](CC(F)(F)F)C1	ZINC000853793112	GH	On-Demand	Anodyne	HTR1A	17	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCO[C@@H](CC(F)(F)F)C1	ZINC000853793112	GH	On-Demand	Anodyne	HTR1D	51	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCO[C@@H](CC(F)(F)F)C1	ZINC000853793112	GH	On-Demand	Anodyne	MPO	50	34
CN1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCC1=O	ZINC000853793117	EE	On-Demand	Anodyne	HTR1A	17	41
CN1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCC1=O	ZINC000853793117	EE	On-Demand	Anodyne	HTR1D	93	42
CN1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCC1=O	ZINC000853793117	EE	On-Demand	Anodyne	HTR1B	73	42
CN1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCC1=O	ZINC000853793117	EE	On-Demand	Anodyne	MPO	60	39
CN1CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)CCC1=O	ZINC000853793117	EE	On-Demand	Anodyne	MAPT	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@H]2C1	ZINC000853793118	DG	On-Demand	Anodyne	HTR1A	20	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@H]2C1	ZINC000853793118	DG	On-Demand	Anodyne	HTR1D	104	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@H]2C1	ZINC000853793118	DG	On-Demand	Anodyne	HTR1B	83	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@H]2C1	ZINC000853793118	DG	On-Demand	Anodyne	SLC6A4	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@H]2C1	ZINC000853793118	DG	On-Demand	Anodyne	MPO	61	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@H]2C1	ZINC000853793118	DG	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@@H]2C1	ZINC000853793119	DG	On-Demand	Anodyne	HTR1A	20	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@@H]2C1	ZINC000853793119	DG	On-Demand	Anodyne	HTR1D	104	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@@H]2C1	ZINC000853793119	DG	On-Demand	Anodyne	HTR1B	83	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@@H]2C1	ZINC000853793119	DG	On-Demand	Anodyne	SLC6A4	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@@H]2C1	ZINC000853793119	DG	On-Demand	Anodyne	MPO	61	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@@H]2C1	ZINC000853793119	DG	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@@H]2C1	ZINC000853793120	DG	On-Demand	Anodyne	HTR1A	20	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@@H]2C1	ZINC000853793120	DG	On-Demand	Anodyne	HTR1D	104	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@@H]2C1	ZINC000853793120	DG	On-Demand	Anodyne	HTR1B	83	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@@H]2C1	ZINC000853793120	DG	On-Demand	Anodyne	SLC6A4	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@@H]2C1	ZINC000853793120	DG	On-Demand	Anodyne	MPO	61	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@H]2C[C@@H]2C1	ZINC000853793120	DG	On-Demand	Anodyne	MAPT	15	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@H]2C1	ZINC000853793121	DG	On-Demand	Anodyne	HTR1A	20	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@H]2C1	ZINC000853793121	DG	On-Demand	Anodyne	HTR1D	104	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@H]2C1	ZINC000853793121	DG	On-Demand	Anodyne	HTR1B	83	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@H]2C1	ZINC000853793121	DG	On-Demand	Anodyne	SLC6A4	15	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@H]2C1	ZINC000853793121	DG	On-Demand	Anodyne	MPO	61	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CC[C@@H]2C[C@H]2C1	ZINC000853793121	DG	On-Demand	Anodyne	MAPT	15	45
CON(C)CCNC(=O)NC1C[C@@H]2CCC[C@H](C1)N2C	ZINC000853793128	CC	On-Demand	Anodyne	HTR3A	33	41
CNc1nc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)nc2ccccc12	ZINC000853793130	GF	On-Demand	Clean	STAT6	49	40
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@H]1C[C@@H](O)c3ccccc31)C2	ZINC000853793131	EE	On-Demand	Anodyne	HTR3A	39	48
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@H]1C[C@@H](O)c3ccccc31)C2	ZINC000853793131	EE	On-Demand	Anodyne	HTR4	25	47
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@H]1C[C@@H](O)c3ccccc31)C2	ZINC000853793131	EE	On-Demand	Anodyne	GLRA1	44	36
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@@H]1C[C@@H](O)c3ccccc31)C2	ZINC000853793132	EE	On-Demand	Anodyne	HTR3A	39	48
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@@H]1C[C@@H](O)c3ccccc31)C2	ZINC000853793132	EE	On-Demand	Anodyne	HTR4	25	47
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@@H]1C[C@@H](O)c3ccccc31)C2	ZINC000853793132	EE	On-Demand	Anodyne	GLRA1	44	36
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@H]1C[C@H](O)c3ccccc31)C2	ZINC000853793133	EE	On-Demand	Anodyne	HTR3A	39	48
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@H]1C[C@H](O)c3ccccc31)C2	ZINC000853793133	EE	On-Demand	Anodyne	HTR4	25	47
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@H]1C[C@H](O)c3ccccc31)C2	ZINC000853793133	EE	On-Demand	Anodyne	GLRA1	44	36
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@@H]1C[C@H](O)c3ccccc31)C2	ZINC000853793134	EE	On-Demand	Anodyne	HTR3A	39	48
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@@H]1C[C@H](O)c3ccccc31)C2	ZINC000853793134	EE	On-Demand	Anodyne	HTR4	25	47
CN1[C@H]2CCC[C@H]1CC(NC(=O)N[C@@H]1C[C@H](O)c3ccccc31)C2	ZINC000853793134	EE	On-Demand	Anodyne	GLRA1	44	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C1	ZINC000853793141	DE	On-Demand	Anodyne	HTR1A	17	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C1	ZINC000853793141	DE	On-Demand	Anodyne	HTR1D	62	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C1	ZINC000853793141	DE	On-Demand	Anodyne	HTR1B	46	44
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C1	ZINC000853793141	DE	On-Demand	Anodyne	MPO	73	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N[C@H]1C[C@H](O)C1	ZINC000853793141	DE	On-Demand	Anodyne	MAPT	16	48
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853793154	GF	On-Demand	Anodyne	HTR1D	80	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853793154	GF	On-Demand	Anodyne	HTR1B	61	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853793154	GF	On-Demand	Anodyne	MAPT	15	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853793155	GF	On-Demand	Anodyne	HTR1D	80	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853793155	GF	On-Demand	Anodyne	HTR1B	61	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853793155	GF	On-Demand	Anodyne	MAPT	15	42
Cc1nnc(CN(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)s1	ZINC000853793172	FG	On-Demand	Anodyne	MPO	64	37
Cc1nnc(CN(C)C(=O)NCCc2c[nH]c3ccc(Cl)cc23)s1	ZINC000853793172	FG	On-Demand	Anodyne	MAPT	16	47
COC(=O)c1cccc(NNC(=O)NC2C[C@@H]3CCC[C@H](C2)N3C)c1C	ZINC000853793175	FE	On-Demand	Reactive	HTR3A	38	47
COC(=O)c1cccc(NNC(=O)NC2C[C@@H]3CCC[C@H](C2)N3C)c1C	ZINC000853793175	FE	On-Demand	Reactive	GLRA1	42	31
CN1[C@H]2CCC[C@H]1CC(NC(=O)NNc1cc(F)cc(Cl)c1)C2	ZINC000853793177	EG	On-Demand	Reactive	HTR3A	30	41
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853793197	FG	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853793198	FG	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCOc2ccc(O)cc2C1	ZINC000853793224	GH	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@H](CO)CC1CC1	ZINC000853793233	EG	On-Demand	Anodyne	HTR1D	47	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@H](CO)CC1CC1	ZINC000853793233	EG	On-Demand	Anodyne	HTR1B	36	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@H](CO)CC1CC1	ZINC000853793233	EG	On-Demand	Anodyne	MPO	43	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@H](CO)CC1CC1	ZINC000853793233	EG	On-Demand	Anodyne	MAPT	15	48
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@H](CO)CC1CC1	ZINC000853793234	EG	On-Demand	Anodyne	HTR1D	47	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@H](CO)CC1CC1	ZINC000853793234	EG	On-Demand	Anodyne	HTR1B	36	42
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@H](CO)CC1CC1	ZINC000853793234	EG	On-Demand	Anodyne	MPO	43	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC[C@@H](CO)CC1CC1	ZINC000853793234	EG	On-Demand	Anodyne	MAPT	15	48
CCN1CC[C@H](N(CC)C(=O)NCc2c(C)cccc2F)C1	ZINC000853793256	DF	On-Demand	Anodyne	CCR5	28	48
CCN1CC[C@@H](N(CC)C(=O)NCc2c(C)cccc2F)C1	ZINC000853793257	DF	On-Demand	Anodyne	CCR5	28	48
C[C@@]1(C#N)CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793280	EG	On-Demand	Mild	HTR1D	48	38
C[C@@]1(C#N)CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793280	EG	On-Demand	Mild	MPO	47	35
C[C@@]1(C#N)CCN(C(=O)NCCc2c[nH]c3ccc(Cl)cc23)C1	ZINC000853793280	EG	On-Demand	Mild	MAPT	17	49
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853793289	GH	On-Demand	Anodyne	MPO	62	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853793289	GH	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853793290	GH	On-Demand	Anodyne	MPO	62	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853793290	GH	On-Demand	Anodyne	MAPT	15	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853793291	GH	On-Demand	Anodyne	MPO	62	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853793291	GH	On-Demand	Anodyne	MAPT	15	43
O=S1(=O)CCN(c2ccc(CNc3cc(CO)c(F)cn3)cc2)CC1	ZINC000853793292	FD	On-Demand	Clean	STAT6	53	32
Cc1ccc2ccnc(NCc3ccc(N4CCS(=O)(=O)CC4)cc3)c2c1	ZINC000853793297	GG	On-Demand	Clean	EPHB4	45	32
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC(O)(C1CC1)C1CC1	ZINC000853793304	FG	On-Demand	Anodyne	HTR1A	16	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC(O)(C1CC1)C1CC1	ZINC000853793304	FG	On-Demand	Anodyne	HTR1D	45	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC(O)(C1CC1)C1CC1	ZINC000853793304	FG	On-Demand	Anodyne	HTR1B	36	45
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC(O)(C1CC1)C1CC1	ZINC000853793304	FG	On-Demand	Anodyne	MPO	68	36
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NCC(O)(C1CC1)C1CC1	ZINC000853793304	FG	On-Demand	Anodyne	MAPT	16	46
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853793311	GF	On-Demand	Anodyne	HTR1D	56	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853793311	GF	On-Demand	Anodyne	HTR1B	42	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(N2CCOC2=O)CC1	ZINC000853793311	GF	On-Demand	Anodyne	MAPT	15	43
O=S1(=O)CCN(c2ccc(CNc3nccc4cc(F)ccc34)cc2)CC1	ZINC000853793318	GG	On-Demand	Clean	STAT6	72	37
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(c2ccon2)CC1	ZINC000853793322	FH	On-Demand	Anodyne	HTR1D	79	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)N1CCC(c2ccon2)CC1	ZINC000853793322	FH	On-Demand	Anodyne	HTR1B	59	40
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC1CC(CO)C1	ZINC000853793374	DE	On-Demand	Anodyne	HTR1D	44	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC1CC(CO)C1	ZINC000853793374	DE	On-Demand	Anodyne	HTR1B	34	43
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC1CC(CO)C1	ZINC000853793374	DE	On-Demand	Anodyne	MPO	64	38
O=C(NCCc1c[nH]c2ccc(Cl)cc12)NC1CC(CO)C1	ZINC000853793374	DE	On-Demand	Anodyne	MAPT	16	49
NC(=O)c1csc(NCc2ccc(N3CCS(=O)(=O)CC3)cc2)n1	ZINC000853793396	FD	On-Demand	Clean	STAT6	54	37
CN1[C@H]2CCC[C@H]1CC(NC(=O)NCCc1nnc(S)n1C1CC1)C2	ZINC000853793397	FD	On-Demand	Anodyne	HTR3A	34	41
O=S1(=O)CCN(c2ccc(CNc3ccc(F)cn3)cc2)CC1	ZINC000853793422	EE	On-Demand	Clean	STAT6	62	35
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853793490	GF	On-Demand	Mild	GPR119	25	43
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853793491	GF	On-Demand	Mild	GPR119	25	43
CO[C@@](C)(CNc1cc(C#N)ccc1C(C)=O)COCc1ccccc1	ZINC000853793492	FH	On-Demand	Mild	CTRB_BOVIN	45	35
N#Cc1ccc(F)c(CNC(=O)N2CCN(S(=O)(=O)c3cc[nH]n3)CC2)c1	ZINC000853793534	GC	On-Demand	Mild	EPHX2	15	47
Cc1cc([C@@H]2CCN(C(=O)NCc3cc(C#N)ccc3F)C2)c(O)cc1Cl	ZINC000853793546	GI	On-Demand	Mild	P2RX7	62	44
Cc1cc([C@@H]2CCN(C(=O)NCc3cc(C#N)ccc3F)C2)c(O)cc1Cl	ZINC000853793546	GI	On-Demand	Mild	EPHX2	18	50
CN(C(=O)NCCS(=O)(=O)C(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853793547	FD	On-Demand	Anodyne	MME	34	41
CN(C(=O)NCCS(=O)(=O)C(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853793547	FD	On-Demand	Anodyne	NPY5R	15	41
CN(C(=O)NCCS(=O)(=O)C(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853793548	FD	On-Demand	Anodyne	MME	34	41
CN(C(=O)NCCS(=O)(=O)C(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853793548	FD	On-Demand	Anodyne	NPY5R	15	41
CCN1CC[C@H](N(CC)C(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853793674	DE	On-Demand	Mild	CCR5	23	44
CCN1CC[C@H](N(CC)C(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853793674	DE	On-Demand	Mild	MCHR1	25	43
CCN1CC[C@@H](N(CC)C(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853793675	DE	On-Demand	Mild	CCR5	23	44
CCN1CC[C@@H](N(CC)C(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853793675	DE	On-Demand	Mild	MCHR1	25	43
CN1C[C@@H](CNC(=O)NCc2cc(C#N)ccc2F)CC1=O	ZINC000853793705	DC	On-Demand	Mild	P2RX7	58	49
CN1C[C@@H](CNC(=O)NCc2cc(C#N)ccc2F)CC1=O	ZINC000853793705	DC	On-Demand	Mild	CCR3	15	42
CN1C[C@H](CNC(=O)NCc2cc(C#N)ccc2F)CC1=O	ZINC000853793706	DC	On-Demand	Mild	P2RX7	58	49
CN1C[C@H](CNC(=O)NCc2cc(C#N)ccc2F)CC1=O	ZINC000853793706	DC	On-Demand	Mild	CCR3	15	42
CO[C@]1(CO)CCCN(C(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853793708	DD	On-Demand	Mild	EPHX2	17	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cc(C#N)ccc1F	ZINC000853793725	GF	On-Demand	Mild	GPR119	38	45
CC(=O)Nc1ccc(S(=O)(=O)CCCSCCOC(F)F)cc1	ZINC000853793828	FF	On-Demand	Anodyne	CA2	20	44
CC(=O)Nc1ccc(S(=O)(=O)CCCSCCOC(F)F)cc1	ZINC000853793828	FF	On-Demand	Anodyne	CA1	22	43
CC(=O)Nc1ccc(S(=O)(=O)CCCSCCOC(F)F)cc1	ZINC000853793828	FF	On-Demand	Anodyne	CA4	15	40
CC(=O)Nc1ccc(S(=O)(=O)CCCSCCOC(F)F)cc1	ZINC000853793828	FF	On-Demand	Anodyne	CA12	18	44
CC(=O)Nc1ccc(S(=O)(=O)CCCSCCOC(F)F)cc1	ZINC000853793828	FF	On-Demand	Anodyne	CA9	17	44
CC(=O)Nc1ccc(S(=O)(=O)CCCSCCOC(F)F)cc1	ZINC000853793828	FF	On-Demand	Anodyne	MTCA1	38	43
CC(=O)Nc1ccc(S(=O)(=O)CCCSCCOC(F)F)cc1	ZINC000853793828	FF	On-Demand	Anodyne	P96878_MYCTU	48	43
C[C@H](SCCOC(F)F)C(=O)NCc1ccc(F)cc1	ZINC000853793833	DF	On-Demand	Anodyne	AMP1_PLAFQ	20	42
C[C@H](SCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853793852	CH	On-Demand	Bother	CACNA1D	60	36
O=C(CSCCOC(F)F)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853793853	EE	On-Demand	Anodyne	KCNK3	46	32
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(OCC(N)=O)c3)C2)cc1	ZINC000853793879	GD	On-Demand	Clean	HRH2	21	40
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(OCC(N)=O)c3)C2)cc1	ZINC000853793879	GD	On-Demand	Clean	MMP13	24	40
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(OCC(N)=O)c3)C2)cc1	ZINC000853793879	GD	On-Demand	Clean	CCR3	19	40
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(OCC(N)=O)c3)C2)cc1	ZINC000853793879	GD	On-Demand	Clean	MTNR1A	21	49
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(OCC(N)=O)c3)C2)cc1	ZINC000853793879	GD	On-Demand	Clean	MTNR1B	22	49
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(OCC(N)=O)c3)C2)cc1	ZINC000853793879	GD	On-Demand	Clean	MCHR1	22	49
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(OCC(N)=O)c3)C2)cc1	ZINC000853793879	GD	On-Demand	Clean	STAT6	27	42
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@@](O)(C3CC3)C2)c1	ZINC000853793898	DE	On-Demand	Mild	EPHX2	15	44
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@](O)(C3CC3)C2)c1	ZINC000853793900	DE	On-Demand	Mild	EPHX2	15	44
Cc1ccccc1CNC(=O)CSCCOC(F)F	ZINC000853793916	CF	On-Demand	Anodyne	P2RX7	20	42
CCCCCNC(=O)CSCCOC(F)F	ZINC000853793944	CE	On-Demand	Anodyne	EST1_PIG	44	36
CCCCCNC(=O)CSCCOC(F)F	ZINC000853793944	CE	On-Demand	Anodyne	ASAH1	75	34
N#Cc1ccc(F)c(CNC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)c1	ZINC000853793991	FG	On-Demand	Mild	EPHX2	26	47
N#Cc1ccc(F)c(CNC(=O)N(CCN2CCOCC2)CC2CC2)c1	ZINC000853794014	FD	On-Demand	Mild	CASR	48	45
N#Cc1ccc(F)c(CNC(=O)N(CCN2CCOCC2)CC2CC2)c1	ZINC000853794014	FD	On-Demand	Mild	MCHR1	21	43
N#Cc1ccc(F)c(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)c1	ZINC000853794016	EE	On-Demand	Mild	CPT1A	84	41
N#Cc1ccc(F)c(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)c1	ZINC000853794017	EE	On-Demand	Mild	CPT1A	84	41
C[C@H](SCCOC(F)F)C(=O)NCc1ccc(Cl)cc1	ZINC000853794031	DG	On-Demand	Anodyne	AMP1_PLAFQ	16	47
N#Cc1ccc(F)c(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)c1	ZINC000853794058	DD	On-Demand	Mild	EPHX2	16	48
N#Cc1ccc(F)c(CNC(=O)N2CC[C@H](O)C(F)(F)C2)c1	ZINC000853794059	DD	On-Demand	Mild	EPHX2	16	48
C[Si](C)(C)c1ccc(CNC(=O)NCc2cccc(OCC(N)=O)c2)cc1	ZINC000853794091	GE	On-Demand	Anodyne	HRH2	21	41
C[Si](C)(C)c1ccc(CNC(=O)NCc2cccc(OCC(N)=O)c2)cc1	ZINC000853794091	GE	On-Demand	Anodyne	ROCK1	24	41
C[Si](C)(C)c1ccc(CNC(=O)NCc2cccc(OCC(N)=O)c2)cc1	ZINC000853794091	GE	On-Demand	Anodyne	ROCK2	34	42
C[Si](C)(C)c1ccc(CNC(=O)NCc2cccc(OCC(N)=O)c2)cc1	ZINC000853794091	GE	On-Demand	Anodyne	PDS	64	39
C[C@H](SCCOC(F)F)C(=O)NCc1ccccc1	ZINC000853794097	CF	On-Demand	Anodyne	ANPEP	28	45
C[C@H](SCCOC(F)F)C(=O)NCc1ccccc1	ZINC000853794097	CF	On-Demand	Anodyne	AMP1_PLAFQ	57	45
C[C@H](SCCOC(F)F)C(=O)NCc1ccccc1	ZINC000853794097	CF	On-Demand	Anodyne	PDS	58	40
N#Cc1ccc(F)c(CNC(=O)N2CCC3(COC3)C2)c1	ZINC000853794107	CD	On-Demand	Mild	EPHX2	20	43
CC(C)(C)N1C[C@@H](CNC(=O)NCc2cc(C#N)ccc2F)CC1=O	ZINC000853794113	EE	On-Demand	Mild	P2RX7	57	42
CC(C)(C)N1C[C@H](CNC(=O)NCc2cc(C#N)ccc2F)CC1=O	ZINC000853794117	EE	On-Demand	Mild	P2RX7	57	42
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c1	ZINC000853794119	GE	On-Demand	Mild	SIGMAR1	21	40
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c1	ZINC000853794119	GE	On-Demand	Mild	CCR3	42	39
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c1	ZINC000853794119	GE	On-Demand	Mild	MLNR	46	38
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c1	ZINC000853794119	GE	On-Demand	Mild	CXCR3	29	44
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)c1	ZINC000853794119	GE	On-Demand	Mild	MCHR1	45	48
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c1	ZINC000853794121	GE	On-Demand	Mild	SIGMAR1	21	40
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c1	ZINC000853794121	GE	On-Demand	Mild	CCR3	42	39
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c1	ZINC000853794121	GE	On-Demand	Mild	MLNR	46	38
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c1	ZINC000853794121	GE	On-Demand	Mild	CXCR3	29	44
N#Cc1ccc(F)c(CNC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)c1	ZINC000853794121	GE	On-Demand	Mild	MCHR1	45	48
Cc1ccccc1CNC(=O)[C@@H](C)SCCOC(F)F	ZINC000853794132	DF	On-Demand	Anodyne	AMP1_PLAFQ	18	44
Cc1ccccc1CNC(=O)[C@H](C)SCCOC(F)F	ZINC000853794136	DF	On-Demand	Anodyne	AMP1_PLAFQ	18	44
COC(=O)c1cccc(NCc2ccc(CN3CC[C@H](O)C3)cc2)n1	ZINC000853794159	EE	On-Demand	Anodyne	MLNR	42	32
COC(=O)c1cccc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)n1	ZINC000853794161	EE	On-Demand	Anodyne	MLNR	42	32
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853794170	DG	On-Demand	Anodyne	ACE	20	41
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853794170	DG	On-Demand	Anodyne	DRD4	22	41
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853794170	DG	On-Demand	Anodyne	TPP2	60	37
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853794172	DG	On-Demand	Anodyne	ACE	20	41
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853794172	DG	On-Demand	Anodyne	DRD4	22	41
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853794172	DG	On-Demand	Anodyne	TPP2	60	37
O=C(CCSCCOC(F)F)Nc1ccc(F)cc1	ZINC000853794186	CG	On-Demand	Anodyne	FUCA1	18	41
O[C@H]1CCN(Cc2ccc(CNc3cc(OCc4ccccc4)ncn3)cc2)C1	ZINC000853794193	GG	On-Demand	Anodyne	SCN5A	41	38
O[C@@H]1CCN(Cc2ccc(CNc3cc(OCc4ccccc4)ncn3)cc2)C1	ZINC000853794194	GG	On-Demand	Anodyne	SCN5A	41	38
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853794197	FF	On-Demand	Bother	SIGMAR1	22	47
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853794198	FF	On-Demand	Bother	SIGMAR1	22	47
O=C(CSCCC1SCCS1)Nc1ccc2c(c1)CCC2	ZINC000853794232	EI	On-Demand	Anodyne	PTPRF	40	30
CC(C)c1ccc(NC(=O)CSCCOC(F)F)cc1	ZINC000853794238	DH	On-Demand	Anodyne	ENPP1	55	31
N#Cc1cccc(NC(=O)CSCCC2SCCS2)c1	ZINC000853794245	DG	On-Demand	Mild	CCR3	15	41
N#Cc1cccc(NC(=O)CSCCC2SCCS2)c1	ZINC000853794245	DG	On-Demand	Mild	MCHR1	40	38
Cc1cccc(NC(=O)[C@@H](C)SCCC2SCCS2)c1	ZINC000853794248	EI	On-Demand	Anodyne	KCNK3	50	37
Cc1cccc(NC(=O)[C@H](C)SCCC2SCCS2)c1	ZINC000853794249	EI	On-Demand	Anodyne	KCNK3	50	37
C[C@H](SCCC1SCCS1)C(=O)Nc1ccccc1	ZINC000853794256	DH	On-Demand	Anodyne	TIMP3	42	33
CC(=O)c1ccc(C#N)cc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853794261	EF	On-Demand	Mild	MLNR	25	40
CC(=O)c1ccc(C#N)cc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853794261	EF	On-Demand	Mild	MCHR1	26	42
CC(=O)c1ccc(C#N)cc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853794262	EF	On-Demand	Mild	MLNR	25	40
CC(=O)c1ccc(C#N)cc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853794262	EF	On-Demand	Mild	MCHR1	26	42
C[C@H](SCCC1SCCS1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853794271	GJ	On-Demand	Anodyne	RBP4	42	32
C[C@H](SCCC1SCCS1)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853794271	GJ	On-Demand	Anodyne	SLC16A1	43	30
CN(C)C(=O)c1cc(=NCc2ccc(CN3CC[C@@H](O)C3)cc2)cc[nH]1	ZINC000853794274	FD	On-Demand	Anodyne	MLNR	42	35
CN(C)C(=O)c1cc(=NCc2ccc(CN3CC[C@H](O)C3)cc2)cc[nH]1	ZINC000853794275	FD	On-Demand	Anodyne	MLNR	42	35
COc1ccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C2CC2)cc1	ZINC000853794281	GE	On-Demand	Anodyne	MTNR1A	21	41
COc1ccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C2CC2)cc1	ZINC000853794282	GE	On-Demand	Anodyne	MTNR1A	21	41
O=C(CSCCOC(F)F)NCc1ccccc1	ZINC000853794286	CE	On-Demand	Anodyne	CA5B	15	41
O=C(CSCCOC(F)F)NCc1ccccc1	ZINC000853794286	CE	On-Demand	Anodyne	CA5A	18	41
O=C(CSCCOC(F)F)NCc1ccccc1	ZINC000853794286	CE	On-Demand	Anodyne	PDS	55	38
Cc1ccccc1CNC(=O)CSCCC1SCCS1	ZINC000853794287	EH	On-Demand	Anodyne	P2RX7	24	44
C[C@H](SCCC1SCCS1)C(=O)Nc1ccccc1Cl	ZINC000853794303	EJ	On-Demand	Anodyne	CXCL8	41	36
C[C@@H]1CN(C(=O)NCc2cc(C#N)ccc2F)C[C@@H](C)C1O	ZINC000853794327	DD	On-Demand	Mild	P2RX7	40	41
FC(F)OCCSCc1ccc2ccccc2n1	ZINC000853794359	CH	On-Demand	Anodyne	CYSLTR1	23	41
N#Cc1ccc(F)c(CNC(=O)N2C[C@@H]3CCCC[C@@H]32)c1	ZINC000853794372	CF	On-Demand	Mild	P2RX7	35	41
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000853794386	GE	On-Demand	Anodyne	ADRB2	26	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CC[C@@H](SC)C2)cc1	ZINC000853794386	GE	On-Demand	Anodyne	ADRB1	60	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CC[C@H](SC)C2)cc1	ZINC000853794388	GE	On-Demand	Anodyne	ADRB2	26	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CC[C@H](SC)C2)cc1	ZINC000853794388	GE	On-Demand	Anodyne	ADRB1	60	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CC[C@@H](SC)C2)cc1	ZINC000853794390	GE	On-Demand	Anodyne	ADRB2	26	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CC[C@@H](SC)C2)cc1	ZINC000853794390	GE	On-Demand	Anodyne	ADRB1	60	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CC[C@H](SC)C2)cc1	ZINC000853794392	GE	On-Demand	Anodyne	ADRB2	26	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CC[C@H](SC)C2)cc1	ZINC000853794392	GE	On-Demand	Anodyne	ADRB1	60	53
CS(=O)(=O)c1ccc(OCCSCCOC(F)F)cc1	ZINC000853794428	EE	On-Demand	Anodyne	CA7	15	46
CS(=O)(=O)c1ccc(OCCSCCOC(F)F)cc1	ZINC000853794428	EE	On-Demand	Anodyne	O49150_SOLTU	41	31
O=C(CCSCCOC(F)F)NC(=O)NCc1ccccc1	ZINC000853794437	EE	On-Demand	Anodyne	PDS	52	35
O=C(CSCCOC(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853794443	EE	On-Demand	Anodyne	MTOR	43	35
O=C(CSCCOC(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853794443	EE	On-Demand	Anodyne	EPHX2	21	41
O=C(CSCCOC(F)F)Nc1ccc(N2CCOCC2)cc1	ZINC000853794443	EE	On-Demand	Anodyne	STAT6	53	32
C[C@H](SCCOC(F)F)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853794496	EG	On-Demand	Anodyne	EPHX2	64	47
O=C(CSCCOC(F)F)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853794571	FE	On-Demand	Anodyne	MAPK14	22	42
NC(=O)COc1cccc(CNC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853794577	GC	On-Demand	Anodyne	PDS	44	38
C[C@H](SCCOC(F)F)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853794612	EI	On-Demand	Anodyne	KCNK3	31	40
C[C@H](SCCOC(F)F)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853794612	EI	On-Demand	Anodyne	PDS	40	41
CC(C)(C)N(Cc1ccccc1)C(=O)CSCCOC(F)F	ZINC000853794624	EH	On-Demand	Anodyne	AMY2	43	29
C[C@H](SCCC1SCCS1)C(=O)NCCc1ccccc1	ZINC000853794632	EH	On-Demand	Anodyne	AMP1_PLAFQ	33	43
O=C(CSCCC1SCCS1)NC12CC3CC(CC(C3)C1)C2	ZINC000853794653	FI	On-Demand	Anodyne	EPHX2	52	42
O=S(=O)(c1ccccc1NCc1ccc(CN2CC[C@H](O)C2)cc1)C(F)F	ZINC000853794655	GF	On-Demand	Anodyne	OPRK1	21	40
O=S(=O)(c1ccccc1NCc1ccc(CN2CC[C@@H](O)C2)cc1)C(F)F	ZINC000853794656	GF	On-Demand	Anodyne	OPRK1	21	40
COc1ccc(O[C@H](C)CNC(=O)NCCN(C)OC)cc1	ZINC000853794666	DD	On-Demand	Anodyne	MTNR1A	36	48
COc1ccc(O[C@H](C)CNC(=O)NCCN(C)OC)cc1	ZINC000853794666	DD	On-Demand	Anodyne	MTNR1B	27	48
COc1ccc(O[C@@H](C)CNC(=O)NCCN(C)OC)cc1	ZINC000853794667	DD	On-Demand	Anodyne	MTNR1A	36	48
COc1ccc(O[C@@H](C)CNC(=O)NCCN(C)OC)cc1	ZINC000853794667	DD	On-Demand	Anodyne	MTNR1B	27	48
O=C(CSCCOC(F)F)N[C@@H]1CCCc2ccccc21	ZINC000853794668	DG	On-Demand	Anodyne	BDKRB1	47	41
O=C(CSCCOC(F)F)N[C@H]1CCCc2ccccc21	ZINC000853794669	DG	On-Demand	Anodyne	BDKRB1	47	41
Cc1cccc(C(C)C)c1NC(=O)CSCCOC(F)F	ZINC000853794680	DI	On-Demand	Anodyne	SOAT1	48	42
O[C@@H]1CCN(Cc2ccc(CNc3nccc(N4CCCC4)n3)cc2)C1	ZINC000853794694	FE	On-Demand	Anodyne	MRGPRX1	44	38
O[C@H]1CCN(Cc2ccc(CNc3nccc(N4CCCC4)n3)cc2)C1	ZINC000853794695	FE	On-Demand	Anodyne	MRGPRX1	44	38
CC(=O)Nc1cccc(NC(=O)CSCCOC(F)F)c1	ZINC000853794704	DF	On-Demand	Anodyne	KCNK3	66	33
CC(=O)Nc1cccc(NC(=O)CSCCOC(F)F)c1	ZINC000853794704	DF	On-Demand	Anodyne	KCNK9	57	33
C[C@@H]1Cc2ccccc2N1C(=O)CSCCC1SCCS1	ZINC000853794715	EH	On-Demand	Anodyne	DRD4	27	47
C[C@@H]1Cc2ccccc2N1C(=O)CSCCC1SCCS1	ZINC000853794715	EH	On-Demand	Anodyne	TPP2	59	34
COc1ccccc1NC(=O)CSCCOC(F)F	ZINC000853794721	CF	On-Demand	Anodyne	ENPP1	49	32
COc1ccccc1NC(=O)CSCCOC(F)F	ZINC000853794721	CF	On-Demand	Anodyne	FAS	41	38
N#Cc1ccc(F)c(CNC(=O)N2CCC(O)(CO)CC2)c1	ZINC000853794758	DC	On-Demand	Mild	S1PR2	25	43
O=C(CCSCCOC(F)F)NCc1ccccc1Cl	ZINC000853794802	DG	On-Demand	Anodyne	P2RX7	36	40
O=C(CSCCOC(F)F)NCCOc1cccc(Cl)c1	ZINC000853794832	EF	On-Demand	Anodyne	HRH2	22	40
O=C(CSCCOC(F)F)NCCOc1cccc(Cl)c1	ZINC000853794832	EF	On-Demand	Anodyne	PDS	64	39
Cn1c(S)nnc1CCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853794836	FC	On-Demand	Anodyne	PDS	41	32
Cc1ccc(CC2CN(C(=O)NCc3cc(C#N)ccc3F)C2)cc1	ZINC000853794843	EG	On-Demand	Mild	CCR3	29	44
FC(F)OCCSCCSCc1ccccc1	ZINC000853794885	CH	On-Demand	Anodyne	CACNA2D1	15	43
O=C([C@@H](SCCOC(F)F)c1ccccc1)N1CCCCC1	ZINC000853794899	EH	On-Demand	Anodyne	AMY2	42	29
O=C([C@@H](SCCOC(F)F)c1ccccc1)N1CCCCC1	ZINC000853794899	EH	On-Demand	Anodyne	DPP7	50	41
O=C([C@H](SCCOC(F)F)c1ccccc1)N1CCCCC1	ZINC000853794902	EH	On-Demand	Anodyne	AMY2	42	29
O=C([C@H](SCCOC(F)F)c1ccccc1)N1CCCCC1	ZINC000853794902	EH	On-Demand	Anodyne	DPP7	50	41
CCCCCNC(=O)[C@@H](C)SCCOC(F)F	ZINC000853794954	CF	On-Demand	Anodyne	ASAH1	46	31
CCCCCNC(=O)[C@H](C)SCCOC(F)F	ZINC000853794956	CF	On-Demand	Anodyne	ASAH1	46	31
CC(C)c1ccccc1NC(=O)[C@@H](C)SCCOC(F)F	ZINC000853794958	DI	On-Demand	Anodyne	SOAT1	30	40
O=C(CSCCOC(F)F)Nc1ccccc1N1CCCC1=O	ZINC000853794983	EF	On-Demand	Anodyne	KCNQ2	69	38
O=C(CCSCCOC(F)F)Nc1cccc(Br)c1	ZINC000853794991	FH	On-Demand	Anodyne	EGFR	21	40
O=C(CCSCCOC(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000853795000	EI	On-Demand	Anodyne	SLC1A1	25	42
O=C(CCSCCOC(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000853795000	EI	On-Demand	Anodyne	SLC1A3	24	42
O=C(CCSCCOC(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000853795000	EI	On-Demand	Anodyne	SLC1A2	36	42
O=C(CSCCOC(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853795043	EG	On-Demand	Anodyne	P2RY1	58	37
O=C(CSCCOC(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853795043	EG	On-Demand	Anodyne	EPHX2	54	41
O=C(CSCCOC(F)F)Nc1ccc(OCc2ccccc2)cc1	ZINC000853795047	FI	On-Demand	Anodyne	TSHR	42	33
O=C(CSCCOC(F)F)Nc1ccc(OCc2ccccc2)cc1	ZINC000853795047	FI	On-Demand	Anodyne	LTA4H	50	57
O=C(CSCCOC(F)F)Nc1ccc(OCc2ccccc2)cc1	ZINC000853795047	FI	On-Demand	Anodyne	FFAR1	26	40
COc1ccc(C)cc1NC(=O)CSCCOC(F)F	ZINC000853795056	DF	On-Demand	Anodyne	ENPP1	68	32
COCCN(CCF)C(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853795064	EC	On-Demand	Anodyne	PDS	49	36
NC(=O)COc1cccc(CNC(=O)NCC2SCCS2)c1	ZINC000853795066	ED	On-Demand	Anodyne	PDS	42	34
O=C(CSCCOC(F)F)Nc1cccc(S(=O)(=O)N2CCCC2)c1	ZINC000853795095	GE	On-Demand	Anodyne	F13A1	57	43
CC[C@@H](C)c1ccc(NC(=O)CSCCOC(F)F)cc1	ZINC000853795101	DI	On-Demand	Anodyne	SCN2A	20	46
O=C(CSCCC1SCCS1)N1CCN(c2ccc(F)cc2)CC1	ZINC000853795105	GG	On-Demand	Anodyne	SSTR1	34	44
CC(C)c1cccc(C(C)C)c1NC(=O)CSCCC1SCCS1	ZINC000853795109	GK	On-Demand	Anodyne	SOAT1	54	41
CCOc1ccccc1NC(=O)[C@@H](C)SCCC1SCCS1	ZINC000853795112	FI	On-Demand	Anodyne	HCN1	42	31
CCOc1ccccc1NC(=O)[C@H](C)SCCC1SCCS1	ZINC000853795113	FI	On-Demand	Anodyne	HCN1	42	31
Cc1ccc(NC(=O)CSCCOC(F)F)cc1F	ZINC000853795121	CG	On-Demand	Anodyne	ENPP1	54	32
COc1ccc(C)cc1NC(=O)CSCCC1SCCS1	ZINC000853795122	EH	On-Demand	Anodyne	ENPP1	67	32
O=[N+]([O-])c1ccc(CCSCCOC(F)F)cc1	ZINC000853795176	CG	On-Demand	Bother	KCNJ1	22	42
CNC(=O)[C@@H](Cc1ccccc1)SCCOC(F)F	ZINC000853795178	CE	On-Demand	Anodyne	MME	78	40
CNC(=O)[C@@H](Cc1ccccc1)SCCOC(F)F	ZINC000853795178	CE	On-Demand	Anodyne	FCER2	50	36
CNC(=O)[C@@H](Cc1ccccc1)SCCOC(F)F	ZINC000853795178	CE	On-Demand	Anodyne	CAPN2	45	32
Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)SCCOC(F)F	ZINC000853795194	EI	On-Demand	Anodyne	SOAT1	49	47
Cc1cccc(C(C)C)c1NC(=O)[C@H](C)SCCOC(F)F	ZINC000853795196	EI	On-Demand	Anodyne	SOAT1	49	47
O=C(CSCCOC(F)F)NCc1ccc(F)cc1C(F)(F)F	ZINC000853795204	FG	On-Demand	Anodyne	P2RX7	40	47
CN1CCN(C(=O)NCc2cc(C#N)ccc2F)CCC1=O	ZINC000853795257	DD	On-Demand	Mild	P2RX7	49	43
O=C(CCSCCOC(F)F)N1CCN(c2ccccn2)CC1	ZINC000853795296	EE	On-Demand	Anodyne	DRD4	25	40
O=C(NC[C@@H]1OCCc2sccc21)N(CCN1CCOCC1)CC1CC1	ZINC000853795302	GE	On-Demand	Anodyne	CASR	47	38
O=C(NC[C@H]1OCCc2sccc21)N(CCN1CCOCC1)CC1CC1	ZINC000853795305	GE	On-Demand	Anodyne	CASR	47	38
O=C(NC[C@H]1OCCc2sccc21)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853795308	EE	On-Demand	Anodyne	CPT1A	55	34
O=C(NC[C@@H]1OCCc2sccc21)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853795309	EE	On-Demand	Anodyne	CPT1A	55	34
O=C(NC[C@H]1OCCc2sccc21)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853795311	EE	On-Demand	Anodyne	CPT1A	55	34
O=C(NC[C@@H]1OCCc2sccc21)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853795313	EE	On-Demand	Anodyne	CPT1A	55	34
C[C@H]1CCc2ccccc2N1C(=O)CSCCOC(F)F	ZINC000853795321	DG	On-Demand	Anodyne	TPP2	46	30
COc1ccccc1N1CC[C@@H](SCCOC(F)F)C1=O	ZINC000853795338	DF	On-Demand	Anodyne	HTR1A	36	40
COc1ccccc1N1CC[C@@H](SCCOC(F)F)C1=O	ZINC000853795338	DF	On-Demand	Anodyne	DRD2	16	40
COc1ccccc1N1CC[C@H](SCCOC(F)F)C1=O	ZINC000853795340	DF	On-Demand	Anodyne	HTR1A	36	40
COc1ccccc1N1CC[C@H](SCCOC(F)F)C1=O	ZINC000853795340	DF	On-Demand	Anodyne	DRD2	16	40
C[C@H](SCCOC(F)F)C(=O)Nc1ccccc1Cl	ZINC000853795351	DH	On-Demand	Anodyne	CXCL8	56	39
O=C(CCSCCOC(F)F)NCc1ccc(F)cc1	ZINC000853795379	DF	On-Demand	Anodyne	TPSAB1	15	41
COc1ccc(NC(=O)[C@H](C)SCCOC(F)F)cc1OC	ZINC000853795399	EG	On-Demand	Anodyne	ENPP1	78	37
COc1ccc(NC(=O)[C@H](C)SCCOC(F)F)cc1OC	ZINC000853795399	EG	On-Demand	Anodyne	DRTS_TRYCR	43	30
NC(=O)COc1cccc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853795433	FD	On-Demand	Anodyne	PDS	43	34
NC(=O)COc1cccc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853795434	FD	On-Demand	Anodyne	PDS	43	34
NC(=O)COc1cccc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853795435	FD	On-Demand	Anodyne	PDS	43	34
NC(=O)COc1cccc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853795436	FD	On-Demand	Anodyne	PDS	43	34
O=C(CSCCOC(F)F)NCc1cccc(Cl)c1	ZINC000853795437	DF	On-Demand	Anodyne	PDS	66	41
O=C(CSCCC1SCCS1)Nc1ccc2ccccc2c1	ZINC000853795497	EJ	On-Demand	Anodyne	IMDH_CRYPV	18	40
C[C@H](NC(=O)CSCCC1SCCS1)c1ccc(Cl)cc1	ZINC000853795501	FI	On-Demand	Anodyne	PRCP	20	45
NC(=O)c1cc(Cl)nnc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853795517	FD	On-Demand	Anodyne	CCR3	22	41
NC(=O)c1cc(Cl)nnc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853795517	FD	On-Demand	Anodyne	MCHR1	24	41
NC(=O)c1cc(Cl)nnc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853795517	FD	On-Demand	Anodyne	STAT6	58	43
NC(=O)c1cc(Cl)nnc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853795520	FD	On-Demand	Anodyne	CCR3	22	41
NC(=O)c1cc(Cl)nnc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853795520	FD	On-Demand	Anodyne	MCHR1	24	41
NC(=O)c1cc(Cl)nnc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853795520	FD	On-Demand	Anodyne	STAT6	58	43
O=C(CSCCOC(F)F)Nc1ccc(Cl)c(Cl)c1	ZINC000853795532	EH	On-Demand	Anodyne	ENPP1	56	33
O=C(CSCCOC(F)F)NCc1ccc2c(c1)OCO2	ZINC000853795534	DE	On-Demand	Anodyne	BMP1	40	35
O=C(CSCCOC(F)F)NCc1ccc2c(c1)OCO2	ZINC000853795534	DE	On-Demand	Anodyne	NOS2	95	37
N#Cc1ccc(F)c(CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)c1	ZINC000853795544	DE	On-Demand	Mild	P2RX7	36	40
O=C(CSCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853795546	FI	On-Demand	Anodyne	SLC1A1	28	40
O=C(CSCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853795546	FI	On-Demand	Anodyne	SLC1A3	26	40
O=C(CSCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853795546	FI	On-Demand	Anodyne	SLC1A2	28	40
O=C(CSCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853795546	FI	On-Demand	Anodyne	MCHR1	22	42
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@H](N3CCOCC3)CC2)c1	ZINC000853795553	FE	On-Demand	Mild	HRH3	23	40
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@H](N3CCOCC3)CC2)c1	ZINC000853795553	FE	On-Demand	Mild	L3MBTL3	58	37
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@@H](N3CCOCC3)CC2)c1	ZINC000853795554	FE	On-Demand	Mild	HRH3	23	40
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@@H](N3CCOCC3)CC2)c1	ZINC000853795554	FE	On-Demand	Mild	L3MBTL3	58	37
NC(=O)COc1cccc(CNC(=O)NCCC2SCCS2)c1	ZINC000853795621	FD	On-Demand	Anodyne	HRH2	24	42
O=C(CSCCOC(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853795639	EH	On-Demand	Anodyne	EPHX2	23	45
O=C(CSCCOC(F)F)NCC1(c2ccccc2)CCCC1	ZINC000853795678	EH	On-Demand	Anodyne	KCNA3	45	38
FC(F)OCCSCCn1ccnc1	ZINC000853795683	BD	On-Demand	Anodyne	TBXAS1	18	41
FC(F)OCCSCCn1ccnc1	ZINC000853795683	BD	On-Demand	Anodyne	HMOX2	45	35
O[C@H]1CCN(Cc2ccc(CNc3nc4c(F)cccc4o3)cc2)C1	ZINC000853795713	EG	On-Demand	Anodyne	MCHR1	32	40
O[C@@H]1CCN(Cc2ccc(CNc3nc4c(F)cccc4o3)cc2)C1	ZINC000853795715	EG	On-Demand	Anodyne	MCHR1	32	40
O=C(CSCCOC(F)F)NCC1(c2ccccc2)CC1	ZINC000853795743	DF	On-Demand	Anodyne	KCNA3	46	39
O=C(NC[C@H]1OCCc2sccc21)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853795778	FG	On-Demand	Anodyne	EPHX2	17	41
O=C(NC[C@@H]1OCCc2sccc21)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853795779	FG	On-Demand	Anodyne	EPHX2	17	41
CCCCNC(=O)CCSCCOC(F)F	ZINC000853795781	CE	On-Demand	Anodyne	NOD1	48	38
O=C(CCSCCOC(F)F)Nc1ccccc1	ZINC000853795795	CF	On-Demand	Anodyne	LTA4H	22	46
O=C(CCSCCOC(F)F)Nc1ccccc1	ZINC000853795795	CF	On-Demand	Anodyne	HDAC10	18	44
O=C(CCSCCOC(F)F)Nc1ccccc1	ZINC000853795795	CF	On-Demand	Anodyne	HDAC2	15	44
O=C(CCSCCOC(F)F)Nc1ccccc1	ZINC000853795795	CF	On-Demand	Anodyne	HDAC6	15	44
O=C(CCSCCOC(F)F)Nc1ccccc1	ZINC000853795795	CF	On-Demand	Anodyne	HDAC11	15	44
COc1ccc(NC(=O)[C@H](C)SCCOC(F)F)cc1	ZINC000853795812	DF	On-Demand	Anodyne	MTNR1B	19	42
CS[C@H]1CC[C@H](NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853795824	EG	On-Demand	Anodyne	EPHX2	24	41
CS[C@H]1CC[C@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853795893	DG	On-Demand	Anodyne	EPHX2	42	50
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@H]2c2nccc(C(F)(F)F)n2)c1	ZINC000853795897	GH	On-Demand	Mild	P2RX7	21	41
N#Cc1ccc(F)c(CNC(=O)N2CCC[C@@H]2c2nccc(C(F)(F)F)n2)c1	ZINC000853795898	GH	On-Demand	Mild	P2RX7	21	41
COc1ccc2c(NCc3ccc(CN4CC[C@@H](O)C4)cc3)ccnc2c1	ZINC000853795919	FG	On-Demand	Anodyne	HRP1_PLAFA	116	52
COc1ccc2c(NCc3ccc(CN4CC[C@@H](O)C4)cc3)ccnc2c1	ZINC000853795919	FG	On-Demand	Anodyne	SSTR5	42	34
COc1ccc2c(NCc3ccc(CN4CC[C@@H](O)C4)cc3)ccnc2c1	ZINC000853795919	FG	On-Demand	Anodyne	HNMT	64	39
COc1ccc2c(NCc3ccc(CN4CC[C@@H](O)C4)cc3)ccnc2c1	ZINC000853795919	FG	On-Demand	Anodyne	MCHR1	27	47
COc1ccc2c(NCc3ccc(CN4CC[C@H](O)C4)cc3)ccnc2c1	ZINC000853795921	FG	On-Demand	Anodyne	HRP1_PLAFA	116	52
COc1ccc2c(NCc3ccc(CN4CC[C@H](O)C4)cc3)ccnc2c1	ZINC000853795921	FG	On-Demand	Anodyne	SSTR5	42	34
COc1ccc2c(NCc3ccc(CN4CC[C@H](O)C4)cc3)ccnc2c1	ZINC000853795921	FG	On-Demand	Anodyne	HNMT	64	39
COc1ccc2c(NCc3ccc(CN4CC[C@H](O)C4)cc3)ccnc2c1	ZINC000853795921	FG	On-Demand	Anodyne	MCHR1	27	47
OC/C=C/CNc1nccc(N2CCCC2)n1	ZINC000853795935	BD	On-Demand	Anodyne	SORD	62	43
OC/C=C/CNc1nccc(N2CCCC2)n1	ZINC000853795935	BD	On-Demand	Anodyne	MRGPRX1	40	35
O=C(CSCCC1SCCS1)NCc1ccc2c(c1)OCO2	ZINC000853795936	FF	On-Demand	Anodyne	NOS2	100	38
OC/C=C\CNc1nccc(N2CCCC2)n1	ZINC000853795937	BD	On-Demand	Anodyne	SORD	62	43
OC/C=C\CNc1nccc(N2CCCC2)n1	ZINC000853795937	BD	On-Demand	Anodyne	MRGPRX1	40	35
Cc1ccc(NC(=O)CSCCC2SCCS2)cc1C	ZINC000853795957	EI	On-Demand	Anodyne	ENPP1	60	32
O=C(CSCCOC(F)F)NCCCc1ccccc1	ZINC000853795961	DF	On-Demand	Anodyne	CES1	15	41
O=C(CSCCOC(F)F)NCCCc1ccccc1	ZINC000853795961	DF	On-Demand	Anodyne	AMP1_PLAFQ	22	42
O=C(CSCCOC(F)F)NCCCc1ccccc1	ZINC000853795961	DF	On-Demand	Anodyne	CRTM	40	41
CCOc1ccccc1NC(=O)CSCCC1SCCS1	ZINC000853795970	EH	On-Demand	Anodyne	HCN1	42	30
CCOc1ccc([C@@H]2CCCN2C(=O)CSCCOC(F)F)cc1	ZINC000853795996	FH	On-Demand	Anodyne	CPT1A	47	34
O=C(CSCCC1SCCS1)Nc1ccccc1C(F)(F)F	ZINC000853796022	FJ	On-Demand	Anodyne	RBP4	59	35
Cc1cccc(NC(=O)[C@H](C)SCCOC(F)F)c1	ZINC000853796023	CG	On-Demand	Anodyne	KCNK3	69	39
Cc1cccc(NC(=O)[C@H](C)SCCOC(F)F)c1	ZINC000853796023	CG	On-Demand	Anodyne	KCNK9	63	39
Cc1cccc(NC(=O)[C@@H](C)SCCOC(F)F)c1	ZINC000853796026	CG	On-Demand	Anodyne	KCNK3	69	39
Cc1cccc(NC(=O)[C@@H](C)SCCOC(F)F)c1	ZINC000853796026	CG	On-Demand	Anodyne	KCNK9	63	39
Cc1ccc(NC(=O)CSCCOC(F)F)cc1C	ZINC000853796058	CG	On-Demand	Anodyne	ENPP1	70	35
NC(=O)COc1cccc(CNC(=O)N[C@@H]2C=CCC2)c1	ZINC000853796068	CD	On-Demand	Anodyne	PDS	46	33
NC(=O)COc1cccc(CNC(=O)N[C@H]2C=CCC2)c1	ZINC000853796072	CD	On-Demand	Anodyne	PDS	46	33
CS(=O)(=O)C1CN(C(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853796089	DC	On-Demand	Mild	P2RX7	33	40
CS(=O)(=O)C1CN(C(=O)NCc2cc(C#N)ccc2F)C1	ZINC000853796089	DC	On-Demand	Mild	EPHX2	17	47
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CSCCOC(F)F	ZINC000853796093	FD	On-Demand	Anodyne	CA7	28	54
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CSCCOC(F)F	ZINC000853796093	FD	On-Demand	Anodyne	EIF2AK3	44	31
O=C(CSCCOC(F)F)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853796102	GJ	On-Demand	Anodyne	KCNA5	15	41
O=C(CSCCOC(F)F)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853796108	GJ	On-Demand	Anodyne	KCNA5	15	41
C[C@H](SCCOC(F)F)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000853796140	DE	On-Demand	Anodyne	ACR	57	35
O=C(CSCCC1SCCS1)Nc1ccc(N2CCOCC2)cc1	ZINC000853796141	GG	On-Demand	Anodyne	MTOR	48	35
O=C(CSCCC1SCCS1)Nc1ccc(N2CCOCC2)cc1	ZINC000853796141	GG	On-Demand	Anodyne	EPHX2	18	46
O=C(CSCCC1SCCS1)Nc1ccc(N2CCOCC2)cc1	ZINC000853796141	GG	On-Demand	Anodyne	STAT6	52	32
O=C(CSCCOC(F)F)Nc1ccc2ccccc2c1	ZINC000853796143	DH	On-Demand	Anodyne	ENPP1	54	32
O=C(CSCCOC(F)F)Nc1ccc2ccccc2c1	ZINC000853796143	DH	On-Demand	Anodyne	IMDH_CRYPV	17	41
COc1ccc([C@@H]2CCCCCN2C(=O)CSCCOC(F)F)cc1	ZINC000853796183	FI	On-Demand	Anodyne	CPT1A	72	39
CON(C)CCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853796210	DB	On-Demand	Anodyne	HRH2	25	42
CON(C)CCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853796210	DB	On-Demand	Anodyne	ROCK2	37	41
CON(C)CCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853796210	DB	On-Demand	Anodyne	PDS	61	35
NC(=O)COc1cccc(CNC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853796219	GC	On-Demand	Anodyne	PDS	52	42
NC(=O)COc1cccc(CNC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853796220	GC	On-Demand	Anodyne	PDS	52	42
O=C(CSCCOC(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853796236	DG	On-Demand	Anodyne	SLC1A1	33	40
O=C(CSCCOC(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853796236	DG	On-Demand	Anodyne	SLC1A2	40	40
O=C(CSCCOC(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853796236	DG	On-Demand	Anodyne	ERBB4	43	34
O=C(CSCCOC(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853796236	DG	On-Demand	Anodyne	MCHR1	15	41
C[C@H](SCCOC(F)F)C(=O)N1CCc2ccccc2C1	ZINC000853796240	DF	On-Demand	Anodyne	DPP8	25	44
C[C@H](SCCC1SCCS1)C(=O)NCc1ccccc1Cl	ZINC000853796250	FI	On-Demand	Anodyne	P2RX7	29	40
O=C(CSCCC1SCCS1)NCCCc1ccccc1	ZINC000853796252	EH	On-Demand	Anodyne	MTNR1A	18	41
O=C(CSCCC1SCCS1)NCCCc1ccccc1	ZINC000853796252	EH	On-Demand	Anodyne	MTNR1B	17	41
O=C(CSCCC1SCCS1)NCCCc1ccccc1	ZINC000853796252	EH	On-Demand	Anodyne	CRTM	33	40
O=C(CSCCC1SCCS1)N1CCCc2ccccc21	ZINC000853796268	EH	On-Demand	Anodyne	AVPR2	33	40
O=C(CSCCOC(F)F)N1CCCc2ccccc21	ZINC000853796270	DF	On-Demand	Anodyne	AVPR2	32	40
C[C@H](SCCOC(F)F)C(=O)N1CCN(c2ccccn2)CC1	ZINC000853796274	EE	On-Demand	Anodyne	DRD4	25	42
COc1ccccc1NC(=O)CSCCC1SCCS1	ZINC000853796289	EH	On-Demand	Anodyne	FAS	51	37
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000853796304	EH	On-Demand	Anodyne	ACE	21	43
O=C(CSCCC1SCCS1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000853796306	GG	On-Demand	Anodyne	KCNK3	44	33
C[C@H]1CCc2ccccc2N1C(=O)[C@@H](C)SCCOC(F)F	ZINC000853796307	EH	On-Demand	Anodyne	ACE	21	43
C[C@H](SCCOC(F)F)C(=O)N1c2ccccc2CC[C@@H]1C	ZINC000853796309	EH	On-Demand	Anodyne	ACE	21	43
CC(C)c1cccc(C(C)C)c1NC(=O)CSCCOC(F)F	ZINC000853796316	EJ	On-Demand	Anodyne	SOAT1	64	47
COc1cc(NCc2ccc(CN3CC[C@H](O)C3)cc2)c([N+](=O)[O-])cc1OC	ZINC000853796344	GF	On-Demand	Bother	DRD4	22	41
COc1cc(NCc2ccc(CN3CC[C@H](O)C3)cc2)c([N+](=O)[O-])cc1OC	ZINC000853796344	GF	On-Demand	Bother	ACHE	16	42
COc1cc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)c([N+](=O)[O-])cc1OC	ZINC000853796347	GF	On-Demand	Bother	DRD4	22	41
COc1cc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)c([N+](=O)[O-])cc1OC	ZINC000853796347	GF	On-Demand	Bother	ACHE	16	42
O=C(CSCCC1SCCS1)N[C@H]1CCCc2ccccc21	ZINC000853796350	FI	On-Demand	Anodyne	BDKRB1	45	42
O=C(CSCCC1SCCS1)N[C@@H]1CCCc2ccccc21	ZINC000853796352	FI	On-Demand	Anodyne	BDKRB1	45	42
O=C(CSCCOC(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000853796427	EH	On-Demand	Anodyne	SLC1A1	24	40
O=C(CSCCOC(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000853796427	EH	On-Demand	Anodyne	SLC1A3	22	40
O=C(CSCCOC(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000853796427	EH	On-Demand	Anodyne	SLC1A2	35	40
O=C(CSCCOC(F)F)Nc1cccc(C(F)(F)F)c1	ZINC000853796427	EH	On-Demand	Anodyne	PDS	39	40
COc1ccc(NC(=O)[C@H](C)SCCC2SCCS2)cc1OC	ZINC000853796435	FH	On-Demand	Anodyne	QRFPR	40	33
COc1ccc(NC(=O)[C@H](C)SCCC2SCCS2)cc1OC	ZINC000853796435	FH	On-Demand	Anodyne	ENPP1	74	35
O=C(CCSCCOC(F)F)N1CCN(c2ccc(F)cc2)CC1	ZINC000853796436	FF	On-Demand	Anodyne	SSTR1	31	44
COC(=O)c1ccc(C)c(NC(=O)CSCCC2SCCS2)c1	ZINC000853796441	FH	On-Demand	Anodyne	FAS	41	32
O=C(CSCCOC(F)F)NCC1(c2ccccc2)CCOCC1	ZINC000853796455	FF	On-Demand	Anodyne	KCNA3	41	37
O=C(CSCCOC(F)F)NCC1(c2ccccc2)CCOCC1	ZINC000853796455	FF	On-Demand	Anodyne	ICMT	53	38
O=C(CSCCC1SCCS1)N1CCC(Cc2ccccc2)CC1	ZINC000853796463	GI	On-Demand	Anodyne	GRIN2B	80	46
O=C(CSCCC1SCCS1)N1CCC(Cc2ccccc2)CC1	ZINC000853796463	GI	On-Demand	Anodyne	SIGMAR1	17	43
O=C(CSCCC1SCCS1)N1CCC(Cc2ccccc2)CC1	ZINC000853796463	GI	On-Demand	Anodyne	CCR3	31	41
C[C@H](SCCOC(F)F)C(=O)NCCc1ccccc1	ZINC000853796470	DF	On-Demand	Anodyne	MME	45	38
C[C@H](SCCOC(F)F)C(=O)NCCc1ccccc1	ZINC000853796470	DF	On-Demand	Anodyne	CAPN2	50	38
C[C@H](SCCOC(F)F)C(=O)NCCc1ccccc1	ZINC000853796470	DF	On-Demand	Anodyne	NPR	45	39
C[C@H](SCCOC(F)F)C(=O)NCCc1ccccc1	ZINC000853796470	DF	On-Demand	Anodyne	AMP1_PLAFQ	37	46
COc1ccc(CNC(=O)[C@H](C)SCCOC(F)F)cc1OC	ZINC000853796539	EF	On-Demand	Anodyne	TRPV1	17	42
COc1ccc(CNC(=O)[C@H](C)SCCOC(F)F)cc1OC	ZINC000853796539	EF	On-Demand	Anodyne	MT-ND1	19	42
COc1ccc(CNC(=O)[C@H](C)SCCOC(F)F)cc1OC	ZINC000853796539	EF	On-Demand	Anodyne	DRTS_TRYCR	46	32
COc1ccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853796547	FF	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853796547	FF	On-Demand	Anodyne	MTNR1B	15	46
COc1ccc(O[C@H](C)CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853796548	FF	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@H](C)CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853796548	FF	On-Demand	Anodyne	MTNR1B	15	46
COc1ccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853796549	FF	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@H](C)CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853796549	FF	On-Demand	Anodyne	MTNR1B	15	46
COc1ccc(O[C@H](C)CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853796550	FF	On-Demand	Anodyne	MTNR1A	18	46
COc1ccc(O[C@H](C)CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853796550	FF	On-Demand	Anodyne	MTNR1B	15	46
O=C(CSCCC1SCCS1)Nc1ccccc1Cl	ZINC000853796554	EI	On-Demand	Anodyne	EPHB3	53	33
CC(=O)Nc1ccc(NC(=O)CSCCOC(F)F)cc1	ZINC000853796559	DF	On-Demand	Anodyne	ENPP1	49	30
O=C(CSCCOC(F)F)Nc1ccccc1Cl	ZINC000853796563	CG	On-Demand	Anodyne	EPHB3	42	33
COC(=O)N(C)CCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853796565	EC	On-Demand	Anodyne	HRH2	24	40
COC(=O)N(C)CCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853796565	EC	On-Demand	Anodyne	ROCK2	33	40
COC(=O)N(C)CCNC(=O)NCc1cccc(OCC(N)=O)c1	ZINC000853796565	EC	On-Demand	Anodyne	PDS	51	34
C#CCNC(=O)c1ccc(NCc2ccc(CN3CC[C@H](O)C3)cc2)nc1	ZINC000853796573	FD	On-Demand	Mild	MCHR1	20	43
C#CCNC(=O)c1ccc(NCc2ccc(CN3CC[C@H](O)C3)cc2)nc1	ZINC000853796573	FD	On-Demand	Mild	CACNA1I	50	38
C#CCNC(=O)c1ccc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)nc1	ZINC000853796574	FD	On-Demand	Mild	MCHR1	20	43
C#CCNC(=O)c1ccc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)nc1	ZINC000853796574	FD	On-Demand	Mild	CACNA1I	50	38
O=C(CSCCOC(F)F)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853796576	FI	On-Demand	Anodyne	SLC1A1	22	41
O=C(CSCCOC(F)F)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853796576	FI	On-Demand	Anodyne	SLC1A3	21	41
O=C(CSCCOC(F)F)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853796576	FI	On-Demand	Anodyne	SLC1A2	24	41
O=C(CSCCOC(F)F)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853796576	FI	On-Demand	Anodyne	BRAF	15	44
O=C(CSCCOC(F)F)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000853796576	FI	On-Demand	Anodyne	IMDH_CRYPV	22	46
O=C(CSCCC1SCCS1)NCc1ccccc1	ZINC000853796580	DG	On-Demand	Anodyne	PDS	42	35
O=C(CSCCC1SCCS1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853796582	GI	On-Demand	Anodyne	P2RY1	59	38
O=C(CSCCC1SCCS1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853796582	GI	On-Demand	Anodyne	EPHX2	56	43
COc1ccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853796588	GE	On-Demand	Anodyne	MTNR1A	22	40
COc1ccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C(C)C)cc1	ZINC000853796589	GE	On-Demand	Anodyne	MTNR1A	22	40
COc1ccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853796603	FD	On-Demand	Anodyne	MTNR1A	27	40
COc1ccc(O[C@H](C)CNC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853796603	FD	On-Demand	Anodyne	MTNR1B	17	40
COc1ccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853796604	FD	On-Demand	Anodyne	MTNR1A	27	40
COc1ccc(O[C@@H](C)CNC(=O)NCCc2nnc(S)n2C)cc1	ZINC000853796604	FD	On-Demand	Anodyne	MTNR1B	17	40
C[C@@H]1Cc2ccccc2N1C(=O)CSCCOC(F)F	ZINC000853796606	DF	On-Demand	Anodyne	DRD4	25	46
C[C@@H]1Cc2ccccc2N1C(=O)CSCCOC(F)F	ZINC000853796606	DF	On-Demand	Anodyne	TPP2	61	35
O=C(CSCCOC(F)F)N1CCC(Cc2ccccc2)CC1	ZINC000853796611	EG	On-Demand	Anodyne	GRIN2B	82	45
O=C(CSCCOC(F)F)N1CCC(Cc2ccccc2)CC1	ZINC000853796611	EG	On-Demand	Anodyne	SIGMAR1	20	42
O=C(CSCCOC(F)F)N1CCC(Cc2ccccc2)CC1	ZINC000853796611	EG	On-Demand	Anodyne	CCR3	39	41
O=[N+]([O-])c1ccccc1CSCCOC(F)F	ZINC000853796618	CG	On-Demand	Bother	COLA	80	34
C[C@H](SCCOC(F)F)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853796639	EI	On-Demand	Anodyne	EPHX2	21	44
C[C@H](SCCOC(F)F)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853796639	EI	On-Demand	Anodyne	FPR2	17	41
O=C(NC[C@H]1OCCc2sccc21)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853796728	GE	On-Demand	Anodyne	L3MBTL3	50	37
O=C(NC[C@H]1OCCc2sccc21)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853796729	GE	On-Demand	Anodyne	L3MBTL3	50	37
O=C(NC[C@@H]1OCCc2sccc21)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853796730	GE	On-Demand	Anodyne	L3MBTL3	50	37
O=C(NC[C@@H]1OCCc2sccc21)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853796731	GE	On-Demand	Anodyne	L3MBTL3	50	37
C[C@H](SCCOC(F)F)C(=O)Nc1ccccc1	ZINC000853796751	CF	On-Demand	Anodyne	TIMP3	41	32
Cc1cccc(CNC(=O)CSCCOC(F)F)c1	ZINC000853796782	CF	On-Demand	Anodyne	PDS	42	39
O[C@H]1CCN(Cc2ccc(CNc3ccnc4c(F)cccc34)cc2)C1	ZINC000853796801	FH	On-Demand	Anodyne	HRP1_PLAFA	40	32
O[C@H]1CCN(Cc2ccc(CNc3ccnc4c(F)cccc34)cc2)C1	ZINC000853796801	FH	On-Demand	Anodyne	HNMT	49	32
O[C@@H]1CCN(Cc2ccc(CNc3ccnc4c(F)cccc34)cc2)C1	ZINC000853796802	FH	On-Demand	Anodyne	HRP1_PLAFA	40	32
O[C@@H]1CCN(Cc2ccc(CNc3ccnc4c(F)cccc34)cc2)C1	ZINC000853796802	FH	On-Demand	Anodyne	HNMT	49	32
O=C(CSCCOC(F)F)N(c1ccccc1)C1CCCCC1	ZINC000853796809	EI	On-Demand	Anodyne	AMY2	50	34
COc1ccc(OC)c([C@H]2CCCN2C(=O)CSCCOC(F)F)c1	ZINC000853796824	GG	On-Demand	Anodyne	FKBP1A	24	40
COc1cc2c(cc1OC)CN(C(=O)CSCCOC(F)F)CC2	ZINC000853796840	FF	On-Demand	Anodyne	ABCB1	19	49
O=[N+]([O-])c1ccc(NCc2ccc(CN3CC[C@H](O)C3)cc2)c2nonc12	ZINC000853796943	FE	On-Demand	Bother	GSTM2	108	39
O=[N+]([O-])c1ccc(NCc2ccc(CN3CC[C@H](O)C3)cc2)c2nonc12	ZINC000853796943	FE	On-Demand	Bother	GSTP1	67	39
O=[N+]([O-])c1ccc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)c2nonc12	ZINC000853796944	FE	On-Demand	Bother	GSTM2	108	39
O=[N+]([O-])c1ccc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)c2nonc12	ZINC000853796944	FE	On-Demand	Bother	GSTP1	67	39
O=S(=O)(NCCSCCC1SCCS1)c1ccccc1	ZINC000853796950	EF	On-Demand	Anodyne	TBXA2R	15	41
O=C(CSCCC1SCCS1)Nc1ccccc1N1CCCC1=O	ZINC000853796973	GH	On-Demand	Anodyne	KCNQ2	57	38
CCCOc1cccc(CNC(=O)CSCCC2SCCS2)c1	ZINC000853797080	FI	On-Demand	Anodyne	PDS	64	36
O=C(CSCCC1SCCS1)NCC1(c2ccccc2)CCOCC1	ZINC000853797121	GH	On-Demand	Anodyne	KCNA3	41	35
C[C@H](SCCC1SCCS1)C(=O)N1CCc2ccccc2C1	ZINC000853797153	FH	On-Demand	Anodyne	DPP8	22	43
Nc1nc(Cl)cc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)n1	ZINC000853797181	ED	On-Demand	Anodyne	HRH4	16	47
Nc1nc(Cl)cc(NCc2ccc(CN3CC[C@@H](O)C3)cc2)n1	ZINC000853797181	ED	On-Demand	Anodyne	MCHR1	21	40
Nc1nc(Cl)cc(NCc2ccc(CN3CC[C@H](O)C3)cc2)n1	ZINC000853797182	ED	On-Demand	Anodyne	HRH4	16	47
Nc1nc(Cl)cc(NCc2ccc(CN3CC[C@H](O)C3)cc2)n1	ZINC000853797182	ED	On-Demand	Anodyne	MCHR1	21	40
COc1cc2c(cc1OC)CN(C(=O)CSCCC1SCCS1)CC2	ZINC000853797195	GH	On-Demand	Anodyne	ABCB1	18	48
O=[N+]([O-])c1ccc(CCSCCC2SCCS2)cc1	ZINC000853797214	DI	On-Demand	Bother	KCNJ1	23	43
O[C@H]1CCN(Cc2ccc(CNc3cccc(F)n3)cc2)C1	ZINC000853797236	DE	On-Demand	Anodyne	MCHR1	16	41
O[C@@H]1CCN(Cc2ccc(CNc3cccc(F)n3)cc2)C1	ZINC000853797237	DE	On-Demand	Anodyne	MCHR1	16	41
C[C@H](SCCC1SCCS1)C(=O)NCc1ccccc1	ZINC000853797245	EH	On-Demand	Anodyne	ANPEP	21	42
C[C@H](SCCC1SCCS1)C(=O)NCc1ccccc1	ZINC000853797245	EH	On-Demand	Anodyne	AMP1_PLAFQ	50	42
C[C@H](SCCC1SCCS1)C(=O)NCc1ccccc1	ZINC000853797245	EH	On-Demand	Anodyne	PDS	48	38
CNC(=O)[C@@H](Cc1ccccc1)SCCC1SCCS1	ZINC000853797266	EG	On-Demand	Anodyne	MME	73	38
O=C(CSCCC1SCCS1)NCC1(c2ccccc2)CC1	ZINC000853797271	FH	On-Demand	Anodyne	KCNA3	44	36
O=C(CSCCC1SCCS1)NCCOc1cccc(Cl)c1	ZINC000853797289	GH	On-Demand	Anodyne	HRH2	24	41
O[C@@H]1CCN(Cc2ccc(CNc3cc4ccccc4c(Cl)n3)cc2)C1	ZINC000853797305	FI	On-Demand	Anodyne	MCHR1	20	41
O[C@H]1CCN(Cc2ccc(CNc3cc4ccccc4c(Cl)n3)cc2)C1	ZINC000853797306	FI	On-Demand	Anodyne	MCHR1	20	41
O=C(CCSCCC1SCCS1)Nc1ccccc1	ZINC000853797346	DH	On-Demand	Anodyne	LTA4H	16	42
O=C(CCSCCC1SCCS1)Nc1ccccc1	ZINC000853797346	DH	On-Demand	Anodyne	HDAC10	18	43
O=C(CCSCCC1SCCS1)Nc1ccccc1	ZINC000853797346	DH	On-Demand	Anodyne	HDAC11	17	43
O=C(CSCCC1SCCS1)NCc1ccc(F)cc1C(F)(F)F	ZINC000853797396	GI	On-Demand	Anodyne	P2RX7	53	49
O=C(CCSCCC1SCCS1)Nc1ccccc1C(F)(F)F	ZINC000853797429	GJ	On-Demand	Anodyne	RBP4	41	33
O=C(CCSCCC1SCCS1)NCc1ccccc1Cl	ZINC000853797430	FI	On-Demand	Anodyne	P2RX7	29	40
C[C@H](SCCC1SCCS1)C(=O)N[C@H](C)c1ccc(Cl)cc1	ZINC000853797435	GJ	On-Demand	Anodyne	PRCP	15	42
C[C@H](NC(=O)[C@@H](C)SCCC1SCCS1)c1ccc(Cl)cc1	ZINC000853797436	GJ	On-Demand	Anodyne	PRCP	15	42
C[C@H](SCCC1SCCS1)C(=O)N[C@@H](C)c1ccc(Cl)cc1	ZINC000853797437	GJ	On-Demand	Anodyne	PRCP	15	42
COc1ccccc1N1CC[C@H](SCCC2SCCS2)C1=O	ZINC000853797532	FH	On-Demand	Anodyne	HTR1A	38	40
COc1ccccc1N1CC[C@@H](SCCC2SCCS2)C1=O	ZINC000853797533	FH	On-Demand	Anodyne	HTR1A	38	40
O=[N+]([O-])c1ccc(NC[C@]2(OCCO)CCOC2)c2nonc12	ZINC000853797542	DC	On-Demand	Bother	GSTM2	109	39
O=[N+]([O-])c1ccc(NC[C@]2(OCCO)CCOC2)c2nonc12	ZINC000853797542	DC	On-Demand	Bother	GSTP1	67	38
O=[N+]([O-])c1ccc(NC[C@@]2(OCCO)CCOC2)c2nonc12	ZINC000853797543	DC	On-Demand	Bother	GSTM2	109	39
O=[N+]([O-])c1ccc(NC[C@@]2(OCCO)CCOC2)c2nonc12	ZINC000853797543	DC	On-Demand	Bother	GSTP1	67	38
C[C@H](SCCC1SCCS1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853797622	FI	On-Demand	Anodyne	ACE	19	42
C[C@H](SCCC1SCCS1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853797622	FI	On-Demand	Anodyne	DRD4	22	41
C[C@H](SCCC1SCCS1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853797622	FI	On-Demand	Anodyne	TPP2	59	36
C[C@H](SCCC1SCCS1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853797624	FI	On-Demand	Anodyne	ACE	19	42
C[C@H](SCCC1SCCS1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853797624	FI	On-Demand	Anodyne	DRD4	22	41
C[C@H](SCCC1SCCS1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853797624	FI	On-Demand	Anodyne	TPP2	59	36
CCOc1ccc([C@@H]2CCCN2C(=O)CSCCC2SCCS2)cc1	ZINC000853797638	GJ	On-Demand	Anodyne	CPT1A	47	34
CC(=O)c1c(F)cccc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853797676	EG	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)c1c(F)cccc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853797676	EG	On-Demand	Anodyne	CCR3	45	37
CC(=O)c1c(F)cccc1NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853797676	EG	On-Demand	Anodyne	MLNR	57	36
CC(=O)c1c(F)cccc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853797677	EG	On-Demand	Anodyne	SIGMAR1	24	41
CC(=O)c1c(F)cccc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853797677	EG	On-Demand	Anodyne	CCR3	45	37
CC(=O)c1c(F)cccc1NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853797677	EG	On-Demand	Anodyne	MLNR	57	36
CCCCC[C@@H](C)NC(=O)CSCCC1SCCS1	ZINC000853797686	DI	On-Demand	Anodyne	NOD1	42	33
Cn1ncnc1C(=O)NCC1(NC(=O)OC(C)(C)C)CCCCCC1	ZINC000853797698	FE	On-Demand	Anodyne	HCN1	49	30
Cn1ncnc1C(=O)NCC1(NC(=O)OC(C)(C)C)CCCCCC1	ZINC000853797698	FE	On-Demand	Anodyne	HCN4	47	30
Cn1ncnc1C(=O)N1CCC[C@@H](C(=O)Nc2ccccn2)C1	ZINC000853797720	DC	On-Demand	Anodyne	MAP3K12	29	42
Cn1ncnc1C(=O)N1CCC[C@H](C(=O)Nc2ccccn2)C1	ZINC000853797721	DC	On-Demand	Anodyne	MAP3K12	29	42
Cn1ncnc1C(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853797770	EC	On-Demand	Anodyne	DRD4	43	33
Cn1ncnc1C(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853797770	EC	On-Demand	Anodyne	GPR119	40	37
Cn1ncnc1C(=O)NCC1CCCCCCC1	ZINC000853797783	CD	On-Demand	Anodyne	CACNA1I	60	36
C[C@@H](OC(=O)CSc1ncnc2sccc12)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853797786	JG	On-Demand	Anodyne	DRD4	26	45
C[C@@H](OC(=O)CSc1ncnc2sccc12)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853797786	JG	On-Demand	Anodyne	SIGMAR1	21	40
C[C@@H](OC(=O)CSc1ncnc2sccc12)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853797786	JG	On-Demand	Anodyne	BIRC2	25	40
C[C@@H](OC(=O)CSc1ncnc2sccc12)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853797788	JG	On-Demand	Anodyne	DRD4	26	45
C[C@@H](OC(=O)CSc1ncnc2sccc12)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853797788	JG	On-Demand	Anodyne	SIGMAR1	21	40
C[C@@H](OC(=O)CSc1ncnc2sccc12)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853797788	JG	On-Demand	Anodyne	BIRC2	25	40
Cn1ncnc1C(=O)NCCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853797829	FC	On-Demand	Anodyne	DRD2	33	42
Cn1ncnc1C(=O)NCCCN1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853797829	FC	On-Demand	Anodyne	DRD3	61	38
Cn1ncnc1C(=O)N1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853797880	DC	On-Demand	Anodyne	GPR119	36	41
O=C(NCCOC1CCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853797901	EE	On-Demand	Anodyne	EPHX2	24	41
Cn1ncnc1C(=O)N1CCC(C2CCCCC2)CC1	ZINC000853797906	CE	On-Demand	Anodyne	L3MBTL3	52	35
COc1ccc(N2CCCN(C(=O)c3ncnn3C)CC2)cc1	ZINC000853797908	DD	On-Demand	Clean	CCKAR	32	40
Cn1ncnc1C(=O)NCc1ccc(N2CCOCC2)cc1	ZINC000853797936	DC	On-Demand	Clean	STAT6	60	37
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCOC2CCC2)C1	ZINC000853797953	CC	On-Demand	Anodyne	EPHX2	15	46
CCn1c(=O)c(N[C@@H]2C=CCC2)nc2ccccc21	ZINC000853797984	CF	On-Demand	Anodyne	PYGM	20	43
CCn1c(=O)c(N[C@H]2C=CCC2)nc2ccccc21	ZINC000853797985	CF	On-Demand	Anodyne	PYGM	20	43
O=C(c1ccccc1)N1CC[C@H](CSCCC2SCCS2)C1	ZINC000853797999	FI	On-Demand	Anodyne	L3MBTL3	42	34
O=C(c1ccccc1)N1CC[C@@H](CSCCC2SCCS2)C1	ZINC000853798000	FI	On-Demand	Anodyne	L3MBTL3	42	34
C[C@H](SCCC1SCCS1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853798012	FI	On-Demand	Anodyne	EPHX2	45	41
Cn1ncnc1C(=O)NC1CCCCCCC1	ZINC000853798061	BD	On-Demand	Anodyne	CNR1	23	49
Cn1ncnc1C(=O)NC1CCCCCCC1	ZINC000853798061	BD	On-Demand	Anodyne	CNR2	29	42
Cn1ncnc1C(=O)NC1CCCCCCC1	ZINC000853798061	BD	On-Demand	Anodyne	EPHX2	23	40
C#CCCCNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853798076	CF	On-Demand	Mild	IMDH_CRYPV	52	33
CCCCC[C@@H](C)NC(=O)c1ncnn1C	ZINC000853798147	BD	On-Demand	Anodyne	ADA	30	40
Cn1ncnc1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000853798171	CC	On-Demand	Anodyne	ADRB1	27	42
Cn1ncnc1C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000853798171	CC	On-Demand	Anodyne	ADRB3	41	42
Cn1ncnc1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000853798172	CC	On-Demand	Anodyne	ADRB1	27	42
Cn1ncnc1C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000853798172	CC	On-Demand	Anodyne	ADRB3	41	42
C[C@H](CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-])N(C)C	ZINC000853798173	FF	On-Demand	Bother	COLA	76	35
C[C@@H](CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-])N(C)C	ZINC000853798174	FF	On-Demand	Bother	COLA	76	35
C[C@H](CCNc1nccc(N2CCCC2)n1)N(C)C	ZINC000853798185	CD	On-Demand	Anodyne	SORD	85	37
C[C@H](CCNc1nccc(N2CCCC2)n1)N(C)C	ZINC000853798185	CD	On-Demand	Anodyne	MRGPRX1	42	38
C[C@@H](CCNc1nccc(N2CCCC2)n1)N(C)C	ZINC000853798186	CD	On-Demand	Anodyne	SORD	85	37
C[C@@H](CCNc1nccc(N2CCCC2)n1)N(C)C	ZINC000853798186	CD	On-Demand	Anodyne	MRGPRX1	42	38
Cn1ncnc1C(=O)NCc1ccc(N2CCOCC2)cc1C(F)(F)F	ZINC000853798202	FD	On-Demand	Clean	STAT6	53	32
Cn1ncnc1C(=O)NC[C@H](O)c1ccccc1	ZINC000853798259	BC	On-Demand	Anodyne	SCD1	18	40
Cn1ncnc1C(=O)NC[C@@H](O)c1ccccc1	ZINC000853798263	BC	On-Demand	Anodyne	SCD1	18	40
COCC1(NC(=O)NCCOC2CCC2)CCCC1	ZINC000853798293	CD	On-Demand	Anodyne	EPHX2	19	41
CC(=O)c1ccc(N2CCN(C(=O)c3ncnn3C)CC2)c(F)c1	ZINC000853798294	ED	On-Demand	Anodyne	NPY2R	59	41
CC(=O)c1ccc(N2CCN(C(=O)c3ncnn3C)CC2)c(F)c1	ZINC000853798294	ED	On-Demand	Anodyne	SLC6A9	29	51
C#CCCCNC(=O)NC1(COC)CCCC1	ZINC000853798340	BD	On-Demand	Mild	EPHX2	17	40
CN(Cc1ccc(Cl)nc1)C(=O)c1ncnn1C	ZINC000853798374	CD	On-Demand	Anodyne	Q8WSF8_APLCA	33	46
CN(Cc1ccc(Cl)nc1)C(=O)c1ncnn1C	ZINC000853798374	CD	On-Demand	Anodyne	NACHRBETA2	38	46
COc1ccc2c(NCCN(C)CCCN(C)C)ccnc2c1	ZINC000853798401	DF	On-Demand	Anodyne	HRP1_PLAFA	121	48
COc1ccc2c(NCCN(C)CCCN(C)C)ccnc2c1	ZINC000853798401	DF	On-Demand	Anodyne	HNMT	62	39
COc1ccc2c(NCCN(C)CCCN(C)C)ccnc2c1	ZINC000853798401	DF	On-Demand	Anodyne	BOTA	20	44
COc1ccc2c(NCCN(C)CCCN(C)C)ccnc2c1	ZINC000853798401	DF	On-Demand	Anodyne	GSG2	33	42
COC[C@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798431	DE	On-Demand	Anodyne	ADRB1	16	51
COC[C@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798431	DE	On-Demand	Anodyne	DRD4	40	30
COC[C@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798431	DE	On-Demand	Anodyne	MTNR1A	46	40
COC[C@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798431	DE	On-Demand	Anodyne	MTNR1B	41	40
COC[C@@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798433	DE	On-Demand	Anodyne	ADRB1	16	51
COC[C@@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798433	DE	On-Demand	Anodyne	DRD4	40	30
COC[C@@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798433	DE	On-Demand	Anodyne	MTNR1A	46	40
COC[C@@H](NC(=O)NCCOC1CCC1)c1cccc(OC)c1	ZINC000853798433	DE	On-Demand	Anodyne	MTNR1B	41	40
Cn1ncnc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853798485	DC	On-Demand	Anodyne	L3MBTL3	56	37
Cn1ncnc1C(=O)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853798485	DC	On-Demand	Anodyne	NAMPT	37	42
C#CCCCNC(=O)NC[C@@H](C)c1ccccn1	ZINC000853798497	BD	On-Demand	Mild	HRH2	16	42
C#CCCCNC(=O)NC[C@H](C)c1ccccn1	ZINC000853798498	BD	On-Demand	Mild	HRH2	16	42
COc1cccc(C2(NC(=O)NCCOC3CCC3)CCC2)c1	ZINC000853798557	DF	On-Demand	Anodyne	MTNR1A	44	40
COc1cccc(C2(NC(=O)NCCOC3CCC3)CCC2)c1	ZINC000853798557	DF	On-Demand	Anodyne	MTNR1B	38	40
C[C@@H](CCNC(=O)NCCOC1CCC1)N(C)C	ZINC000853798572	CD	On-Demand	Anodyne	CHRNA4	23	47
O=C(NCCOC1CCC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853798579	ED	On-Demand	Anodyne	HRH2	22	42
O=C(NCCOC1CCC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853798579	ED	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCCOC1CCC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853798580	ED	On-Demand	Anodyne	HRH2	22	42
O=C(NCCOC1CCC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853798580	ED	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NCCOC1CCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853798584	CD	On-Demand	Anodyne	CPT1A	62	35
O=C(NCCOC1CCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853798585	CD	On-Demand	Anodyne	CPT1A	62	35
COc1ccccc1[C@@H](O)CNC(=O)c1ncnn1C	ZINC000853798597	CC	On-Demand	Anodyne	HCN1	56	33
COc1ccc(OC)c([C@H](O)CNC(=O)c2ncnn2C)c1	ZINC000853798601	DC	On-Demand	Anodyne	MTNR1A	21	43
C#CCCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853798617	CE	On-Demand	Mild	MTNR1A	44	41
C#CCCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853798617	CE	On-Demand	Mild	MTNR1B	45	41
C#CCCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853798620	CE	On-Demand	Mild	MTNR1A	44	41
C#CCCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853798620	CE	On-Demand	Mild	MTNR1B	45	41
Cn1ncnc1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000853798625	CE	On-Demand	Anodyne	ACHE	32	41
Cn1ncnc1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000853798625	CE	On-Demand	Anodyne	SLC18A2	44	39
Cn1ncnc1C(=O)N1CCC(CCc2ccccc2)CC1	ZINC000853798625	CE	On-Demand	Anodyne	GRIN2B	67	48
C#CCCCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853798657	CD	On-Demand	Mild	MME	34	43
C#CCCCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853798657	CD	On-Demand	Mild	NPY5R	16	41
C#CCCCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853798657	CD	On-Demand	Mild	NPFFR1	56	32
Cn1ncnc1C(=O)N1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853798659	CC	On-Demand	Anodyne	GPR119	45	43
C#CCCCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853798660	CD	On-Demand	Mild	MME	34	43
C#CCCCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853798660	CD	On-Demand	Mild	NPY5R	16	41
C#CCCCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853798660	CD	On-Demand	Mild	NPFFR1	56	32
CCOC(=O)N1CCC(NC(=O)CCCNC(=O)c2ncnn2C)CC1	ZINC000853798709	FC	On-Demand	Anodyne	CCR8	21	40
C[C@H](CCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)N(C)C	ZINC000853798725	DE	On-Demand	Bother	TBXA2R	16	40
C[C@@H](CCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1)N(C)C	ZINC000853798727	DE	On-Demand	Bother	TBXA2R	16	40
Cn1ncnc1C(=O)NCCc1ccc(N2CCCCC2)cc1	ZINC000853798783	DD	On-Demand	Anodyne	CTSK	26	46
Cn1ncnc1C(=O)NCCc1ccc(N2CCCCC2)cc1	ZINC000853798783	DD	On-Demand	Anodyne	CTSL	20	46
O=C(NCCC1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853798805	DG	On-Demand	Reactive	LCK	21	41
O=C(NCCC1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853798805	DG	On-Demand	Reactive	CSNK1D	43	44
O=C(NCCC1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853798805	DG	On-Demand	Reactive	SIRT3	41	33
O=C(NCCC1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853798805	DG	On-Demand	Reactive	SIRT2	46	33
O=C(NCCC1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853798805	DG	On-Demand	Reactive	SIRT1	41	33
Cn1ncnc1C(=O)NCCc1cccnc1	ZINC000853798943	BC	On-Demand	Anodyne	TBXAS1	39	44
Cn1ncnc1C(=O)NCCc1cccnc1	ZINC000853798943	BC	On-Demand	Anodyne	PTAFR	29	46
Cn1ncnc1C(=O)NCCc1cccnc1	ZINC000853798943	BC	On-Demand	Anodyne	CHRNA7	41	34
Cn1ncnc1C(=O)NCCc1cccnc1	ZINC000853798943	BC	On-Demand	Anodyne	NAMPT	51	41
CCCCCCCCCNC(=O)c1ncnn1C	ZINC000853798967	CE	On-Demand	Mild	ASAH1	101	41
COc1ccc2c(NCC[C@@H](C)N(C)C)ccnc2c1	ZINC000853798972	CF	On-Demand	Anodyne	HRP1_PLAFA	120	45
COc1ccc2c(NCC[C@@H](C)N(C)C)ccnc2c1	ZINC000853798972	CF	On-Demand	Anodyne	HNMT	61	38
COc1ccc2c(NCC[C@@H](C)N(C)C)ccnc2c1	ZINC000853798972	CF	On-Demand	Anodyne	BOTA	34	43
COc1ccc2c(NCC[C@H](C)N(C)C)ccnc2c1	ZINC000853798974	CF	On-Demand	Anodyne	HRP1_PLAFA	120	45
COc1ccc2c(NCC[C@H](C)N(C)C)ccnc2c1	ZINC000853798974	CF	On-Demand	Anodyne	HNMT	61	38
COc1ccc2c(NCC[C@H](C)N(C)C)ccnc2c1	ZINC000853798974	CF	On-Demand	Anodyne	BOTA	34	43
Cn1ncnc1C(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1	ZINC000853799056	GD	On-Demand	Clean	NPY2R	68	35
C#CCCN(CCOC)C(=O)N[C@@H](C)COCc1ccccc1	ZINC000853799057	DE	On-Demand	Mild	NPR	43	30
Cn1ncnc1C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853799058	DC	On-Demand	Anodyne	EPHX2	15	44
Cn1ncnc1C(=O)NC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853799058	DC	On-Demand	Anodyne	GPR119	50	45
C#CCCN(CCOC)C(=O)N[C@H](C)COCc1ccccc1	ZINC000853799059	DE	On-Demand	Mild	NPR	43	30
C1=C[C@@H](Nc2ccnc(N3CCOCC3)n2)CC1	ZINC000853799101	BD	On-Demand	Anodyne	PIK3CA	16	42
COc1ccc(-c2noc(N[C@@H]3C=CCC3)n2)cc1	ZINC000853799107	CF	On-Demand	Anodyne	LUCI_PHOPE	15	40
COc1ccc(-c2noc(N[C@H]3C=CCC3)n2)cc1	ZINC000853799108	CF	On-Demand	Anodyne	LUCI_PHOPE	15	40
CN(C(=O)NCCOC1CCC1)[C@H](CO)Cc1ccccc1	ZINC000853799182	DD	On-Demand	Anodyne	TIMP3	75	37
CN(C(=O)NCCOC1CCC1)[C@H](CO)Cc1ccccc1	ZINC000853799182	DD	On-Demand	Anodyne	NPY5R	16	41
CN(C(=O)NCCOC1CCC1)[C@@H](CO)Cc1ccccc1	ZINC000853799184	DD	On-Demand	Anodyne	TIMP3	75	37
CN(C(=O)NCCOC1CCC1)[C@@H](CO)Cc1ccccc1	ZINC000853799184	DD	On-Demand	Anodyne	NPY5R	16	41
O=C(NCCOC1CCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853799221	DE	On-Demand	Anodyne	EPHX2	28	51
O=C(NCCOC1CCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853799221	DE	On-Demand	Anodyne	SCD1	17	45
O=C(NCCOC1CCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853799226	EG	On-Demand	Reactive	CSNK1D	38	43
O=C(NCCOC1CCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853799226	EG	On-Demand	Reactive	ITK	15	41
Cn1ncnc1C(=O)NN1CCCCC1	ZINC000853799362	BB	On-Demand	Anodyne	CNR1	40	30
COCc1nc(C(=O)N(C)Cc2ccccc2O)n(C)n1	ZINC000853799390	CC	On-Demand	Clean	MT-CYB	40	31
C[C@H](CCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])N(C)C	ZINC000853799401	CE	On-Demand	Bother	COLA	102	36
C[C@@H](CCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])N(C)C	ZINC000853799402	CE	On-Demand	Bother	COLA	102	36
C[C@H](CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])N(C)C	ZINC000853799427	FE	On-Demand	Bother	COLA	41	30
C[C@@H](CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])N(C)C	ZINC000853799428	FE	On-Demand	Bother	COLA	41	30
Cn1ncnc1C(=O)NCCCCCCCN1CCCC1	ZINC000853799481	CD	On-Demand	Anodyne	HTR1A	24	42
Cn1ncnc1C(=O)NCCCCCCCN1CCCC1	ZINC000853799481	CD	On-Demand	Anodyne	HTR2A	27	40
Cn1ncnc1C(=O)NCCCCCCCN1CCCC1	ZINC000853799481	CD	On-Demand	Anodyne	DRD3	68	38
Cn1ncnc1C(=O)NCCCCCCCN1CCCC1	ZINC000853799481	CD	On-Demand	Anodyne	CHRNA7	20	47
Cn1ncnc1C(=O)NCCCCCCCN1CCCC1	ZINC000853799481	CD	On-Demand	Anodyne	HNMT	50	37
C#CCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853799594	EE	On-Demand	Mild	HTR1A	34	46
C#CCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853799594	EE	On-Demand	Mild	DRD2	27	41
C#CCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853799594	EE	On-Demand	Mild	HTR2A	25	44
C#CCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853799594	EE	On-Demand	Mild	ADRA1A	20	41
C#CCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853799594	EE	On-Demand	Mild	DRD3	42	44
C[C@@H](CCNc1nc(-c2cccnc2)nc2ccccc12)N(C)C	ZINC000853799648	DG	On-Demand	Anodyne	PKN2	18	43
C[C@H](CCNc1nc(-c2cccnc2)nc2ccccc12)N(C)C	ZINC000853799649	DG	On-Demand	Anodyne	PKN2	18	43
CON(C)CCNC(=O)N[C@H](C)COCc1ccccc1	ZINC000853799658	CD	On-Demand	Anodyne	PAPA1_CARPA	44	34
CON(C)CCNC(=O)N[C@H](C)COCc1ccccc1	ZINC000853799658	CD	On-Demand	Anodyne	CTSK	20	40
CON(C)CCNC(=O)N[C@H](C)COCc1ccccc1	ZINC000853799658	CD	On-Demand	Anodyne	CAPNS1	53	34
CON(C)CCNC(=O)N[C@H](C)COCc1ccccc1	ZINC000853799658	CD	On-Demand	Anodyne	CAPN1	53	39
CON(C)CCNC(=O)N[C@H](C)COCc1ccccc1	ZINC000853799658	CD	On-Demand	Anodyne	CAPN2	76	36
CON(C)CCNC(=O)N[C@H](C)COCc1ccccc1	ZINC000853799658	CD	On-Demand	Anodyne	NPR	74	34
CON(C)CCNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000853799659	CD	On-Demand	Anodyne	PAPA1_CARPA	44	34
CON(C)CCNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000853799659	CD	On-Demand	Anodyne	CTSK	20	40
CON(C)CCNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000853799659	CD	On-Demand	Anodyne	CAPNS1	53	34
CON(C)CCNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000853799659	CD	On-Demand	Anodyne	CAPN1	53	39
CON(C)CCNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000853799659	CD	On-Demand	Anodyne	CAPN2	76	36
CON(C)CCNC(=O)N[C@@H](C)COCc1ccccc1	ZINC000853799659	CD	On-Demand	Anodyne	NPR	74	34
CC(=O)c1ccnc(N[C@@H]2C=CCC2)c1	ZINC000853799705	BE	On-Demand	Anodyne	TYK2	32	40
CC(=O)c1ccnc(N[C@H]2C=CCC2)c1	ZINC000853799707	BE	On-Demand	Anodyne	TYK2	32	40
O=C(c1cccnc1N[C@H]1C=CCC1)N1CCc2ccccc21	ZINC000853799823	DG	On-Demand	Anodyne	AVPR2	60	38
O=C(c1cccnc1N[C@H]1C=CCC1)N1CCc2ccccc21	ZINC000853799823	DG	On-Demand	Anodyne	GPBAR1	27	41
O=C(c1cccnc1N[C@@H]1C=CCC1)N1CCc2ccccc21	ZINC000853799824	DG	On-Demand	Anodyne	AVPR2	60	38
O=C(c1cccnc1N[C@@H]1C=CCC1)N1CCc2ccccc21	ZINC000853799824	DG	On-Demand	Anodyne	GPBAR1	27	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	ADA	39	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	ADORA1	175	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	SLC29A1	138	58
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	ADORA2A	59	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	ADORA2B	19	74
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	ADK	62	57
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	AHCY	62	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	CDA	43	33
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	P2RX4	43	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	P2RX1	57	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	P2RY1	35	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	AMD1	17	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	P2RY2	15	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	ADORA3	142	74
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	OXGR1	123	43
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	RNASE1	43	33
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	DNMT3B	70	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	Q4VQ11_PIG	99	74
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	GPR17	49	51
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799842	EB	On-Demand	Anodyne	DOT1L	91	44
C#CCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853799852	CD	On-Demand	Mild	CPT1A	63	34
C#CCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853799853	CD	On-Demand	Mild	CPT1A	63	34
COc1ccc2c(NC[C@@]3(OCCO)CCOC3)ccnc2c1	ZINC000853799888	DD	On-Demand	Anodyne	HRP1_PLAFA	55	41
COc1ccc2c(NC[C@@]3(OCCO)CCOC3)ccnc2c1	ZINC000853799888	DD	On-Demand	Anodyne	HNMT	45	33
COc1ccc2c(NC[C@]3(OCCO)CCOC3)ccnc2c1	ZINC000853799889	DD	On-Demand	Anodyne	HRP1_PLAFA	55	41
COc1ccc2c(NC[C@]3(OCCO)CCOC3)ccnc2c1	ZINC000853799889	DD	On-Demand	Anodyne	HNMT	45	33
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	ADA	39	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	ADORA1	175	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	SLC29A1	138	58
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	ADORA2A	59	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	ADORA2B	19	74
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	ADK	62	57
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	AHCY	62	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	CDA	43	33
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	P2RX4	43	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	P2RX1	57	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	P2RY1	35	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	AMD1	17	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	P2RY2	15	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	ADORA3	142	74
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	OXGR1	123	43
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	RNASE1	43	33
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	DNMT3B	70	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	Q4VQ11_PIG	99	74
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	GPR17	49	51
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C=CCC4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853799945	EB	On-Demand	Anodyne	DOT1L	91	44
CCOC(=O)N[C@@H](CNC(=O)c1nc(COC)nn1C)CC(C)C	ZINC000853799954	EC	On-Demand	Anodyne	CAPN2	59	31
CCOC(=O)N[C@H](CNC(=O)c1nc(COC)nn1C)CC(C)C	ZINC000853799956	EC	On-Demand	Anodyne	CAPN2	59	31
C#CCCCNC(=O)NC1(c2cccc(OC)c2)CCC1	ZINC000853800003	CF	On-Demand	Mild	DRD4	41	32
Cn1ncnc1C(=O)NCCc1nnc2ccccn12	ZINC000853800008	CB	On-Demand	Anodyne	POLR1A	72	35
Cn1ncnc1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000853800030	CC	On-Demand	Anodyne	ADRB2	21	41
Cn1ncnc1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000853800030	CC	On-Demand	Anodyne	ADRB1	26	41
Cn1ncnc1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000853800030	CC	On-Demand	Anodyne	ADRB3	16	41
Cn1ncnc1C(=O)NC[C@H](O)COc1cccc(F)c1	ZINC000853800030	CC	On-Demand	Anodyne	PDS	47	42
Cn1ncnc1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000853800031	CC	On-Demand	Anodyne	ADRB2	21	41
Cn1ncnc1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000853800031	CC	On-Demand	Anodyne	ADRB1	26	41
Cn1ncnc1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000853800031	CC	On-Demand	Anodyne	ADRB3	16	41
Cn1ncnc1C(=O)NC[C@@H](O)COc1cccc(F)c1	ZINC000853800031	CC	On-Demand	Anodyne	PDS	47	42
C#CCCCNC(=O)N1CCNC(=O)[C@@H]1c1cccc(C)c1	ZINC000853800057	CD	On-Demand	Mild	ADRA1D	20	44
C#CCCCNC(=O)N1CCNC(=O)[C@@H]1c1cccc(C)c1	ZINC000853800057	CD	On-Demand	Mild	ADRA1B	23	44
C#CCCCNC(=O)N1CCNC(=O)[C@H]1c1cccc(C)c1	ZINC000853800059	CD	On-Demand	Mild	ADRA1D	20	44
C#CCCCNC(=O)N1CCNC(=O)[C@H]1c1cccc(C)c1	ZINC000853800059	CD	On-Demand	Mild	ADRA1B	23	44
CCn1c(CNC(=O)c2ncnn2C)nc2ccccc21	ZINC000853800094	CD	On-Demand	Anodyne	PYGM	24	42
COCc1nc(C(=O)N(C)Cc2ccc(N3CCOCC3)cc2)n(C)n1	ZINC000853800115	FD	On-Demand	Clean	EPHB4	60	34
C#CCCCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853800119	CD	On-Demand	Mild	L3MBTL3	50	38
C#CCCCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853800120	CD	On-Demand	Mild	L3MBTL3	50	38
CCn1c(CNC(=O)c2nc(COC)nn2C)nc2ccccc21	ZINC000853800128	ED	On-Demand	Anodyne	PYGM	17	40
C#CCCCNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1	ZINC000853800200	DD	On-Demand	Mild	CPT1A	47	33
C#CCCCNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1	ZINC000853800203	DD	On-Demand	Mild	CPT1A	47	33
Cn1ncnc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000853800219	DC	On-Demand	Bother	SLC6A9	17	42
Cn1ncnc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000853800219	DC	On-Demand	Bother	SSTR1	45	42
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853800263	DD	On-Demand	Anodyne	CACNA1I	45	35
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000853800264	DD	On-Demand	Anodyne	CACNA1I	45	35
O=C(NCc1nnnn1C1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853800271	FE	On-Demand	Reactive	CSNK1D	24	40
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853800313	EE	On-Demand	Bother	TAAR1	19	41
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853800314	EE	On-Demand	Bother	TAAR1	19	41
CCC(CC)(CNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1)SC	ZINC000853800315	FG	On-Demand	Anodyne	CPT1A	66	35
CCC(CC)(CNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1)SC	ZINC000853800316	FG	On-Demand	Anodyne	CPT1A	66	35
Cn1ncnc1C(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000853800318	DD	On-Demand	Anodyne	CNR1	15	40
Cn1ncnc1C(=O)NC1CCN(CC2CCCCC2)CC1	ZINC000853800318	DD	On-Demand	Anodyne	HTR4	25	41
CCC(CC)(CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)SC	ZINC000853800338	EF	On-Demand	Anodyne	CPT1A	92	37
CCC(CC)(CNC(=O)N1CCCC[C@H]1c1nc[nH]n1)SC	ZINC000853800339	EF	On-Demand	Anodyne	CPT1A	92	37
O=C(c1ccc(N[C@H]2C=CCC2)nc1)N1CCc2ccccc21	ZINC000853800343	DG	On-Demand	Anodyne	AVPR2	105	43
O=C(c1ccc(N[C@H]2C=CCC2)nc1)N1CCc2ccccc21	ZINC000853800343	DG	On-Demand	Anodyne	AVPR1A	65	43
O=C(c1ccc(N[C@@H]2C=CCC2)nc1)N1CCc2ccccc21	ZINC000853800344	DG	On-Demand	Anodyne	AVPR2	105	43
O=C(c1ccc(N[C@@H]2C=CCC2)nc1)N1CCc2ccccc21	ZINC000853800344	DG	On-Demand	Anodyne	AVPR1A	65	43
CCC(CC)(CNC(=O)NC(C)(C)c1cccc(C#N)c1)SC	ZINC000853800366	EI	On-Demand	Mild	IMDH_CRYPV	51	33
Cn1ncnc1C(=O)N1CCC([C@@H]2CCCN2C(=O)OC(C)(C)C)CC1	ZINC000853800381	FE	On-Demand	Anodyne	GPR119	26	42
Cn1ncnc1C(=O)N1CCC([C@H]2CCCN2C(=O)OC(C)(C)C)CC1	ZINC000853800384	FE	On-Demand	Anodyne	GPR119	26	42
C#CCCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853800437	DD	On-Demand	Mild	HRH2	24	43
C#CCCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853800437	DD	On-Demand	Mild	SIGMAR1	17	43
C#CCCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853800437	DD	On-Demand	Mild	CCR3	29	44
C#CCCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853800439	DD	On-Demand	Mild	HRH2	24	43
C#CCCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853800439	DD	On-Demand	Mild	SIGMAR1	17	43
C#CCCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853800439	DD	On-Demand	Mild	CCR3	29	44
Cn1ncnc1C(=O)NC[C@H](O)c1cccc(F)c1	ZINC000853800471	CC	On-Demand	Anodyne	SCD	19	43
Cn1ncnc1C(=O)NC[C@@H](O)c1cccc(F)c1	ZINC000853800472	CC	On-Demand	Anodyne	SCD	19	43
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CCSC1	ZINC000853800556	EG	On-Demand	Reactive	LCK	21	43
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@H]1CCSC1	ZINC000853800557	EG	On-Demand	Reactive	LCK	21	43
COc1ccc(N2CCC(NC(=O)c3ncnn3C)CC2)cc1	ZINC000853800603	DD	On-Demand	Clean	PDK1	40	34
C1=C[C@@H](Nc2ncnc3c2ncn3C2CC2)CC1	ZINC000853800610	BE	On-Demand	Anodyne	ADORA1	43	43
C1=C[C@@H](Nc2ncnc3c2ncn3C2CC2)CC1	ZINC000853800610	BE	On-Demand	Anodyne	ADORA3	28	41
C1=C[C@@H](Nc2ncnc3c2ncn3C2CC2)CC1	ZINC000853800610	BE	On-Demand	Anodyne	Q4VQ11_PIG	35	41
CS(=O)(=O)c1ccc2ncnc(N[C@H]3C=CCC3)c2c1	ZINC000853800613	CE	On-Demand	Anodyne	CD38	61	42
CS(=O)(=O)c1ccc2ncnc(N[C@@H]3C=CCC3)c2c1	ZINC000853800615	CE	On-Demand	Anodyne	CD38	61	42
CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1C=CCC1	ZINC000853800644	EE	On-Demand	Bother	TBXA2R	19	42
CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1C=CCC1	ZINC000853800645	EE	On-Demand	Bother	TBXA2R	19	42
Cn1ncnc1C(=O)NCC12CC3CC(CC(C3)C1)C2	ZINC000853800726	CD	On-Demand	Anodyne	P2RX7	20	47
CCOC(=O)N1CCC(NC(=O)c2ncnn2C)CC1	ZINC000853800728	CC	On-Demand	Anodyne	SSTR5	40	38
CCOC(=O)N1CCC(NC(=O)c2ncnn2C)CC1	ZINC000853800728	CC	On-Demand	Anodyne	CCR8	26	45
O=C(c1cc(N[C@@H]2C=CCC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000853800743	DF	On-Demand	Bother	L3MBTL3	50	45
O=C(c1cc(N[C@H]2C=CCC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000853800747	DF	On-Demand	Bother	L3MBTL3	50	45
O=C(c1cccnc1N[C@@H]1C=CCC1)N1CCCCC1	ZINC000853800880	CF	On-Demand	Anodyne	L3MBTL3	64	38
O=C(c1cccnc1N[C@H]1C=CCC1)N1CCCCC1	ZINC000853800881	CF	On-Demand	Anodyne	L3MBTL3	64	38
C1=C[C@@H](Nc2nccc(N3CCOCC3)n2)CC1	ZINC000853800882	BD	On-Demand	Anodyne	SMG1	30	40
Cn1ncnc1C(=O)NCc1ccccc1N1CCOCC1	ZINC000853800954	DC	On-Demand	Anodyne	SCN2A	17	40
Cn1ncnc1C(=O)NCc1ccccc1N1CCOCC1	ZINC000853800954	DC	On-Demand	Anodyne	SCN10A	25	52
Cc1nc(SCC(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)c2c(C)c(C)sc2n1	ZINC000853800957	JI	On-Demand	Anodyne	GRPR	42	31
Cc1nc(SCC(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)c2c(C)c(C)sc2n1	ZINC000853800958	JI	On-Demand	Anodyne	GRPR	42	31
O=C(c1ccc(N[C@@H]2C=CCC2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000853800997	DE	On-Demand	Bother	L3MBTL3	26	44
O=S(=O)(c1ccc(N[C@@H]2C=CCC2)nc1)N1CCCC1	ZINC000853801012	CD	On-Demand	Anodyne	TGM2	37	42
O=S(=O)(c1ccc(N[C@H]2C=CCC2)nc1)N1CCCC1	ZINC000853801013	CD	On-Demand	Anodyne	TGM2	37	42
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(Br)c1	ZINC000853801027	FE	On-Demand	Anodyne	MTNR1A	24	48
CON(C)CCNC(=O)NC[C@@H](C)Oc1cccc(Br)c1	ZINC000853801027	FE	On-Demand	Anodyne	MTNR1B	18	48
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(Br)c1	ZINC000853801028	FE	On-Demand	Anodyne	MTNR1A	24	48
CON(C)CCNC(=O)NC[C@H](C)Oc1cccc(Br)c1	ZINC000853801028	FE	On-Demand	Anodyne	MTNR1B	18	48
Cn1ncnc1C(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000853801048	DD	On-Demand	Anodyne	ACACB	15	40
Cn1ncnc1C(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000853801048	DD	On-Demand	Anodyne	CACNA1I	49	38
Cn1ncnc1C(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000853801048	DD	On-Demand	Anodyne	SIRT3	29	40
Cn1ncnc1C(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000853801048	DD	On-Demand	Anodyne	SIRT2	24	40
Cn1ncnc1C(=O)N1CCC(CNC(=O)OC(C)(C)C)CC1	ZINC000853801048	DD	On-Demand	Anodyne	SIRT1	24	40
Cn1ncnc1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853801066	DD	On-Demand	Anodyne	CACNA1I	77	42
Cn1ncnc1C(=O)NCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853801066	DD	On-Demand	Anodyne	GPR119	53	44
O=c1c(Cl)c(N[C@@H]2C=CCC2)cnn1Cc1ccccc1	ZINC000853801105	DG	On-Demand	Anodyne	NPBWR1	28	40
O=c1c(Cl)c(N[C@H]2C=CCC2)cnn1Cc1ccccc1	ZINC000853801106	DG	On-Demand	Anodyne	NPBWR1	28	40
O=C(c1cnc(N[C@@H]2C=CCC2)c(Cl)c1)N1CCCCC1	ZINC000853801109	DG	On-Demand	Anodyne	L3MBTL3	60	38
O=C(c1cnc(N[C@H]2C=CCC2)c(Cl)c1)N1CCCCC1	ZINC000853801110	DG	On-Demand	Anodyne	L3MBTL3	60	38
O=C(NC1CC1)c1cc(N[C@@H]2C=CCC2)nc2ccccc12	ZINC000853801145	CG	On-Demand	Anodyne	TNKS	55	31
O=C(NC1CC1)c1cc(N[C@H]2C=CCC2)nc2ccccc12	ZINC000853801146	CG	On-Demand	Anodyne	TNKS	55	31
CCC(CC)(CNC(=O)N[C@@H](COC)c1cccc(OC)c1)SC	ZINC000853801160	FH	On-Demand	Anodyne	MTNR1A	36	40
CCC(CC)(CNC(=O)N[C@@H](COC)c1cccc(OC)c1)SC	ZINC000853801160	FH	On-Demand	Anodyne	MTNR1B	37	40
CCC(CC)(CNC(=O)N[C@H](COC)c1cccc(OC)c1)SC	ZINC000853801161	FH	On-Demand	Anodyne	MTNR1A	36	40
CCC(CC)(CNC(=O)N[C@H](COC)c1cccc(OC)c1)SC	ZINC000853801161	FH	On-Demand	Anodyne	MTNR1B	37	40
Cn1ncnc1C(=O)NC[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853801168	DD	On-Demand	Anodyne	CACNA1I	68	39
Cn1ncnc1C(=O)NC[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000853801169	DD	On-Demand	Anodyne	CACNA1I	68	39
CN(C)CCCNS(=O)(=O)c1ccc(N[C@@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853801189	FD	On-Demand	Bother	BCL2L1	73	33
CN(C)CCCNS(=O)(=O)c1ccc(N[C@@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853801189	FD	On-Demand	Bother	BCL2	54	32
CN(C)CCCNS(=O)(=O)c1ccc(N[C@@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853801189	FD	On-Demand	Bother	BCL2L2	44	31
CN(C)CCCNS(=O)(=O)c1ccc(N[C@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853801190	FD	On-Demand	Bother	BCL2L1	73	33
CN(C)CCCNS(=O)(=O)c1ccc(N[C@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853801190	FD	On-Demand	Bother	BCL2	54	32
CN(C)CCCNS(=O)(=O)c1ccc(N[C@H]2C=CCC2)c([N+](=O)[O-])c1	ZINC000853801190	FD	On-Demand	Bother	BCL2L2	44	31
O=C(NC1CC1)c1ccc(N[C@@H]2C=CCC2)nc1	ZINC000853801206	BE	On-Demand	Anodyne	SSTR5	19	40
O=C(NC1CC1)c1ccc(N[C@H]2C=CCC2)nc1	ZINC000853801207	BE	On-Demand	Anodyne	SSTR5	19	40
Cn1ncnc1C(=O)NCC1(NC(=O)OC(C)(C)C)CCCCC1	ZINC000853801229	ED	On-Demand	Anodyne	HCN1	49	30
Cn1ncnc1C(=O)NCC1(NC(=O)OC(C)(C)C)CCCCC1	ZINC000853801229	ED	On-Demand	Anodyne	HCN4	47	30
NS(=O)(=O)c1ccc(N[C@@H]2C=CCC2)c(C(F)(F)F)c1	ZINC000853801237	DE	On-Demand	Anodyne	CA2	18	43
NS(=O)(=O)c1ccc(N[C@H]2C=CCC2)c(C(F)(F)F)c1	ZINC000853801238	DE	On-Demand	Anodyne	CA2	18	43
Cn1ncnc1C(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000853801301	DE	On-Demand	Anodyne	HRH4	19	45
Cn1ncnc1C(=O)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000853801301	DE	On-Demand	Anodyne	AKR1C3	18	43
CCC(CC)(CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)SC	ZINC000853801304	GF	On-Demand	Anodyne	SIGMAR1	17	40
CCC(CC)(CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)SC	ZINC000853801305	GF	On-Demand	Anodyne	SIGMAR1	17	40
CCC(CC)(CNC(=O)N(C)[C@H](CO)Cc1ccccc1)SC	ZINC000853801317	EG	On-Demand	Anodyne	NPY5R	20	44
CCC(CC)(CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)SC	ZINC000853801318	EG	On-Demand	Anodyne	NPY5R	20	44
CCC(CC)(CNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1)SC	ZINC000853801413	FH	On-Demand	Anodyne	SLC6A3	15	43
O=S(=O)(c1ccc(N[C@@H]2C=CCC2)nc1)N1CCCCC1	ZINC000853801459	DE	On-Demand	Anodyne	TGM2	35	42
O=S(=O)(c1ccc(N[C@H]2C=CCC2)nc1)N1CCCCC1	ZINC000853801460	DE	On-Demand	Anodyne	TGM2	35	42
Cn1ncnc1C(=O)NC[C@@](O)(c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000853801522	GE	On-Demand	Anodyne	PDS	40	31
Cn1ncnc1C(=O)NC[C@](O)(c1cccc(C(F)(F)F)c1)C(F)(F)F	ZINC000853801523	GE	On-Demand	Anodyne	PDS	40	31
Fc1cnc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)cn1	ZINC000853801538	EG	On-Demand	Anodyne	BCL2A1	42	33
Cc1ccccc1[C@@H](O)CNC(=O)c1ncnn1C	ZINC000853801542	CC	On-Demand	Anodyne	CTSA	43	33
CC[C@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801583	ED	On-Demand	Mild	ROCK1	25	40
CC[C@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801583	ED	On-Demand	Mild	ROCK2	24	40
CC[C@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801583	ED	On-Demand	Mild	CTSV	41	34
CC[C@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801583	ED	On-Demand	Mild	PDS	40	35
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801584	ED	On-Demand	Mild	ROCK1	25	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801584	ED	On-Demand	Mild	ROCK2	24	40
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801584	ED	On-Demand	Mild	CTSV	41	34
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2nc(COC)nn2C)c1	ZINC000853801584	ED	On-Demand	Mild	PDS	40	35
Cn1ncnc1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801592	DD	On-Demand	Anodyne	CACNA1I	43	35
Cn1ncnc1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801592	DD	On-Demand	Anodyne	SIRT3	48	39
Cn1ncnc1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801592	DD	On-Demand	Anodyne	SIRT2	50	39
Cn1ncnc1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801592	DD	On-Demand	Anodyne	SIRT1	49	39
Cn1ncnc1C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801592	DD	On-Demand	Anodyne	GPR119	44	40
Cn1ncnc1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801593	DD	On-Demand	Anodyne	CACNA1I	43	35
Cn1ncnc1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801593	DD	On-Demand	Anodyne	SIRT3	48	39
Cn1ncnc1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801593	DD	On-Demand	Anodyne	SIRT2	50	39
Cn1ncnc1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801593	DD	On-Demand	Anodyne	SIRT1	49	39
Cn1ncnc1C(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801593	DD	On-Demand	Anodyne	GPR119	44	40
CCc1nncn1CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853801625	FE	On-Demand	Reactive	CSNK1D	29	40
Cn1ncnc1C(=O)N[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801626	CC	On-Demand	Anodyne	GPR119	43	41
Cn1ncnc1C(=O)N[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853801627	CC	On-Demand	Anodyne	GPR119	43	41
COc1ccc(O)c([C@@H](C)NC(=O)c2ncnn2C)c1	ZINC000853801642	CD	On-Demand	Clean	THRA	54	33
COc1ccc(O)c([C@@H](C)NC(=O)c2ncnn2C)c1	ZINC000853801642	CD	On-Demand	Clean	THRB	56	35
COc1ccc(O)c([C@H](C)NC(=O)c2ncnn2C)c1	ZINC000853801643	CD	On-Demand	Clean	THRA	54	33
COc1ccc(O)c([C@H](C)NC(=O)c2ncnn2C)c1	ZINC000853801643	CD	On-Demand	Clean	THRB	56	35
Cn1ncnc1C(=O)NC[C@H](O)c1cccc(C(F)(F)F)c1	ZINC000853801665	DD	On-Demand	Anodyne	PDS	43	35
Cn1ncnc1C(=O)NC[C@@H](O)c1cccc(C(F)(F)F)c1	ZINC000853801666	DD	On-Demand	Anodyne	PDS	43	35
COc1ccc(O)c(CNC(=O)c2ncnn2C)c1	ZINC000853801669	CC	On-Demand	Clean	MTNR1A	36	44
COc1ccc(O)c(CNC(=O)c2ncnn2C)c1	ZINC000853801669	CC	On-Demand	Clean	MTNR1B	28	44
C=CC[C@@H]1CCCN(c2ccnc(C(C)C)n2)C1	ZINC000853801672	BG	On-Demand	Mild	SORD	125	45
C=CC[C@H]1CCCN(c2ccnc(C(C)C)n2)C1	ZINC000853801673	BG	On-Demand	Mild	SORD	125	45
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCN1c1cc(NC)ncn1	ZINC000853801691	FD	On-Demand	Mild	ACKR3	49	30
C#CCCN(CCOC)C(=O)NC[C@H]1CCCN1c1cc(NC)ncn1	ZINC000853801692	FD	On-Demand	Mild	ACKR3	49	30
COC(=O)c1cccc(N2CCC(C3CCC3)CC2)n1	ZINC000853801693	CF	On-Demand	Anodyne	HSD11B1	17	45
CO[C@H](CNC(=O)N1CCC(N2CCOC2=O)CC1)c1cccc(Cl)c1	ZINC000853801700	GF	On-Demand	Anodyne	CYP3A4	47	36
C#CCNC(=O)c1ccc(N2CCC(C3CCC3)CC2)nc1	ZINC000853801703	CE	On-Demand	Mild	FASN	16	40
C#CCNC(=O)c1ccc(N2CCC(C3CCC3)CC2)nc1	ZINC000853801703	CE	On-Demand	Mild	SCD1	20	41
C#CCNC(=O)c1ccc(N2CCC(C3CCC3)CC2)nc1	ZINC000853801703	CE	On-Demand	Mild	HPGDS	28	48
Cc1nc(N2CCN(c3ccc(Cl)cc3Cl)CC2)c2cnn(C)c2n1	ZINC000853801715	GG	On-Demand	Anodyne	HRH4	19	42
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853801724	GD	On-Demand	Anodyne	CCR5	21	41
Cn1ccnc1C[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853801725	GD	On-Demand	Anodyne	CCR5	21	41
Cn1ccnc1C[C@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853801726	GD	On-Demand	Anodyne	CCR5	21	41
Cn1ccnc1C[C@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccccc1	ZINC000853801727	GD	On-Demand	Anodyne	CCR5	21	41
CC[C@H](C#N)Oc1cccc(CNC(=O)c2ncnn2C)c1	ZINC000853801730	CD	On-Demand	Mild	PDS	57	39
CC[C@@H](C#N)Oc1cccc(CNC(=O)c2ncnn2C)c1	ZINC000853801731	CD	On-Demand	Mild	PDS	57	39
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C2CCC2)CC1	ZINC000853801771	DF	On-Demand	Bother	WDR5	37	42
C=CC[C@@H]1CCCN(c2nc(Cl)c(C(=O)OC)s2)C1	ZINC000853801786	DG	On-Demand	Mild	PARE	81	33
C=CC[C@H]1CCCN(c2nc(Cl)c(C(=O)OC)s2)C1	ZINC000853801787	DG	On-Demand	Mild	PARE	81	33
CO[C@]1(CO)CCCN(c2cc(OCc3ccccc3)ncn2)C1	ZINC000853801810	EE	On-Demand	Anodyne	SLC12A5	64	35
Cn1ccnc1C[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853801832	GE	On-Demand	Anodyne	CCR5	15	41
Cn1ccnc1C[C@@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853801832	GE	On-Demand	Anodyne	CALCRL	45	43
Cn1ccnc1C[C@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853801833	GE	On-Demand	Anodyne	CCR5	15	41
Cn1ccnc1C[C@H](NC(=O)N1CCC(N2CCOC2=O)CC1)c1ccccc1	ZINC000853801833	GE	On-Demand	Anodyne	CALCRL	45	43
C=CC[C@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853801839	CF	On-Demand	Mild	SORD	57	38
C=CC[C@@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853801840	CF	On-Demand	Mild	SORD	57	38
Cn1ncnc1C(=O)NCC1CCN(S(=O)(=O)C(F)F)CC1	ZINC000853801854	EB	On-Demand	Anodyne	CACNA1I	56	36
Cn1ncnc1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853801857	EC	On-Demand	Anodyne	SLC6A3	15	41
Cn1ncnc1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853801857	EC	On-Demand	Anodyne	HTR4	72	42
Cn1ncnc1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853801857	EC	On-Demand	Anodyne	GRIN2B	32	43
Cn1ncnc1C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853801857	EC	On-Demand	Anodyne	CACNA1I	69	40
Cn1ncnc1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853801858	EC	On-Demand	Anodyne	SLC6A3	15	41
Cn1ncnc1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853801858	EC	On-Demand	Anodyne	HTR4	72	42
Cn1ncnc1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853801858	EC	On-Demand	Anodyne	GRIN2B	32	43
Cn1ncnc1C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853801858	EC	On-Demand	Anodyne	CACNA1I	69	40
C=CC[C@@H]1CCCN(c2nccc(C)n2)C1	ZINC000853801860	BF	On-Demand	Mild	SORD	21	40
C=CC[C@H]1CCCN(c2nccc(C)n2)C1	ZINC000853801861	BF	On-Demand	Mild	SORD	21	40
CON(C)CCNC(=O)N[C@H](C)c1cccc(-n2ccnc2)c1	ZINC000853801865	DD	On-Demand	Anodyne	CYP26A1	45	34
CON(C)CCNC(=O)N[C@@H](C)c1cccc(-n2ccnc2)c1	ZINC000853801866	DD	On-Demand	Anodyne	CYP26A1	45	34
NC(=O)c1cc(N2CCN(c3ccc(Cl)cc3Cl)CC2)ccn1	ZINC000853801876	FF	On-Demand	Anodyne	CNR1	52	32
COC(=O)CN1CCN(c2ccc(NC(=O)c3ncnn3C)cc2)CC1	ZINC000853801893	FC	On-Demand	Anodyne	PRNP	49	43
CN(C)C(=O)c1cc(N2CCN(c3ccc(Cl)cc3Cl)CC2)ccn1	ZINC000853801906	GG	On-Demand	Anodyne	CNR1	40	30
CC(C)(C)OC(=O)CCCCCNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853801913	FG	On-Demand	Anodyne	EPHX2	24	52
CC(C)(C)OC(=O)CCCCCNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853801914	FG	On-Demand	Anodyne	EPHX2	24	52
CC(C)(C)OC(=O)CCCCCNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853801915	FG	On-Demand	Anodyne	EPHX2	24	52
CC(C)(C)OC(=O)CCCCCNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853801916	FG	On-Demand	Anodyne	EPHX2	24	52
Cn1ncnc1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000853801963	DC	On-Demand	Anodyne	Q8WSF8_APLCA	41	38
Cn1ncnc1C(=O)N1CCN(Cc2ccc(Cl)nc2)CC1	ZINC000853801963	DC	On-Demand	Anodyne	NACHRBETA2	53	38
Cn1ncnc1C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000853801988	CE	On-Demand	Anodyne	SLC18A3	42	40
Cn1ncnc1C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000853801988	CE	On-Demand	Anodyne	L3MBTL3	43	34
Cn1ncnc1C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000853801989	CE	On-Demand	Anodyne	SLC18A3	42	40
Cn1ncnc1C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000853801989	CE	On-Demand	Anodyne	L3MBTL3	43	34
C=CC[C@@H]1CCCN(c2cc(Cl)nc(N)n2)C1	ZINC000853802000	CF	On-Demand	Mild	HRH4	45	41
C=CC[C@H]1CCCN(c2cc(Cl)nc(N)n2)C1	ZINC000853802001	CF	On-Demand	Mild	HRH4	45	41
Cn1ncnc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1	ZINC000853802019	GD	On-Demand	Bother	SLC6A9	21	47
CN(C)C(=O)c1cc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)ccn1	ZINC000853802033	GG	On-Demand	Anodyne	BCL2A1	52	36
CN(C)C(=O)c1cc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)ccn1	ZINC000853802033	GG	On-Demand	Anodyne	RPA1	50	37
c1cc(N2CCCC2)nc(N2CCC(C3CCC3)CC2)n1	ZINC000853802036	CG	On-Demand	Anodyne	SORD	78	41
C=CC[C@@H]1CCCN(c2ccc(-c3nc(C)no3)cn2)C1	ZINC000853802050	CG	On-Demand	Mild	SCARB1	54	33
C=CC[C@H]1CCCN(c2ccc(-c3nc(C)no3)cn2)C1	ZINC000853802051	CG	On-Demand	Mild	SCARB1	54	33
Cn1ncnc1C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000853802090	DD	On-Demand	Anodyne	NPFFR1	42	38
Cn1ncnc1C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000853802090	DD	On-Demand	Anodyne	HCN1	44	34
Cn1ncnc1C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000853802093	DD	On-Demand	Anodyne	NPFFR1	42	38
Cn1ncnc1C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000853802093	DD	On-Demand	Anodyne	HCN1	44	34
Cn1ncnc1C(=O)NCC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000853802104	FC	On-Demand	Anodyne	CACNA1I	66	39
Cn1ncnc1C(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1	ZINC000853802118	ED	On-Demand	Clean	DRD4	17	42
Cn1ncnc1C(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1	ZINC000853802121	ED	On-Demand	Clean	DRD4	17	42
C[C@@H](NC(=O)N1CCC2(COC2)C1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853802130	FF	On-Demand	Anodyne	CCR1	42	35
NC(=O)c1cc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)ccn1	ZINC000853802141	FF	On-Demand	Anodyne	BCL2A1	53	37
NC(=O)c1cc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)ccn1	ZINC000853802141	FF	On-Demand	Anodyne	RPA1	51	39
NC(=O)c1cc(Cl)nnc1N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853802152	GF	On-Demand	Anodyne	CNR1	53	33
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	GRIN2B	70	49
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	PREP	25	42
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	CAPNS1	56	33
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	CAPN1	57	40
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	CAPN2	93	40
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	TGM2	34	46
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	TPSAB1	26	40
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	NPR	57	33
Cn1ncnc1C(=O)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000853802215	FD	On-Demand	Anodyne	F13A1	25	46
COC(=O)c1cccc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853802229	FH	On-Demand	Anodyne	DRD4	42	35
COC(=O)c1cccc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853802229	FH	On-Demand	Anodyne	HSD11B1	15	42
COC(=O)c1cccc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853802229	FH	On-Demand	Anodyne	CCKAR	19	45
COC(=O)c1cccc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853802229	FH	On-Demand	Anodyne	BCL2A1	52	36
COC(=O)c1cccc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)n1	ZINC000853802229	FH	On-Demand	Anodyne	RPA1	63	39
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](C)O)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853802239	FG	On-Demand	Anodyne	CPT1A	25	42
C[C@@H](NC(=O)N(CCC1CC1)CC1CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853802245	GJ	On-Demand	Anodyne	SPHK1	29	42
CN(CC1CCN(C[C@H](O)c2ccccc2)CC1)C(=O)c1ncnn1C	ZINC000853802327	FD	On-Demand	Anodyne	OPRK1	28	40
CN(CC1CCN(C[C@@H](O)c2ccccc2)CC1)C(=O)c1ncnn1C	ZINC000853802328	FD	On-Demand	Anodyne	OPRK1	28	40
COCc1cc([N+](=O)[O-])ccc1N1CC[C@@H](O)C(F)(F)C1	ZINC000853802347	DD	On-Demand	Bother	CACNA1C	40	35
COCc1cc([N+](=O)[O-])ccc1N1CC[C@@H](O)C(F)(F)C1	ZINC000853802347	DD	On-Demand	Bother	CACNA1D	65	35
COCc1cc([N+](=O)[O-])ccc1N1CC[C@H](O)C(F)(F)C1	ZINC000853802348	DD	On-Demand	Bother	CACNA1C	40	35
COCc1cc([N+](=O)[O-])ccc1N1CC[C@H](O)C(F)(F)C1	ZINC000853802348	DD	On-Demand	Bother	CACNA1D	65	35
CN(CC1=CCSC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802394	GF	On-Demand	Anodyne	CACNA1I	53	36
CN(CC1=CCSC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802395	GF	On-Demand	Anodyne	CACNA1I	53	36
O=[N+]([O-])c1ccc(N2CC[C@@H](O)C(F)(F)C2)c2nonc12	ZINC000853802406	DD	On-Demand	Bother	GSTM2	107	39
O=[N+]([O-])c1ccc(N2CC[C@@H](O)C(F)(F)C2)c2nonc12	ZINC000853802406	DD	On-Demand	Bother	GSTP1	63	39
O=[N+]([O-])c1ccc(N2CC[C@H](O)C(F)(F)C2)c2nonc12	ZINC000853802407	DD	On-Demand	Bother	GSTM2	107	39
O=[N+]([O-])c1ccc(N2CC[C@H](O)C(F)(F)C2)c2nonc12	ZINC000853802407	DD	On-Demand	Bother	GSTP1	63	39
Fc1cc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)ncn1	ZINC000853802428	EG	On-Demand	Anodyne	BCL2A1	42	33
C#Cc1cnc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)nc1	ZINC000853802442	EG	On-Demand	Mild	BCL2A1	41	33
NC(=O)c1cc(Cl)nnc1N1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853802454	GF	On-Demand	Anodyne	BCL2A1	51	36
NC(=O)c1cc(Cl)nnc1N1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853802454	GF	On-Demand	Anodyne	RPA1	41	35
Cn1ncnc1C(=O)NC[C@@]1(O)CCCc2ccccc21	ZINC000853802472	CC	On-Demand	Anodyne	HCN1	62	35
Cn1ncnc1C(=O)NC[C@@]1(O)CCCc2ccccc21	ZINC000853802472	CC	On-Demand	Anodyne	HCN4	47	31
Cn1ncnc1C(=O)NC[C@]1(O)CCCc2ccccc21	ZINC000853802473	CC	On-Demand	Anodyne	HCN1	62	35
Cn1ncnc1C(=O)NC[C@]1(O)CCCc2ccccc21	ZINC000853802473	CC	On-Demand	Anodyne	HCN4	47	31
NC(=O)c1cc(Cl)nnc1N1CCC(C2CCC2)CC1	ZINC000853802493	CE	On-Demand	Anodyne	SIRT3	42	34
Cn1ncnc1C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCCC1	ZINC000853802578	FE	On-Demand	Anodyne	REN	49	37
Cn1ncnc1C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCCC1	ZINC000853802580	FE	On-Demand	Anodyne	REN	49	37
C[C@@H](CCNC(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1)N(C)C	ZINC000853802581	FG	On-Demand	Anodyne	UTS2	44	34
C[C@@H](NC(=O)NCC[C@@H](C)N(C)C)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853802583	FG	On-Demand	Anodyne	UTS2	44	34
Cn1ncnc1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000853802587	EC	On-Demand	Reactive	MAPK14	35	41
Cn1ncnc1C(=O)NNc1c(F)cc(C(=O)NC2CC2)cc1F	ZINC000853802587	EC	On-Demand	Reactive	MAPK13	86	39
CN1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802603	GD	On-Demand	Anodyne	SLC6A3	16	40
CN1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802603	GD	On-Demand	Anodyne	HTR4	54	37
CN1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802603	GD	On-Demand	Anodyne	GRIN2B	23	42
CN1CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802603	GD	On-Demand	Anodyne	CACNA1I	51	36
CN1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802609	GD	On-Demand	Anodyne	SLC6A3	16	40
CN1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802609	GD	On-Demand	Anodyne	HTR4	54	37
CN1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802609	GD	On-Demand	Anodyne	GRIN2B	23	42
CN1CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCC1=O	ZINC000853802609	GD	On-Demand	Anodyne	CACNA1I	51	36
C[C@@H](CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802615	GE	On-Demand	Anodyne	OPRK1	30	40
C[C@@H](CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802615	GE	On-Demand	Anodyne	HTR4	50	37
C[C@@H](CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802615	GE	On-Demand	Anodyne	CCR3	17	40
C[C@@H](CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802615	GE	On-Demand	Anodyne	CCR5	46	38
C[C@@H](CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802615	GE	On-Demand	Anodyne	CACNA1I	58	41
C[C@@H](CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802622	GE	On-Demand	Anodyne	OPRK1	30	40
C[C@@H](CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802622	GE	On-Demand	Anodyne	HTR4	50	37
C[C@@H](CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802622	GE	On-Demand	Anodyne	CCR3	17	40
C[C@@H](CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802622	GE	On-Demand	Anodyne	CCR5	46	38
C[C@@H](CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(C)C	ZINC000853802622	GE	On-Demand	Anodyne	CACNA1I	58	41
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802651	FG	On-Demand	Anodyne	OPRD1	21	45
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802651	FG	On-Demand	Anodyne	SLC6A3	18	40
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802651	FG	On-Demand	Anodyne	HTR4	69	41
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802651	FG	On-Demand	Anodyne	GRIN2B	15	45
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802651	FG	On-Demand	Anodyne	CCR5	35	42
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802651	FG	On-Demand	Anodyne	CACNA1I	60	43
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802656	FG	On-Demand	Anodyne	OPRD1	21	45
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802656	FG	On-Demand	Anodyne	SLC6A3	18	40
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802656	FG	On-Demand	Anodyne	HTR4	69	41
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802656	FG	On-Demand	Anodyne	GRIN2B	15	45
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802656	FG	On-Demand	Anodyne	CCR5	35	42
CC[C@H](C)N(CC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802656	FG	On-Demand	Anodyne	CACNA1I	60	43
N#CC1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCCCC1	ZINC000853802675	GG	On-Demand	Mild	CCR3	15	41
N#CC1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCCCC1	ZINC000853802675	GG	On-Demand	Mild	HCN1	50	32
N#CC1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCCCC1	ZINC000853802675	GG	On-Demand	Mild	HCN4	48	32
N#CC1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCCCC1	ZINC000853802679	GG	On-Demand	Mild	CCR3	15	41
N#CC1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCCCC1	ZINC000853802679	GG	On-Demand	Mild	HCN1	50	32
N#CC1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCCCC1	ZINC000853802679	GG	On-Demand	Mild	HCN4	48	32
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802724	ED	On-Demand	Anodyne	SLC6A3	22	41
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802724	ED	On-Demand	Anodyne	HTR4	67	37
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802724	ED	On-Demand	Anodyne	GRIN2B	17	46
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802724	ED	On-Demand	Anodyne	CCR3	30	44
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802724	ED	On-Demand	Anodyne	CACNA1I	65	41
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802726	ED	On-Demand	Anodyne	SLC6A3	22	41
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802726	ED	On-Demand	Anodyne	HTR4	67	37
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802726	ED	On-Demand	Anodyne	GRIN2B	17	46
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802726	ED	On-Demand	Anodyne	CCR3	30	44
CC[C@@H](O)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802726	ED	On-Demand	Anodyne	CACNA1I	65	41
O=C(NCCc1ccoc1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802746	FF	On-Demand	Anodyne	HTR4	40	36
O=C(NCCc1ccoc1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802746	FF	On-Demand	Anodyne	CCR3	15	43
O=C(NCCc1ccoc1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802746	FF	On-Demand	Anodyne	CACNA1I	45	34
O=C(NCCc1ccoc1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802748	FF	On-Demand	Anodyne	HTR4	40	36
O=C(NCCc1ccoc1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802748	FF	On-Demand	Anodyne	CCR3	15	43
O=C(NCCc1ccoc1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802748	FF	On-Demand	Anodyne	CACNA1I	45	34
Cn1ncnc1C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853802753	ED	On-Demand	Anodyne	SOAT1	18	56
Cn1ncnc1C(=O)NC[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853802755	ED	On-Demand	Anodyne	SOAT1	18	56
Cn1ncnc1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853802756	CD	On-Demand	Anodyne	L3MBTL3	63	36
CO[C@]1(CO)CCCN(c2ccc(-c3nc(C)no3)cn2)C1	ZINC000853802781	DD	On-Demand	Anodyne	SCARB1	51	35
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802786	GG	On-Demand	Anodyne	SLC6A3	31	41
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802786	GG	On-Demand	Anodyne	HTR4	63	38
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802786	GG	On-Demand	Anodyne	GRIN2B	15	46
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802786	GG	On-Demand	Anodyne	CCR3	15	40
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802786	GG	On-Demand	Anodyne	CACNA1I	63	38
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802786	GG	On-Demand	Anodyne	Q8WSF8_APLCA	32	42
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802788	GG	On-Demand	Anodyne	SLC6A3	31	41
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802788	GG	On-Demand	Anodyne	HTR4	63	38
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802788	GG	On-Demand	Anodyne	GRIN2B	15	46
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802788	GG	On-Demand	Anodyne	CCR3	15	40
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802788	GG	On-Demand	Anodyne	CACNA1I	63	38
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802788	GG	On-Demand	Anodyne	Q8WSF8_APLCA	32	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802818	GF	On-Demand	Anodyne	SLC6A3	22	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802818	GF	On-Demand	Anodyne	HTR4	44	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802818	GF	On-Demand	Anodyne	GRIN2B	22	49
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802818	GF	On-Demand	Anodyne	CCR3	16	43
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802818	GF	On-Demand	Anodyne	CACNA1I	59	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802819	GF	On-Demand	Anodyne	SLC6A3	22	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802819	GF	On-Demand	Anodyne	HTR4	44	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802819	GF	On-Demand	Anodyne	GRIN2B	22	49
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802819	GF	On-Demand	Anodyne	CCR3	16	43
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NCC1SCCS1	ZINC000853802819	GF	On-Demand	Anodyne	CACNA1I	59	37
COC(=O)N(C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853802828	GD	On-Demand	Anodyne	CACNA1I	50	36
COC(=O)N(C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853802829	GD	On-Demand	Anodyne	CACNA1I	50	36
CCn1c(C)nc([N+](=O)[O-])c1NCc1ccc(Cl)c(C(=O)OC)n1	ZINC000853802916	FF	On-Demand	Bother	CACNA1D	42	32
CON(C)CCNC(=O)NCc1csc(-c2ccc(C(F)(F)F)cc2)n1	ZINC000853802953	GG	On-Demand	Anodyne	PPARA	17	45
Cn1ncnc1C(=O)N[C@@H]1Cc2ccc(Cl)cc2C1	ZINC000853802958	CD	On-Demand	Anodyne	CA7	16	45
Cn1ncnc1C(=O)N[C@H]1Cc2ccc(Cl)cc2C1	ZINC000853802959	CD	On-Demand	Anodyne	CA7	16	45
COC(=O)c1nc(CNc2nccc(N3CCOCC3)n2)ccc1Cl	ZINC000853802987	FD	On-Demand	Anodyne	EPHB4	76	37
COC(=O)c1nc(CNc2nccc(N3CCOCC3)n2)ccc1Cl	ZINC000853802987	FD	On-Demand	Anodyne	MRGPRX1	44	38
COc1ccc(CNC(=O)c2ncnn2C)c(O)c1	ZINC000853803020	CC	On-Demand	Clean	MT-CYB	41	33
Cn1ncnc1C(=O)N[C@H](CCO)Cc1ccccc1	ZINC000853803025	CC	On-Demand	Anodyne	MME	62	37
Cn1ncnc1C(=O)N[C@@H](CCO)Cc1ccccc1	ZINC000853803026	CC	On-Demand	Anodyne	MME	62	37
CO[C@]1(CO)CCCN(c2ccc(C(C)=O)cc2S(N)(=O)=O)C1	ZINC000853803053	EC	On-Demand	Anodyne	SLC12A5	41	33
C#CCNC(=O)c1ccc(N2CC[C@@H](O)C(F)(F)C2)nc1	ZINC000853803135	CC	On-Demand	Mild	HPGDS	26	42
C#CCNC(=O)c1ccc(N2CC[C@H](O)C(F)(F)C2)nc1	ZINC000853803136	CC	On-Demand	Mild	HPGDS	26	42
Cn1ncnc1C(=O)NCCCCCC(=O)OCc1ccccc1	ZINC000853803139	ED	On-Demand	Anodyne	NPR	56	37
Cn1ncnc1C(=O)NCCCCCC(=O)OCc1ccccc1	ZINC000853803139	ED	On-Demand	Anodyne	POLR1A	45	32
C=CCCC(C)(C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803172	FG	On-Demand	Mild	HTR4	46	35
C=CCCC(C)(C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803172	FG	On-Demand	Mild	CACNA1I	62	39
C=CCCC(C)(C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803174	FG	On-Demand	Mild	HTR4	46	35
C=CCCC(C)(C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803174	FG	On-Demand	Mild	CACNA1I	62	39
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803176	GG	On-Demand	Mild	SLC6A3	17	41
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803176	GG	On-Demand	Mild	HTR4	46	38
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803176	GG	On-Demand	Mild	GRIN2B	19	46
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803176	GG	On-Demand	Mild	CACNA1I	53	36
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803178	GG	On-Demand	Mild	SLC6A3	17	41
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803178	GG	On-Demand	Mild	HTR4	46	38
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803178	GG	On-Demand	Mild	GRIN2B	19	46
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803178	GG	On-Demand	Mild	CACNA1I	53	36
O=C(NCCCC1CCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803180	FG	On-Demand	Anodyne	ACHE	23	41
O=C(NCCCC1CCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803180	FG	On-Demand	Anodyne	OPRK1	16	40
O=C(NCCCC1CCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803180	FG	On-Demand	Anodyne	SLC6A3	21	42
O=C(NCCCC1CCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803180	FG	On-Demand	Anodyne	HTR4	48	38
O=C(NCCCC1CCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803180	FG	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCCCC1CCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803180	FG	On-Demand	Anodyne	CCR3	37	41
O=C(NCCCC1CCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803180	FG	On-Demand	Anodyne	CACNA1I	56	37
O=C(NCCCC1CCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803185	FG	On-Demand	Anodyne	ACHE	23	41
O=C(NCCCC1CCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803185	FG	On-Demand	Anodyne	OPRK1	16	40
O=C(NCCCC1CCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803185	FG	On-Demand	Anodyne	SLC6A3	21	42
O=C(NCCCC1CCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803185	FG	On-Demand	Anodyne	HTR4	48	38
O=C(NCCCC1CCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803185	FG	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCCCC1CCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803185	FG	On-Demand	Anodyne	CCR3	37	41
O=C(NCCCC1CCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803185	FG	On-Demand	Anodyne	CACNA1I	56	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(CO)(CO)C1	ZINC000853803187	GC	On-Demand	Anodyne	CACNA1I	42	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(CO)(CO)C1	ZINC000853803189	GC	On-Demand	Anodyne	CACNA1I	42	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853803191	GG	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853803191	GG	On-Demand	Anodyne	HTR4	41	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853803191	GG	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853803193	GG	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853803193	GG	On-Demand	Anodyne	HTR4	41	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853803193	GG	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853803195	GG	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853803195	GG	On-Demand	Anodyne	HTR4	41	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853803195	GG	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853803197	GG	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853803197	GG	On-Demand	Anodyne	HTR4	41	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853803197	GG	On-Demand	Anodyne	CACNA1I	57	36
COc1ccc(CNC(=O)c2ncnn2C)cc1Cl	ZINC000853803201	CD	On-Demand	Anodyne	PDE5A	54	47
COc1ccc(CNC(=O)c2ncnn2C)cc1Cl	ZINC000853803201	CD	On-Demand	Anodyne	PDE6A	54	41
COc1ccc(CNC(=O)c2ncnn2C)cc1Cl	ZINC000853803201	CD	On-Demand	Anodyne	DNAE	42	32
Cn1ncnc1C(=O)NCCc1ccc(Cl)nc1	ZINC000853803202	CC	On-Demand	Anodyne	NACHRBETA2	40	36
Cn1ncnc1C(=O)N1CC[C@@H]1Cc1ccccc1	ZINC000853803245	CD	On-Demand	Anodyne	SLC18A2	18	42
Cn1ncnc1C(=O)N1CC[C@H]1Cc1ccccc1	ZINC000853803246	CD	On-Demand	Anodyne	SLC18A2	18	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803247	GH	On-Demand	Anodyne	SLC6A3	16	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803247	GH	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803247	GH	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803247	GH	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803248	GH	On-Demand	Anodyne	SLC6A3	16	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803248	GH	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803248	GH	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803248	GH	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803249	GH	On-Demand	Anodyne	SLC6A3	16	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803249	GH	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803249	GH	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC[C@@H](C2CCC2)C1	ZINC000853803249	GH	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803250	GH	On-Demand	Anodyne	SLC6A3	16	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803250	GH	On-Demand	Anodyne	HTR4	46	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803250	GH	On-Demand	Anodyne	GRIN2B	16	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC[C@H](C2CCC2)C1	ZINC000853803250	GH	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1CCC[C@H]2C[C@@H]21	ZINC000853803255	GG	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1CCC[C@H]2C[C@H]21	ZINC000853803256	GG	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1CCC[C@@H]2C[C@@H]12	ZINC000853803257	GG	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H]1CCC[C@@H]2C[C@H]12	ZINC000853803258	GG	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803265	GE	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803265	GE	On-Demand	Anodyne	SLC6A3	25	44
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803265	GE	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803265	GE	On-Demand	Anodyne	GRIN2B	29	49
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803265	GE	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803265	GE	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803265	GE	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803266	GE	On-Demand	Anodyne	OPRK1	27	40
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803266	GE	On-Demand	Anodyne	SLC6A3	25	44
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803266	GE	On-Demand	Anodyne	HTR4	59	37
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803266	GE	On-Demand	Anodyne	GRIN2B	29	49
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803266	GE	On-Demand	Anodyne	CCR3	21	45
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803266	GE	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCC(O)CC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803266	GE	On-Demand	Anodyne	Q8WSF8_APLCA	23	40
COC1CC(CCNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803275	GF	On-Demand	Anodyne	ACHE	19	42
COC1CC(CCNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803275	GF	On-Demand	Anodyne	HTR4	54	37
COC1CC(CCNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803275	GF	On-Demand	Anodyne	CCR3	20	40
COC1CC(CCNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803275	GF	On-Demand	Anodyne	CACNA1I	54	36
COC1CC(CCNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803276	GF	On-Demand	Anodyne	ACHE	19	42
COC1CC(CCNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803276	GF	On-Demand	Anodyne	HTR4	54	37
COC1CC(CCNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803276	GF	On-Demand	Anodyne	CCR3	20	40
COC1CC(CCNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803276	GF	On-Demand	Anodyne	CACNA1I	54	36
Cn1ncnc1C(=O)NCCCCCCNC(=O)c1ncnn1C	ZINC000853803284	EB	On-Demand	Anodyne	ASAH1	47	33
CCCCCCCCNC(=O)c1ncnn1C	ZINC000853803285	BD	On-Demand	Mild	ASAH1	101	41
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803291	GF	On-Demand	Anodyne	HTR4	40	38
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803291	GF	On-Demand	Anodyne	GRIN2B	19	44
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803291	GF	On-Demand	Anodyne	CCR3	21	41
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803291	GF	On-Demand	Anodyne	CACNA1I	42	36
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803292	GF	On-Demand	Anodyne	HTR4	40	38
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803292	GF	On-Demand	Anodyne	GRIN2B	19	44
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803292	GF	On-Demand	Anodyne	CCR3	21	41
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803292	GF	On-Demand	Anodyne	CACNA1I	42	36
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803293	GF	On-Demand	Anodyne	HTR4	40	38
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803293	GF	On-Demand	Anodyne	GRIN2B	19	44
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803293	GF	On-Demand	Anodyne	CCR3	21	41
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803293	GF	On-Demand	Anodyne	CACNA1I	42	36
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803294	GF	On-Demand	Anodyne	HTR4	40	38
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803294	GF	On-Demand	Anodyne	GRIN2B	19	44
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803294	GF	On-Demand	Anodyne	CCR3	21	41
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1cscn1	ZINC000853803294	GF	On-Demand	Anodyne	CACNA1I	42	36
C[C@@H](NC(=O)N1CC[C@@]2(O)C[C@H]2C1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853803320	FF	On-Demand	Anodyne	CCR1	52	36
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NC(=O)c1ncnn1C	ZINC000853803365	DD	On-Demand	Anodyne	GPR119	39	40
Cn1ncnc1C(=O)N[C@H](CNC(=O)OC(C)(C)C)C1CCCC1	ZINC000853803377	ED	On-Demand	Anodyne	REN	43	36
Cn1ncnc1C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C1CCCC1	ZINC000853803378	ED	On-Demand	Anodyne	REN	43	36
COC(=O)c1nc(CNc2nccc(N3CCCC(C)(C)C3)n2)ccc1Cl	ZINC000853803452	GH	On-Demand	Anodyne	MRGPRX1	40	36
CO[C@]1(CO)CCCN(c2ccnc(C(C)C)n2)C1	ZINC000853803519	CD	On-Demand	Anodyne	SORD	127	45
C[C@@]1(C#N)CCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803522	FE	On-Demand	Mild	HTR4	43	36
Cn1ncnc1C(=O)NC1C[C@@H]2CC[C@H](C1)N2C(=O)OC(C)(C)C	ZINC000853803529	ED	On-Demand	Anodyne	GPR119	16	44
C[C@@]1(C#N)CCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803530	FE	On-Demand	Mild	HTR4	43	36
O=C(NCC1=CCCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803543	FF	On-Demand	Anodyne	HTR4	41	34
O=C(NCC1=CCCC1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803543	FF	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1=CCCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803544	FF	On-Demand	Anodyne	HTR4	41	34
O=C(NCC1=CCCC1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803544	FF	On-Demand	Anodyne	CACNA1I	46	35
COCC1(NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCCC1	ZINC000853803547	GF	On-Demand	Anodyne	HTR4	53	36
COCC1(NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CCCC1	ZINC000853803547	GF	On-Demand	Anodyne	CACNA1I	55	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803548	GD	On-Demand	Anodyne	HTR4	55	38
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803548	GD	On-Demand	Anodyne	GRIN2B	18	46
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803548	GD	On-Demand	Anodyne	SIGMAR1	23	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803548	GD	On-Demand	Anodyne	CCR3	27	42
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803548	GD	On-Demand	Anodyne	EPHX2	15	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803548	GD	On-Demand	Anodyne	CACNA1I	55	37
COCC1(NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCCC1	ZINC000853803549	GF	On-Demand	Anodyne	HTR4	53	36
COCC1(NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CCCC1	ZINC000853803549	GF	On-Demand	Anodyne	CACNA1I	55	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803550	GD	On-Demand	Anodyne	HTR4	55	38
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803550	GD	On-Demand	Anodyne	GRIN2B	18	46
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803550	GD	On-Demand	Anodyne	SIGMAR1	23	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803550	GD	On-Demand	Anodyne	CCR3	27	42
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803550	GD	On-Demand	Anodyne	EPHX2	15	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803550	GD	On-Demand	Anodyne	CACNA1I	55	37
Cn1ncnc1C(=O)NCC1CCN(C(=O)C(F)(F)F)CC1	ZINC000853803586	DC	On-Demand	Anodyne	CACNA1I	67	40
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(N4CC=CC4)c3)C2)cc1	ZINC000853803597	GG	On-Demand	Clean	SIGMAR1	17	41
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(N4CC=CC4)c3)C2)cc1	ZINC000853803597	GG	On-Demand	Clean	MTNR1A	26	55
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(N4CC=CC4)c3)C2)cc1	ZINC000853803597	GG	On-Demand	Clean	MTNR1B	23	55
COc1ccc(N2CC[C@H](NC(=O)NCc3cccc(N4CC=CC4)c3)C2)cc1	ZINC000853803597	GG	On-Demand	Clean	MCHR1	21	48
CN(CC1=CCCOC1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853803642	GE	On-Demand	Anodyne	HTR4	49	35
CN(CC1=CCCOC1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853803644	GE	On-Demand	Anodyne	HTR4	49	35
COC(=O)c1sc(N2CC[C@@H](O)C(F)(F)C2)nc1Cl	ZINC000853803654	DD	On-Demand	Anodyne	PARE	78	33
COC(=O)c1sc(N2CC[C@H](O)C(F)(F)C2)nc1Cl	ZINC000853803656	DD	On-Demand	Anodyne	PARE	78	33
Cn1ncnc1C(=O)NCCC1CCC1	ZINC000853803658	BC	On-Demand	Anodyne	SIRT3	54	34
Cn1ncnc1C(=O)NCCC1CCC1	ZINC000853803658	BC	On-Demand	Anodyne	SIRT2	55	34
Cn1ncnc1C(=O)NCCC1CCC1	ZINC000853803658	BC	On-Demand	Anodyne	SIRT1	54	34
C=CC[C@@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803673	GG	On-Demand	Mild	CACNA1I	42	35
C=CC[C@@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803674	GG	On-Demand	Mild	CACNA1I	42	35
C=CC[C@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853803675	GG	On-Demand	Mild	CACNA1I	42	35
C=CC[C@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853803676	GG	On-Demand	Mild	CACNA1I	42	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853803681	FE	On-Demand	Anodyne	SLC6A3	17	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853803681	FE	On-Demand	Anodyne	HTR4	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853803681	FE	On-Demand	Anodyne	GRIN2B	24	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853803681	FE	On-Demand	Anodyne	CACNA1I	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853803682	FE	On-Demand	Anodyne	SLC6A3	17	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853803682	FE	On-Demand	Anodyne	HTR4	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853803682	FE	On-Demand	Anodyne	GRIN2B	24	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853803682	FE	On-Demand	Anodyne	CACNA1I	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@H]2C1	ZINC000853803683	FE	On-Demand	Anodyne	SLC6A3	17	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@H]2C1	ZINC000853803683	FE	On-Demand	Anodyne	HTR4	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@H]2C1	ZINC000853803683	FE	On-Demand	Anodyne	GRIN2B	24	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@H]2C1	ZINC000853803683	FE	On-Demand	Anodyne	CACNA1I	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853803684	FE	On-Demand	Anodyne	SLC6A3	17	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853803684	FE	On-Demand	Anodyne	HTR4	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853803684	FE	On-Demand	Anodyne	GRIN2B	24	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853803684	FE	On-Demand	Anodyne	CACNA1I	50	36
COC(=O)c1nc(CNc2cc(N3CCCC3)ncn2)ccc1Cl	ZINC000853803693	EF	On-Demand	Anodyne	GALR2	41	34
COC(=O)c1nc(CNc2nc(OC)cc(OC)n2)ccc1Cl	ZINC000853803721	ED	On-Demand	Anodyne	ALS	79	43
Cn1ncnc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000853803723	DE	On-Demand	Anodyne	CACNA1B	48	37
Cn1ncnc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000853803723	DE	On-Demand	Anodyne	CCR2	64	41
Cn1ncnc1C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000853803723	DE	On-Demand	Anodyne	RBP4	21	42
Cn1ncnc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000853803724	DE	On-Demand	Anodyne	CACNA1B	48	37
Cn1ncnc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000853803724	DE	On-Demand	Anodyne	CCR2	64	41
Cn1ncnc1C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000853803724	DE	On-Demand	Anodyne	RBP4	21	42
COC(=O)c1nc(CNc2nc(C)nc3scc(C)c23)ccc1Cl	ZINC000853803735	FH	On-Demand	Anodyne	UL26	45	32
COC(=O)c1nc(CNc2ncnc3ccc(C(C)C)cc23)ccc1Cl	ZINC000853803756	FI	On-Demand	Anodyne	PDE5A	15	40
COC(=O)c1nc(CNc2ncnc3ccc(C(C)C)cc23)ccc1Cl	ZINC000853803756	FI	On-Demand	Anodyne	PDE6A	41	32
COC(=O)c1nc(CNc2ncnc3ccc(C(C)C)cc23)ccc1Cl	ZINC000853803756	FI	On-Demand	Anodyne	CLK4	52	40
Cn1ncnc1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853803789	DD	On-Demand	Anodyne	CAPN2	41	32
Cn1ncnc1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853803789	DD	On-Demand	Anodyne	NPR	59	37
Cn1ncnc1C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853803789	DD	On-Demand	Anodyne	POLR1A	46	33
C[C@H](NC(=O)NCC1CCC(O)CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853803824	GG	On-Demand	Anodyne	SPHK1	32	40
C[C@H](NC(=O)NCC1CCC(O)CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853803824	GG	On-Demand	Anodyne	CACNA1I	46	32
C[C@@H](NC(=O)NCC1CCC(O)CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853803825	GG	On-Demand	Anodyne	SPHK1	32	40
C[C@@H](NC(=O)NCC1CCC(O)CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853803825	GG	On-Demand	Anodyne	CACNA1I	46	32
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H](CO)C1CCC1	ZINC000853803869	GD	On-Demand	Anodyne	HTR4	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H](CO)C1CCC1	ZINC000853803869	GD	On-Demand	Anodyne	CACNA1I	46	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H](CO)C1CCC1	ZINC000853803872	GD	On-Demand	Anodyne	HTR4	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H](CO)C1CCC1	ZINC000853803872	GD	On-Demand	Anodyne	CACNA1I	46	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H](CO)C1CCC1	ZINC000853803875	GD	On-Demand	Anodyne	HTR4	42	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H](CO)C1CCC1	ZINC000853803875	GD	On-Demand	Anodyne	CACNA1I	46	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H](CO)C1CCC1	ZINC000853803878	GD	On-Demand	Anodyne	HTR4	42	34
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H](CO)C1CCC1	ZINC000853803878	GD	On-Demand	Anodyne	CACNA1I	46	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803893	GH	On-Demand	Anodyne	ACHE	28	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803893	GH	On-Demand	Anodyne	SLC6A3	23	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803893	GH	On-Demand	Anodyne	GRIN2B	19	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803893	GH	On-Demand	Anodyne	SIGMAR1	15	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803893	GH	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803897	GH	On-Demand	Anodyne	ACHE	28	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803897	GH	On-Demand	Anodyne	SLC6A3	23	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803897	GH	On-Demand	Anodyne	GRIN2B	19	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803897	GH	On-Demand	Anodyne	SIGMAR1	15	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N(CCC1CC1)CC1CC1	ZINC000853803897	GH	On-Demand	Anodyne	CACNA1I	65	39
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853803909	FG	On-Demand	Anodyne	SLC6A3	17	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853803909	FG	On-Demand	Anodyne	HTR4	45	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853803909	FG	On-Demand	Anodyne	CACNA1I	45	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853803913	FG	On-Demand	Anodyne	SLC6A3	17	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853803913	FG	On-Demand	Anodyne	HTR4	45	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853803913	FG	On-Demand	Anodyne	CACNA1I	45	35
O=C(NCCS(=O)(=O)CC(F)(F)F)NCc1cccc(N2CC=CC2)c1	ZINC000853803919	GD	On-Demand	Anodyne	CARM1	51	33
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1CCNC1=O	ZINC000853803962	FC	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1CCNC1=O	ZINC000853803966	FC	On-Demand	Anodyne	CACNA1I	42	34
CCCCCCCCCCNC(=O)c1ncnn1C	ZINC000853803987	CF	On-Demand	Mild	ASAH1	101	41
Cn1ncnc1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853804008	DC	On-Demand	Anodyne	ACE	35	42
Cn1ncnc1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853804008	DC	On-Demand	Anodyne	MME	19	42
Cn1ncnc1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853804010	DC	On-Demand	Anodyne	ACE	35	42
Cn1ncnc1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853804010	DC	On-Demand	Anodyne	MME	19	42
O=C(NCCCc1nc[nH]n1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804021	GD	On-Demand	Anodyne	HTR4	48	35
O=C(NCCCc1nc[nH]n1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804021	GD	On-Demand	Anodyne	GRIN2B	21	42
O=C(NCCCc1nc[nH]n1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804021	GD	On-Demand	Anodyne	CCR3	27	43
O=C(NCCCc1nc[nH]n1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804023	GD	On-Demand	Anodyne	HTR4	48	35
O=C(NCCCc1nc[nH]n1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804023	GD	On-Demand	Anodyne	GRIN2B	21	42
O=C(NCCCc1nc[nH]n1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804023	GD	On-Demand	Anodyne	CCR3	27	43
CCSC1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000853804025	GG	On-Demand	Anodyne	HTR4	44	35
CCSC1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000853804025	GG	On-Demand	Anodyne	CCR3	16	41
CCSC1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1	ZINC000853804025	GG	On-Demand	Anodyne	CACNA1I	59	36
CCSC1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000853804027	GG	On-Demand	Anodyne	HTR4	44	35
CCSC1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000853804027	GG	On-Demand	Anodyne	CCR3	16	41
CCSC1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1	ZINC000853804027	GG	On-Demand	Anodyne	CACNA1I	59	36
C[C@@H](Nc1nccc(N2CCCC2)n1)c1cscn1	ZINC000853804042	CF	On-Demand	Anodyne	SORD	55	34
O[C@H]1CCN(c2nccc(N3CCCC3)n2)CC1(F)F	ZINC000853804058	CD	On-Demand	Anodyne	SORD	50	36
O[C@@H]1CCN(c2nccc(N3CCCC3)n2)CC1(F)F	ZINC000853804062	CD	On-Demand	Anodyne	SORD	50	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853804066	GE	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853804066	GE	On-Demand	Anodyne	GRIN2B	19	43
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804068	GE	On-Demand	Anodyne	SLC6A3	16	41
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804068	GE	On-Demand	Anodyne	HTR4	51	38
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804068	GE	On-Demand	Anodyne	GRIN2B	15	46
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804068	GE	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2COC[C@H]2C1	ZINC000853804069	GE	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H]2COC[C@H]2C1	ZINC000853804069	GE	On-Demand	Anodyne	GRIN2B	19	43
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804070	GE	On-Demand	Anodyne	SLC6A3	16	41
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804070	GE	On-Demand	Anodyne	HTR4	51	38
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804070	GE	On-Demand	Anodyne	GRIN2B	15	46
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804070	GE	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853804072	GE	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853804072	GE	On-Demand	Anodyne	GRIN2B	19	43
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853804074	GE	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853804074	GE	On-Demand	Anodyne	GRIN2B	19	43
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804076	GG	On-Demand	Anodyne	HTR4	57	37
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804076	GG	On-Demand	Anodyne	GRIN2B	18	43
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804076	GG	On-Demand	Anodyne	CCR3	15	40
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804076	GG	On-Demand	Anodyne	CACNA1I	66	41
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804077	GG	On-Demand	Anodyne	HTR4	57	37
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804077	GG	On-Demand	Anodyne	GRIN2B	18	43
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804077	GG	On-Demand	Anodyne	CCR3	15	40
CC(C)(C)C(F)(F)CNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804077	GG	On-Demand	Anodyne	CACNA1I	66	41
Cn1ncnc1C(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000853804082	CD	On-Demand	Anodyne	CCR5	65	32
Cn1ncnc1C(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000853804082	CD	On-Demand	Anodyne	TPSAB1	29	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCc2nccnc2C1	ZINC000853804088	GD	On-Demand	Anodyne	HTR4	40	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCc2nccnc2C1	ZINC000853804088	GD	On-Demand	Anodyne	GRIN2B	23	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCc2nccnc2C1	ZINC000853804089	GD	On-Demand	Anodyne	HTR4	40	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCc2nccnc2C1	ZINC000853804089	GD	On-Demand	Anodyne	GRIN2B	23	41
Cc1ccnc2nc(C(=O)NNC(=S)Nc3cccc(Cl)c3)nn12	ZINC000853804093	FD	On-Demand	Reactive	PPIA	30	44
Cc1ccnc2nc(C(=O)NNC(=S)Nc3cccc(Cl)c3)nn12	ZINC000853804093	FD	On-Demand	Reactive	KCNK3	30	40
Cc1ccnc2nc(C(=O)NNC(=S)Nc3cccc(Cl)c3)nn12	ZINC000853804093	FD	On-Demand	Reactive	KCNK9	18	40
COc1ccc(N2C[C@H](Nc3ncnc4nc(SC)sc34)CC2=O)cc1	ZINC000853804136	GG	On-Demand	Anodyne	GRM1	18	42
Cn1ncnc1C(=O)N1CC(O)(c2ccc(Cl)cc2)C1	ZINC000853804168	CC	On-Demand	Anodyne	CCR1	47	35
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)N2CCc3[nH]c4ccccc4c3C2)CC1	ZINC000853804205	JI	On-Demand	Bother	SSTR4	43	32
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853804207	DC	On-Demand	Anodyne	CACNA1I	77	42
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853804207	DC	On-Demand	Anodyne	GPR119	45	41
Cn1ncnc1C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853804211	DC	On-Demand	Anodyne	CACNA1I	77	42
Cn1ncnc1C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853804211	DC	On-Demand	Anodyne	GPR119	45	41
Cn1ncnc1C(=O)N1CCC[C@](CO)(c2ccccc2)C1	ZINC000853804223	DC	On-Demand	Anodyne	TACR2	18	41
Cn1ncnc1C(=O)N1CCC[C@@](CO)(c2ccccc2)C1	ZINC000853804224	DC	On-Demand	Anodyne	TACR2	18	41
Cn1ncnc1C(=O)N1CCC[C@H](CCNC(=O)OC(C)(C)C)C1	ZINC000853804250	ED	On-Demand	Anodyne	SIRT3	26	42
Cn1ncnc1C(=O)N1CCC[C@H](CCNC(=O)OC(C)(C)C)C1	ZINC000853804250	ED	On-Demand	Anodyne	SIRT2	25	42
Cn1ncnc1C(=O)N1CCC[C@H](CCNC(=O)OC(C)(C)C)C1	ZINC000853804250	ED	On-Demand	Anodyne	SIRT1	24	42
Cn1ncnc1C(=O)N1CCC[C@@H](CCNC(=O)OC(C)(C)C)C1	ZINC000853804253	ED	On-Demand	Anodyne	SIRT3	26	42
Cn1ncnc1C(=O)N1CCC[C@@H](CCNC(=O)OC(C)(C)C)C1	ZINC000853804253	ED	On-Demand	Anodyne	SIRT2	25	42
Cn1ncnc1C(=O)N1CCC[C@@H](CCNC(=O)OC(C)(C)C)C1	ZINC000853804253	ED	On-Demand	Anodyne	SIRT1	24	42
N#CCC1CN(c2cc(Cl)nc(N)n2)C1	ZINC000853804254	BD	On-Demand	Mild	HRH4	42	38
Cn1ncnc1C(=O)NCC1([C@H](O)c2ccccc2)CC1	ZINC000853804256	CD	On-Demand	Anodyne	HCN1	73	34
Cn1ncnc1C(=O)NCC1([C@H](O)c2ccccc2)CC1	ZINC000853804256	CD	On-Demand	Anodyne	HCN4	49	32
Cn1ncnc1C(=O)NCC1([C@@H](O)c2ccccc2)CC1	ZINC000853804257	CD	On-Demand	Anodyne	HCN1	73	34
Cn1ncnc1C(=O)NCC1([C@@H](O)c2ccccc2)CC1	ZINC000853804257	CD	On-Demand	Anodyne	HCN4	49	32
Cn1ncnc1C(=O)NCC1CN(C(=O)OC(C)(C)C)C1	ZINC000853804263	CC	On-Demand	Anodyne	CACNA1I	53	38
CN1C[C@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804269	GD	On-Demand	Anodyne	SLC6A3	23	41
CN1C[C@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804269	GD	On-Demand	Anodyne	HTR4	56	38
CN1C[C@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804269	GD	On-Demand	Anodyne	CCR3	25	40
CN1C[C@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804269	GD	On-Demand	Anodyne	CACNA1I	60	38
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804270	GD	On-Demand	Anodyne	SLC6A3	23	41
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804270	GD	On-Demand	Anodyne	HTR4	56	38
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804270	GD	On-Demand	Anodyne	CCR3	25	40
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804270	GD	On-Demand	Anodyne	CACNA1I	60	38
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804273	GD	On-Demand	Anodyne	SLC6A3	23	41
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804273	GD	On-Demand	Anodyne	HTR4	56	38
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804273	GD	On-Demand	Anodyne	CCR3	25	40
CN1C[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804273	GD	On-Demand	Anodyne	CACNA1I	60	38
CN1C[C@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804275	GD	On-Demand	Anodyne	SLC6A3	23	41
CN1C[C@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804275	GD	On-Demand	Anodyne	HTR4	56	38
CN1C[C@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804275	GD	On-Demand	Anodyne	CCR3	25	40
CN1C[C@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1=O	ZINC000853804275	GD	On-Demand	Anodyne	CACNA1I	60	38
O=C(NCC[S@@](=O)CC(F)(F)F)NCc1cccc(N2CC=CC2)c1	ZINC000853804277	GE	On-Demand	Anodyne	CARM1	46	34
O=C(NCC[S@](=O)CC(F)(F)F)NCc1cccc(N2CC=CC2)c1	ZINC000853804278	GE	On-Demand	Anodyne	CARM1	46	34
C[C@@H](OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853804304	JH	On-Demand	Anodyne	TACR1	21	44
C[C@@H](OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853804304	JH	On-Demand	Anodyne	CCKAR	23	41
C[C@@H](OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853804304	JH	On-Demand	Anodyne	CTSL	19	42
C[C@@H](OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853804304	JH	On-Demand	Anodyne	BRS3	26	41
C[C@@H](OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853804304	JH	On-Demand	Anodyne	NMBR	22	43
C[C@@H](OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853804304	JH	On-Demand	Anodyne	GRPR	59	32
C[C@@H](OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853804304	JH	On-Demand	Anodyne	GHSR	41	37
C[C@@H](Nc1ccc2c(c1)S(=O)(=O)N=C2Cl)C1(CO)CC1	ZINC000853804305	DD	On-Demand	Anodyne	ABCC8	47	38
Cn1ncnc1C(=O)N1CCC[C@H]1C[C@H](O)c1ccccc1	ZINC000853804311	DD	On-Demand	Anodyne	Q8WSF8_APLCA	18	48
Cn1ncnc1C(=O)N1CCC[C@@H]1C[C@H](O)c1ccccc1	ZINC000853804313	DD	On-Demand	Anodyne	Q8WSF8_APLCA	18	48
Cn1ncnc1C(=O)N1CCC[C@H]1C[C@@H](O)c1ccccc1	ZINC000853804315	DD	On-Demand	Anodyne	Q8WSF8_APLCA	18	48
Cn1ncnc1C(=O)N1CCC[C@@H]1C[C@@H](O)c1ccccc1	ZINC000853804317	DD	On-Demand	Anodyne	Q8WSF8_APLCA	18	48
C[C@@H](NC(=O)N1CCC[C@@](O)(C2CC2)C1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853804326	GG	On-Demand	Anodyne	CCR1	54	38
CCC(C)(C)[C@@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804328	GH	On-Demand	Anodyne	HTR4	52	37
CCC(C)(C)[C@@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804328	GH	On-Demand	Anodyne	GRIN2B	24	43
CCC(C)(C)[C@@H](C)NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804328	GH	On-Demand	Anodyne	CACNA1I	67	40
CCC(C)(C)[C@@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804331	GH	On-Demand	Anodyne	HTR4	52	37
CCC(C)(C)[C@@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804331	GH	On-Demand	Anodyne	GRIN2B	24	43
CCC(C)(C)[C@@H](C)NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804331	GH	On-Demand	Anodyne	CACNA1I	67	40
C[C@@H](NC(=O)N1CCC[C@](O)(C2CC2)C1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853804333	GG	On-Demand	Anodyne	CCR1	54	38
O=C(NCCOCCF)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804338	FD	On-Demand	Anodyne	SLC6A3	19	41
O=C(NCCOCCF)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804338	FD	On-Demand	Anodyne	HTR4	42	34
O=C(NCCOCCF)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804338	FD	On-Demand	Anodyne	CCR3	16	40
O=C(NCCOCCF)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804338	FD	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCCOCCF)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804341	FD	On-Demand	Anodyne	SLC6A3	19	41
O=C(NCCOCCF)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804341	FD	On-Demand	Anodyne	HTR4	42	34
O=C(NCCOCCF)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804341	FD	On-Demand	Anodyne	CCR3	16	40
O=C(NCCOCCF)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804341	FD	On-Demand	Anodyne	CACNA1I	50	35
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804374	GC	On-Demand	Anodyne	SLC6A3	17	40
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804374	GC	On-Demand	Anodyne	HTR4	63	39
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804374	GC	On-Demand	Anodyne	GRIN2B	22	44
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804374	GC	On-Demand	Anodyne	CCR5	46	36
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804374	GC	On-Demand	Anodyne	CACNA1I	55	37
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804377	GC	On-Demand	Anodyne	SLC6A3	17	40
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804377	GC	On-Demand	Anodyne	HTR4	63	39
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804377	GC	On-Demand	Anodyne	GRIN2B	22	44
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804377	GC	On-Demand	Anodyne	CCR5	46	36
CS(=O)(=O)C1CN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804377	GC	On-Demand	Anodyne	CACNA1I	55	37
Cn1ncnc1C(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000853804387	CD	On-Demand	Anodyne	KCNA5	16	41
Cn1ncnc1C(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000853804387	CD	On-Demand	Anodyne	CCR1	24	42
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804404	GE	On-Demand	Anodyne	HTR4	60	38
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804404	GE	On-Demand	Anodyne	TIMP3	57	32
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804404	GE	On-Demand	Anodyne	EPHX2	17	40
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853804404	GE	On-Demand	Anodyne	CACNA1I	50	36
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804408	GE	On-Demand	Anodyne	HTR4	60	38
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804408	GE	On-Demand	Anodyne	TIMP3	57	32
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804408	GE	On-Demand	Anodyne	EPHX2	17	40
CCO[C@@H]1C[C@@H](NC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853804408	GE	On-Demand	Anodyne	CACNA1I	50	36
Cn1ncnc1C(=O)NCCCCCCCNC(=O)c1ncnn1C	ZINC000853804414	EC	On-Demand	Anodyne	ASAH1	47	33
Cn1ncnc1C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853804417	EC	On-Demand	Anodyne	GRIN2B	25	47
Cn1ncnc1C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853804417	EC	On-Demand	Anodyne	PREP	25	40
Cn1ncnc1C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853804417	EC	On-Demand	Anodyne	TGM2	43	43
Cn1ncnc1C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853804417	EC	On-Demand	Anodyne	F13A1	38	41
Cn1ncnc1C(=O)N1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853804417	EC	On-Demand	Anodyne	SLC12A5	59	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@H](CO)CC1CC1	ZINC000853804428	GE	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC[C@@H](CO)CC1CC1	ZINC000853804431	GE	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@@H](CO)CC1CC1	ZINC000853804434	GE	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC[C@H](CO)CC1CC1	ZINC000853804437	GE	On-Demand	Anodyne	CACNA1I	50	35
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)N1	ZINC000853804441	FD	On-Demand	Anodyne	SLC6A3	20	40
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)N1	ZINC000853804441	FD	On-Demand	Anodyne	HTR4	49	37
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)N1	ZINC000853804441	FD	On-Demand	Anodyne	GRIN2B	21	45
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)N1	ZINC000853804441	FD	On-Demand	Anodyne	CCR3	17	42
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)N1	ZINC000853804441	FD	On-Demand	Anodyne	CACNA1I	54	36
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)N1	ZINC000853804444	FD	On-Demand	Anodyne	SLC6A3	20	40
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)N1	ZINC000853804444	FD	On-Demand	Anodyne	HTR4	49	37
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)N1	ZINC000853804444	FD	On-Demand	Anodyne	GRIN2B	21	45
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)N1	ZINC000853804444	FD	On-Demand	Anodyne	CCR3	17	42
O=C1CC[C@@H](CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)N1	ZINC000853804444	FD	On-Demand	Anodyne	CACNA1I	54	36
CC[C@@](C)(NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C1CC1	ZINC000853804450	FG	On-Demand	Anodyne	OPRK1	20	41
CC[C@@](C)(NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C1CC1	ZINC000853804450	FG	On-Demand	Anodyne	HTR4	52	36
CC[C@@](C)(NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C1CC1	ZINC000853804450	FG	On-Demand	Anodyne	CACNA1I	64	40
CC[C@@](C)(NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)C1CC1	ZINC000853804454	FG	On-Demand	Anodyne	OPRK1	20	41
CC[C@@](C)(NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)C1CC1	ZINC000853804454	FG	On-Demand	Anodyne	HTR4	52	36
CC[C@@](C)(NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)C1CC1	ZINC000853804454	FG	On-Demand	Anodyne	CACNA1I	64	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804462	FF	On-Demand	Anodyne	SLC6A3	19	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804462	FF	On-Demand	Anodyne	HTR4	43	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804462	FF	On-Demand	Anodyne	GRIN2B	17	46
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804462	FF	On-Demand	Anodyne	CACNA1I	53	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804464	FF	On-Demand	Anodyne	SLC6A3	19	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804464	FF	On-Demand	Anodyne	HTR4	43	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804464	FF	On-Demand	Anodyne	GRIN2B	17	46
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853804464	FF	On-Demand	Anodyne	CACNA1I	53	36
O=C(NC/C=C\CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804487	ED	On-Demand	Anodyne	SLC6A3	20	40
O=C(NC/C=C\CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804487	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NC/C=C\CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804487	ED	On-Demand	Anodyne	GRIN2B	21	47
O=C(NC/C=C\CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804487	ED	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NC/C=C\CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804487	ED	On-Demand	Anodyne	CCR3	17	46
O=C(NC/C=C\CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804487	ED	On-Demand	Anodyne	CACNA1I	58	36
O=C(NC/C=C/CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804489	ED	On-Demand	Anodyne	SLC6A3	20	40
O=C(NC/C=C/CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804489	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NC/C=C/CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804489	ED	On-Demand	Anodyne	GRIN2B	21	47
O=C(NC/C=C/CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804489	ED	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NC/C=C/CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804489	ED	On-Demand	Anodyne	CCR3	17	46
O=C(NC/C=C/CO)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804489	ED	On-Demand	Anodyne	CACNA1I	58	36
O=C(NC/C=C/CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804491	ED	On-Demand	Anodyne	SLC6A3	20	40
O=C(NC/C=C/CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804491	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NC/C=C/CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804491	ED	On-Demand	Anodyne	GRIN2B	21	47
O=C(NC/C=C/CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804491	ED	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NC/C=C/CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804491	ED	On-Demand	Anodyne	CCR3	17	46
O=C(NC/C=C/CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804491	ED	On-Demand	Anodyne	CACNA1I	58	36
O=C(NC/C=C\CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804493	ED	On-Demand	Anodyne	SLC6A3	20	40
O=C(NC/C=C\CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804493	ED	On-Demand	Anodyne	HTR4	45	37
O=C(NC/C=C\CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804493	ED	On-Demand	Anodyne	GRIN2B	21	47
O=C(NC/C=C\CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804493	ED	On-Demand	Anodyne	SIGMAR1	16	40
O=C(NC/C=C\CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804493	ED	On-Demand	Anodyne	CCR3	17	46
O=C(NC/C=C\CO)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804493	ED	On-Demand	Anodyne	CACNA1I	58	36
COc1ccc(NC(=O)[C@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)c(OC)c1	ZINC000853804540	JI	On-Demand	Bother	KCNMA1	19	40
O=C(NCCC(F)(F)F)NNc1nc2ccc(Cl)cc2s1	ZINC000853804548	EH	On-Demand	Reactive	CSNK1D	46	46
COC(=O)c1nc(CNc2ncc3c(n2)CCCC3)ccc1Cl	ZINC000853804583	EF	On-Demand	Anodyne	MAPK1	41	38
Cn1ncnc1C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)CC2	ZINC000853804584	ED	On-Demand	Anodyne	GPR119	49	41
Cn1ncnc1C(=O)N[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853804594	DD	On-Demand	Anodyne	GPR119	45	43
Cn1ncnc1C(=O)N[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000853804595	DD	On-Demand	Anodyne	GPR119	45	43
COC(=O)c1nc(CNc2ncnc(C)c2OC)ccc1Cl	ZINC000853804600	DE	On-Demand	Anodyne	PDE6A	47	36
C[C@@H](NC(=O)NCC(O)(C1CC1)C1CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853804664	GG	On-Demand	Anodyne	SPHK1	29	40
C[C@H](NC(=O)NCC(O)(C1CC1)C1CC1)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853804666	GG	On-Demand	Anodyne	SPHK1	29	40
CN(C[C@@H]1CC1(C)C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804739	FG	On-Demand	Anodyne	HTR4	45	36
CN(C[C@@H]1CC1(C)C)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853804739	FG	On-Demand	Anodyne	CACNA1I	63	38
CN(C[C@@H]1CC1(C)C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804743	FG	On-Demand	Anodyne	HTR4	45	36
CN(C[C@@H]1CC1(C)C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853804743	FG	On-Demand	Anodyne	CACNA1I	63	38
O=[N+]([O-])c1ccc(N2CC[C@H](O)C(F)(F)C2)c(Cl)c1	ZINC000853804767	CE	On-Demand	Bother	WDR5	34	42
O=[N+]([O-])c1ccc(N2CC[C@@H](O)C(F)(F)C2)c(Cl)c1	ZINC000853804768	CE	On-Demand	Bother	WDR5	34	42
Cn1ncnc1C(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000853804800	EB	On-Demand	Anodyne	EPHX2	18	40
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804820	ED	On-Demand	Anodyne	SLC6A3	16	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804820	ED	On-Demand	Anodyne	HTR4	48	37
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804820	ED	On-Demand	Anodyne	GRIN2B	17	46
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804820	ED	On-Demand	Anodyne	CCR3	16	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804820	ED	On-Demand	Anodyne	CACNA1I	58	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804821	ED	On-Demand	Anodyne	SLC6A3	16	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804821	ED	On-Demand	Anodyne	HTR4	48	37
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804821	ED	On-Demand	Anodyne	GRIN2B	17	46
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804821	ED	On-Demand	Anodyne	CCR3	16	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853804821	ED	On-Demand	Anodyne	CACNA1I	58	36
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)c1	ZINC000853804881	JH	On-Demand	Bother	TAAR1	22	47
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)c1	ZINC000853804882	JH	On-Demand	Bother	TAAR1	22	47
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1ncnn1C	ZINC000853804919	DD	On-Demand	Anodyne	GPR119	39	42
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)c1ncnn1C	ZINC000853804920	DD	On-Demand	Anodyne	GPR119	39	42
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NC(=O)c1ncnn1C	ZINC000853804921	DD	On-Demand	Anodyne	GPR119	39	42
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NC(=O)c1ncnn1C	ZINC000853804922	DD	On-Demand	Anodyne	GPR119	39	42
Cn1ncnc1C(=O)NCCCCCCOc1ccc(Cl)cc1	ZINC000853804925	EF	On-Demand	Anodyne	PLA2G4B	43	31
CCOC(=O)N1CCC([C@H](C)NC(=O)c2ncnn2C)CC1	ZINC000853804982	DC	On-Demand	Anodyne	P2RY12	48	34
CCOC(=O)N1CCC([C@@H](C)NC(=O)c2ncnn2C)CC1	ZINC000853804983	DC	On-Demand	Anodyne	P2RY12	48	34
C[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000853805021	FE	On-Demand	Bother	BCL2L1	76	36
C[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000853805021	FE	On-Demand	Bother	BCL2	55	33
C[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000853805021	FE	On-Demand	Bother	BCL2L2	43	30
C#CCCN(CCOC)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853805037	GG	On-Demand	Mild	UTS2	40	33
C#CCCN(CCOC)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853805038	GG	On-Demand	Mild	UTS2	40	33
CO[C@]1(CO)CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853805100	CD	On-Demand	Anodyne	SORD	72	40
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805160	GE	On-Demand	Anodyne	HTR4	47	37
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805160	GE	On-Demand	Anodyne	GRIN2B	19	42
C[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805160	GE	On-Demand	Anodyne	CACNA1I	53	36
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805161	GE	On-Demand	Anodyne	HTR4	47	37
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805161	GE	On-Demand	Anodyne	GRIN2B	19	42
C[C@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805161	GE	On-Demand	Anodyne	CACNA1I	53	36
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805162	GE	On-Demand	Anodyne	HTR4	47	37
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805162	GE	On-Demand	Anodyne	GRIN2B	19	42
C[C@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805162	GE	On-Demand	Anodyne	CACNA1I	53	36
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805163	GE	On-Demand	Anodyne	HTR4	47	37
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805163	GE	On-Demand	Anodyne	GRIN2B	19	42
C[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)c1nccn1C	ZINC000853805163	GE	On-Demand	Anodyne	CACNA1I	53	36
Nc1nc(Cl)cc(N2CC[C@@H](O)C(F)(F)C2)n1	ZINC000853805170	CC	On-Demand	Anodyne	HRH4	40	36
Nc1nc(Cl)cc(N2CC[C@H](O)C(F)(F)C2)n1	ZINC000853805171	CC	On-Demand	Anodyne	HRH4	40	36
C#CCCN(CCOC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805178	GE	On-Demand	Mild	HTR4	47	36
C#CCCN(CCOC)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805178	GE	On-Demand	Mild	CACNA1I	46	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805204	FD	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805204	FD	On-Demand	Anodyne	GRIN2B	15	45
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805204	FD	On-Demand	Anodyne	CCR3	16	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805204	FD	On-Demand	Anodyne	CACNA1I	54	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805206	FD	On-Demand	Anodyne	HTR4	49	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805206	FD	On-Demand	Anodyne	GRIN2B	15	45
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805206	FD	On-Demand	Anodyne	CCR3	16	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853805206	FD	On-Demand	Anodyne	CACNA1I	54	36
COc1ccccc1-c1noc([C@@H](C)NC(=O)NCCN(C)OC)n1	ZINC000853805228	ED	On-Demand	Anodyne	LUCI_PHOPE	30	41
COc1ccccc1-c1noc([C@H](C)NC(=O)NCCN(C)OC)n1	ZINC000853805230	ED	On-Demand	Anodyne	LUCI_PHOPE	30	41
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1ncnn1C	ZINC000853805284	DD	On-Demand	Anodyne	KLK3	59	34
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1ncnn1C	ZINC000853805284	DD	On-Demand	Anodyne	CYSP_TRYCR	45	35
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1ncnn1C	ZINC000853805284	DD	On-Demand	Anodyne	CAPNS1	59	34
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1ncnn1C	ZINC000853805284	DD	On-Demand	Anodyne	CAPN1	61	38
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1ncnn1C	ZINC000853805284	DD	On-Demand	Anodyne	CAPN2	89	37
C[C@H](CC(=O)OCc1ccccc1)NC(=O)c1ncnn1C	ZINC000853805284	DD	On-Demand	Anodyne	NPR	67	35
Cn1ncnc1C(=O)NCc1ccc(N2CCOC2=O)cc1	ZINC000853805285	DC	On-Demand	Anodyne	DGAT1	28	41
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2cccc(C(=O)N(C)C)c2)CC1	ZINC000853805291	JG	On-Demand	Bother	TAAR1	19	46
Cn1ncnc1C(=O)NCCCCCCc1nc(-c2ccc(Cl)cc2)no1	ZINC000853805303	GG	On-Demand	Anodyne	SPHK1	32	40
C=CCN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@@H](C)COC	ZINC000853805324	GF	On-Demand	Mild	SLC6A3	15	40
C=CCN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@@H](C)COC	ZINC000853805324	GF	On-Demand	Mild	CCR5	18	42
C=CCN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@H](C)COC	ZINC000853805325	GF	On-Demand	Mild	SLC6A3	15	40
C=CCN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@H](C)COC	ZINC000853805325	GF	On-Demand	Mild	CCR5	18	42
C=CCN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@@H](C)COC	ZINC000853805326	GF	On-Demand	Mild	SLC6A3	15	40
C=CCN(C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)[C@@H](C)COC	ZINC000853805326	GF	On-Demand	Mild	CCR5	18	42
C=CCN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@H](C)COC	ZINC000853805327	GF	On-Demand	Mild	SLC6A3	15	40
C=CCN(C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)[C@H](C)COC	ZINC000853805327	GF	On-Demand	Mild	CCR5	18	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1CCNC1=O	ZINC000853805333	FC	On-Demand	Anodyne	CACNA1I	42	34
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1CCNC1=O	ZINC000853805334	FC	On-Demand	Anodyne	CACNA1I	42	34
CN(C[C@@H]1COCCO1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805338	GD	On-Demand	Anodyne	HTR4	44	35
CN(C[C@@H]1COCCO1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805338	GD	On-Demand	Anodyne	CACNA1I	42	35
CN(C[C@@H]1COCCO1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805340	GD	On-Demand	Anodyne	HTR4	44	35
CN(C[C@@H]1COCCO1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805340	GD	On-Demand	Anodyne	CACNA1I	42	35
Cn1ncnc1C(=O)NCCC(=O)OCc1ccccc1	ZINC000853805344	CC	On-Demand	Anodyne	CAPN2	50	30
Cn1ncnc1C(=O)NCCC(=O)OCc1ccccc1	ZINC000853805344	CC	On-Demand	Anodyne	NPR	63	35
C[C@H](NC(=O)N1C[C@@H]2CCCC[C@@H]21)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853805373	FI	On-Demand	Anodyne	CPT1A	16	41
C[C@@H](NC(=O)N1C[C@@H]2CCCC[C@@H]21)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853805375	FI	On-Demand	Anodyne	CPT1A	16	41
C[C@@H](Nc1nccc(N2CCCC2)n1)C1(CO)CC1	ZINC000853805405	CD	On-Demand	Anodyne	SORD	120	42
O=C(NCCO[C@H]1CC1(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805408	GE	On-Demand	Anodyne	CACNA1I	45	33
O=C(NCCO[C@@H]1CC1(F)F)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805411	GE	On-Demand	Anodyne	CACNA1I	45	33
O=C(NCCO[C@H]1CC1(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805415	GE	On-Demand	Anodyne	CACNA1I	45	33
O=C(NCCO[C@@H]1CC1(F)F)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805419	GE	On-Demand	Anodyne	CACNA1I	45	33
Cn1ncnc1C(=O)NCCCNC(=O)/C=C/c1ccccc1	ZINC000853805420	DC	On-Demand	Anodyne	DRD3	15	45
Cn1ncnc1C(=O)NCCCNC(=O)/C=C/c1ccccc1	ZINC000853805420	DC	On-Demand	Anodyne	HDAC8	45	36
Cn1ncnc1C(=O)NCCCNC(=O)/C=C/c1ccccc1	ZINC000853805420	DC	On-Demand	Anodyne	HDAC1	26	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C/c1ccccc1	ZINC000853805420	DC	On-Demand	Anodyne	HDAC4	25	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C/c1ccccc1	ZINC000853805420	DC	On-Demand	Anodyne	HDAC6	31	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C/c1ccccc1	ZINC000853805420	DC	On-Demand	Anodyne	HDAC9	33	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C/c1ccccc1	ZINC000853805420	DC	On-Demand	Anodyne	HDAC7	33	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C\c1ccccc1	ZINC000853805421	DC	On-Demand	Anodyne	DRD3	15	45
Cn1ncnc1C(=O)NCCCNC(=O)/C=C\c1ccccc1	ZINC000853805421	DC	On-Demand	Anodyne	HDAC8	45	36
Cn1ncnc1C(=O)NCCCNC(=O)/C=C\c1ccccc1	ZINC000853805421	DC	On-Demand	Anodyne	HDAC1	26	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C\c1ccccc1	ZINC000853805421	DC	On-Demand	Anodyne	HDAC4	25	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C\c1ccccc1	ZINC000853805421	DC	On-Demand	Anodyne	HDAC6	31	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C\c1ccccc1	ZINC000853805421	DC	On-Demand	Anodyne	HDAC9	33	42
Cn1ncnc1C(=O)NCCCNC(=O)/C=C\c1ccccc1	ZINC000853805421	DC	On-Demand	Anodyne	HDAC7	33	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805451	GH	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805451	GH	On-Demand	Anodyne	HTR4	56	36
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805451	GH	On-Demand	Anodyne	GRIN2B	25	46
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805451	GH	On-Demand	Anodyne	CCR3	18	42
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805451	GH	On-Demand	Anodyne	CACNA1I	57	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805454	GH	On-Demand	Anodyne	SLC6A3	17	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805454	GH	On-Demand	Anodyne	HTR4	56	36
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805454	GH	On-Demand	Anodyne	GRIN2B	25	46
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805454	GH	On-Demand	Anodyne	CCR3	18	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853805454	GH	On-Demand	Anodyne	CACNA1I	57	36
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	GRIN2B	26	42
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	CTRA_BOVIN	61	32
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	CTSG	41	32
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	PREP	35	43
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	CELA2A	49	32
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	TGM2	33	41
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	NPR	46	31
Cn1ncnc1C(=O)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805475	FD	On-Demand	Anodyne	F13A1	18	41
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	GRIN2B	26	42
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	CTRA_BOVIN	61	32
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	CTSG	41	32
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	PREP	35	43
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	CELA2A	49	32
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	TGM2	33	41
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	NPR	46	31
Cn1ncnc1C(=O)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000853805476	FD	On-Demand	Anodyne	F13A1	18	41
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CCC(O)(CO)CC1	ZINC000853805484	GC	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC(O)(CO)CC1	ZINC000853805487	GC	On-Demand	Anodyne	CACNA1I	46	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CCC2(COC2)C1	ZINC000853805494	FD	On-Demand	Anodyne	HTR4	43	36
COCCN(CCF)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805495	GE	On-Demand	Anodyne	HTR4	54	39
COCCN(CCF)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805495	GE	On-Demand	Anodyne	CACNA1I	58	37
COCCN(CCF)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805496	GE	On-Demand	Anodyne	HTR4	54	39
COCCN(CCF)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805496	GE	On-Demand	Anodyne	CACNA1I	58	37
CCOC(=O)N1CC[C@@H](NC(=O)c2ncnn2C)C1	ZINC000853805580	CB	On-Demand	Anodyne	CCR8	28	42
CCOC(=O)N1CC[C@H](NC(=O)c2ncnn2C)C1	ZINC000853805581	CB	On-Demand	Anodyne	CCR8	28	42
COC(=O)c1nc(CNc2ncnc3c2ncn3C2CC2)ccc1Cl	ZINC000853805611	FF	On-Demand	Anodyne	ADORA1	74	43
COC(=O)c1nc(CNc2ncnc3c2ncn3C2CC2)ccc1Cl	ZINC000853805611	FF	On-Demand	Anodyne	SLC29A1	19	40
COC(=O)c1nc(CNc2ncnc3c2ncn3C2CC2)ccc1Cl	ZINC000853805611	FF	On-Demand	Anodyne	ADORA3	112	43
COC(=O)c1nc(CNc2ncnc3c2ncn3C2CC2)ccc1Cl	ZINC000853805611	FF	On-Demand	Anodyne	Q4VQ11_PIG	52	32
COC(=O)c1nc(CNc2cc(N3CCCCC3)ncn2)ccc1Cl	ZINC000853805642	FF	On-Demand	Anodyne	GALR2	43	35
Cn1ncnc1C(=O)N1C[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]2C1	ZINC000853805718	DC	On-Demand	Anodyne	GPR119	33	41
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805728	FD	On-Demand	Anodyne	HTR4	42	36
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805728	FD	On-Demand	Anodyne	ACE2	20	40
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805728	FD	On-Demand	Anodyne	TAAR1	23	40
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805730	FD	On-Demand	Anodyne	HTR4	42	36
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805730	FD	On-Demand	Anodyne	ACE2	20	40
CN(Cc1cnc[nH]1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805730	FD	On-Demand	Anodyne	TAAR1	23	40
CCCCCCCCNC(=O)c1nc(COC)nn1C	ZINC000853805733	CE	On-Demand	Mild	ASAH1	88	36
CON(C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805736	FD	On-Demand	Anodyne	HTR4	44	37
CON(C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805736	FD	On-Demand	Anodyne	CCR3	20	40
CON(C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805736	FD	On-Demand	Anodyne	CACNA1I	55	37
CON(C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805740	FD	On-Demand	Anodyne	HTR4	44	37
CON(C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805740	FD	On-Demand	Anodyne	CCR3	20	40
CON(C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805740	FD	On-Demand	Anodyne	CACNA1I	55	37
O=C(NCc1ncccn1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805752	FD	On-Demand	Anodyne	HTR4	46	37
O=C(NCc1ncccn1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805752	FD	On-Demand	Anodyne	GRIN2B	33	45
O=C(NCc1ncccn1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805752	FD	On-Demand	Anodyne	CCR3	17	42
O=C(NCc1ncccn1)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805752	FD	On-Demand	Anodyne	CACNA1I	58	36
O=C(NCc1ncccn1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805754	FD	On-Demand	Anodyne	HTR4	46	37
O=C(NCc1ncccn1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805754	FD	On-Demand	Anodyne	GRIN2B	33	45
O=C(NCc1ncccn1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805754	FD	On-Demand	Anodyne	CCR3	17	42
O=C(NCc1ncccn1)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805754	FD	On-Demand	Anodyne	CACNA1I	58	36
CCCCCNC(=O)[C@@H](C)OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O	ZINC000853805758	HG	On-Demand	Anodyne	ASAH1	56	37
CCCCCNC(=O)[C@H](C)OC(=O)c1nn(-c2ccccc2C(F)(F)F)cc1O	ZINC000853805762	HG	On-Demand	Anodyne	ASAH1	56	37
Cn1ncnc1C(=O)NC[C@@]1(O)CCc2ccccc21	ZINC000853805817	CC	On-Demand	Anodyne	HCN1	62	35
Cn1ncnc1C(=O)NC[C@@]1(O)CCc2ccccc21	ZINC000853805817	CC	On-Demand	Anodyne	HCN4	46	30
Cn1ncnc1C(=O)NC[C@]1(O)CCc2ccccc21	ZINC000853805818	CC	On-Demand	Anodyne	HCN1	62	35
Cn1ncnc1C(=O)NC[C@]1(O)CCc2ccccc21	ZINC000853805818	CC	On-Demand	Anodyne	HCN4	46	30
N#CC[C@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853805828	GF	On-Demand	Mild	CACNA1I	42	35
N#CC[C@@H]1CCCN(C(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)C1	ZINC000853805829	GF	On-Demand	Mild	CACNA1I	42	35
N#CC[C@@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853805830	GF	On-Demand	Mild	CACNA1I	42	35
N#CC[C@H]1CCCN(C(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)C1	ZINC000853805831	GF	On-Demand	Mild	CACNA1I	42	35
CC[C@H](C)N(CC)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853805872	FI	On-Demand	Anodyne	UTS2	40	31
CC[C@H](C)N(CC)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC000853805873	FI	On-Demand	Anodyne	UTS2	40	31
Cn1ncnc1C(=O)N[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853805888	GF	On-Demand	Anodyne	PAPA1_CARPA	18	41
Cn1ncnc1C(=O)N[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853805889	GF	On-Demand	Anodyne	PAPA1_CARPA	18	41
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805982	FG	On-Demand	Anodyne	SLC6A3	18	41
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805982	FG	On-Demand	Anodyne	HTR4	50	38
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805982	FG	On-Demand	Anodyne	GRIN2B	18	46
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805982	FG	On-Demand	Anodyne	CCR3	28	42
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853805982	FG	On-Demand	Anodyne	CACNA1I	59	42
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805983	FG	On-Demand	Anodyne	SLC6A3	18	41
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805983	FG	On-Demand	Anodyne	HTR4	50	38
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805983	FG	On-Demand	Anodyne	GRIN2B	18	46
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805983	FG	On-Demand	Anodyne	CCR3	28	42
CC[C@@H](C)CCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853805983	FG	On-Demand	Anodyne	CACNA1I	59	42
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853806010	EE	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853806011	EE	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853806012	EE	On-Demand	Anodyne	CACNA1I	50	35
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853806013	EE	On-Demand	Anodyne	CACNA1I	50	35
CC[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)C1CC1	ZINC000853806015	FF	On-Demand	Anodyne	HTR4	46	36
CC[C@@H](NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1)C1CC1	ZINC000853806015	FF	On-Demand	Anodyne	CACNA1I	60	40
CC[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C1CC1	ZINC000853806017	FF	On-Demand	Anodyne	HTR4	46	36
CC[C@@H](NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1)C1CC1	ZINC000853806017	FF	On-Demand	Anodyne	CACNA1I	60	40
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC[C@H](O)C(F)(F)C1	ZINC000853806020	GD	On-Demand	Anodyne	GRIN2B	15	44
O=C(NCC1CCN(C[C@@H](O)c2ccccc2)CC1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853806021	GD	On-Demand	Anodyne	GRIN2B	15	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@H](O)C(F)(F)C1	ZINC000853806022	GD	On-Demand	Anodyne	GRIN2B	15	44
O=C(NCC1CCN(C[C@H](O)c2ccccc2)CC1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853806023	GD	On-Demand	Anodyne	GRIN2B	15	44
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806069	GF	On-Demand	Mild	HTR4	44	36
N#C[C@@H]1CCCC[C@H]1NC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806070	GF	On-Demand	Mild	HTR4	44	36
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806071	GF	On-Demand	Mild	HTR4	44	36
N#C[C@@H]1CCCC[C@H]1NC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806072	GF	On-Demand	Mild	HTR4	44	36
C[C@@]1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1(F)F	ZINC000853806112	GF	On-Demand	Anodyne	HTR4	41	36
C[C@@]1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1(F)F	ZINC000853806112	GF	On-Demand	Anodyne	CCR3	18	42
C[C@@]1(CNC(=O)NCC2CCN(C[C@H](O)c3ccccc3)CC2)CC1(F)F	ZINC000853806112	GF	On-Demand	Anodyne	CACNA1I	57	37
C[C@@]1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1(F)F	ZINC000853806114	GF	On-Demand	Anodyne	HTR4	41	36
C[C@@]1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1(F)F	ZINC000853806114	GF	On-Demand	Anodyne	CCR3	18	42
C[C@@]1(CNC(=O)NCC2CCN(C[C@@H](O)c3ccccc3)CC2)CC1(F)F	ZINC000853806114	GF	On-Demand	Anodyne	CACNA1I	57	37
COCc1cc([N+](=O)[O-])ccc1NCc1ccc(Cl)c(C(=O)OC)n1	ZINC000853806159	FG	On-Demand	Bother	CACNA1C	44	37
COCc1cc([N+](=O)[O-])ccc1NCc1ccc(Cl)c(C(=O)OC)n1	ZINC000853806159	FG	On-Demand	Bother	CACNA1D	71	37
CN(Cc1cn(C)nn1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806160	GD	On-Demand	Anodyne	HTR4	45	36
CN(Cc1cn(C)nn1)C(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806160	GD	On-Demand	Anodyne	CACNA1I	45	33
CN(Cc1cn(C)nn1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806161	GD	On-Demand	Anodyne	HTR4	45	36
CN(Cc1cn(C)nn1)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806161	GD	On-Demand	Anodyne	CACNA1I	45	33
C=CCCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806162	EE	On-Demand	Mild	SLC6A3	16	40
C=CCCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806162	EE	On-Demand	Mild	HTR4	42	37
C=CCCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806162	EE	On-Demand	Mild	GRIN2B	17	45
C=CCCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806162	EE	On-Demand	Mild	SIGMAR1	15	40
C=CCCNC(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000853806162	EE	On-Demand	Mild	CACNA1I	58	36
C=CCCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806163	EE	On-Demand	Mild	SLC6A3	16	40
C=CCCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806163	EE	On-Demand	Mild	HTR4	42	37
C=CCCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806163	EE	On-Demand	Mild	GRIN2B	17	45
C=CCCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806163	EE	On-Demand	Mild	SIGMAR1	15	40
C=CCCNC(=O)NCC1CCN(C[C@H](O)c2ccccc2)CC1	ZINC000853806163	EE	On-Demand	Mild	CACNA1I	58	36
COC(=O)c1nc(CNc2nccc(N3CCCC3)n2)ccc1Cl	ZINC000853806168	EF	On-Demand	Anodyne	MRGPRX1	43	37
COC(=O)c1nc(CNc2cc(NCC3CC3)ncn2)ccc1Cl	ZINC000853806187	EF	On-Demand	Anodyne	VCP	50	33
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@@H](N2CCOC2=O)C1	ZINC000853806201	EF	On-Demand	Mild	LIPG	52	38
N#Cc1cc(C(F)(F)F)ccc1N1CC[C@H](N2CCOC2=O)C1	ZINC000853806202	EF	On-Demand	Mild	LIPG	52	38
O=C1OCCN1[C@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853806260	FF	On-Demand	Anodyne	PIK3CA	20	45
O=C1OCCN1[C@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853806260	FF	On-Demand	Anodyne	MTOR	27	45
O=C1OCCN1[C@@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853806261	FF	On-Demand	Anodyne	PIK3CA	20	45
O=C1OCCN1[C@@H]1CCN(c2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853806261	FF	On-Demand	Anodyne	MTOR	27	45
O=C(NC1CC1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nc1	ZINC000853806265	DD	On-Demand	Anodyne	HPGDS	36	48
O=C(NC1CC1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nc1	ZINC000853806266	DD	On-Demand	Anodyne	HPGDS	36	48
O[C@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806271	FF	On-Demand	Anodyne	PIK3CA	17	41
O[C@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806271	FF	On-Demand	Anodyne	SORD	53	40
O[C@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806271	FF	On-Demand	Anodyne	EPHB4	46	35
O[C@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806271	FF	On-Demand	Anodyne	SMG1	29	40
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806272	FF	On-Demand	Anodyne	PIK3CA	17	41
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806272	FF	On-Demand	Anodyne	SORD	53	40
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806272	FF	On-Demand	Anodyne	EPHB4	46	35
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853806272	FF	On-Demand	Anodyne	SMG1	29	40
Cn1ncnc1C(=O)NC1CCC(N2CCN(C(=O)OC(C)(C)C)CC2)CC1	ZINC000853806288	GD	On-Demand	Anodyne	GPR119	41	39
O=C(c1cc(N2CC[C@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000853806297	FD	On-Demand	Bother	L3MBTL3	43	43
O=C(c1cc(N2CC[C@@H](N3CCOC3=O)C2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000853806298	FD	On-Demand	Bother	L3MBTL3	43	43
O=C1OCCN1[C@@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000853806301	DF	On-Demand	Anodyne	HRP1_PLAFA	99	36
O=C1OCCN1[C@H]1CCN(c2ccnc3cc(Cl)ccc23)C1	ZINC000853806302	DF	On-Demand	Anodyne	HRP1_PLAFA	99	36
Cn1ncnc1C(=O)N1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]2CC1	ZINC000853806305	ED	On-Demand	Anodyne	GPR119	48	48
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853806341	FE	On-Demand	Anodyne	NAMPT	60	39
O=C(NCc1ccc(-c2cccnc2)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853806342	FE	On-Demand	Anodyne	NAMPT	60	39
Cc1cc(N2CC[C@H](N3CCOC3=O)C2)nc(N)n1	ZINC000853806353	CC	On-Demand	Anodyne	HRH4	50	39
O=C(c1cnc(N2CC[C@H](N3CCOC3=O)C2)c(Cl)c1)N1CCCCC1	ZINC000853806389	GE	On-Demand	Anodyne	L3MBTL3	51	37
O=C(c1cnc(N2CC[C@@H](N3CCOC3=O)C2)c(Cl)c1)N1CCCCC1	ZINC000853806390	GE	On-Demand	Anodyne	L3MBTL3	51	37
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccsc23)C1	ZINC000853806398	CD	On-Demand	Anodyne	SIRT3	42	32
O=C1OCCN1[C@H]1CCN(c2ncnc3ccsc23)C1	ZINC000853806399	CD	On-Demand	Anodyne	SIRT3	42	32
Cn1ncnc1C(=O)N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853806413	FC	On-Demand	Anodyne	GPR119	41	40
Cn1ncnc1C(=O)N1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853806413	FC	On-Demand	Anodyne	L3MBTL3	53	37
Cn1ncnc1C(=O)N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853806414	FC	On-Demand	Anodyne	GPR119	41	40
Cn1ncnc1C(=O)N1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853806414	FC	On-Demand	Anodyne	L3MBTL3	53	37
COC(=O)c1sc(N2CC[C@@H](N3CCOC3=O)C2)nc1Cl	ZINC000853806418	ED	On-Demand	Anodyne	PARE	103	39
COC(=O)c1sc(N2CC[C@H](N3CCOC3=O)C2)nc1Cl	ZINC000853806419	ED	On-Demand	Anodyne	PARE	103	39
Cn1ncnc1C(=O)N1CCC([C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853806422	FD	On-Demand	Anodyne	GPR119	47	50
Cn1ncnc1C(=O)N1CCC([C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853806423	FD	On-Demand	Anodyne	GPR119	47	50
O=C1OCCN1[C@@H]1CCN(c2ncccc2C(F)(F)F)C1	ZINC000853806426	DE	On-Demand	Anodyne	TRPV1	29	45
O=C1OCCN1[C@H]1CCN(c2ncccc2C(F)(F)F)C1	ZINC000853806427	DE	On-Demand	Anodyne	TRPV1	29	45
Cc1ccc(-c2csc3ncnc(N4CC[C@H](N5CCOC5=O)C4)c23)cc1	ZINC000853806438	GH	On-Demand	Anodyne	ADRB3	15	53
Cc1ccc(-c2csc3ncnc(N4CC[C@@H](N5CCOC5=O)C4)c23)cc1	ZINC000853806439	GH	On-Demand	Anodyne	ADRB3	15	53
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccc(F)cc23)C1	ZINC000853806448	DD	On-Demand	Anodyne	PDE3A	41	37
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccc(F)cc23)C1	ZINC000853806448	DD	On-Demand	Anodyne	PDE3B	45	35
O=C1OCCN1[C@H]1CCN(c2ncnc3ccc(F)cc23)C1	ZINC000853806449	DD	On-Demand	Anodyne	PDE3A	41	37
O=C1OCCN1[C@H]1CCN(c2ncnc3ccc(F)cc23)C1	ZINC000853806449	DD	On-Demand	Anodyne	PDE3B	45	35
O[C@@H](CNc1ncnc2c1ncn2C1CC1)c1cccc2ccccc12	ZINC000853806463	EG	On-Demand	Anodyne	ADORA1	63	46
O[C@@H](CNc1ncnc2c1ncn2C1CC1)c1cccc2ccccc12	ZINC000853806463	EG	On-Demand	Anodyne	ADORA3	78	45
O[C@H](CNc1ncnc2c1ncn2C1CC1)c1cccc2ccccc12	ZINC000853806464	EG	On-Demand	Anodyne	ADORA1	63	46
O[C@H](CNc1ncnc2c1ncn2C1CC1)c1cccc2ccccc12	ZINC000853806464	EG	On-Demand	Anodyne	ADORA3	78	45
O=C(NCc1ccc(-c2cccnc2)cc1)NCC1SCCS1	ZINC000853806467	EG	On-Demand	Anodyne	NAMPT	61	45
O=C(c1ccc(N2CC[C@H](N3CCOC3=O)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000853806474	GD	On-Demand	Bother	L3MBTL3	37	45
O=C(c1ccc(N2CC[C@@H](N3CCOC3=O)C2)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000853806475	GD	On-Demand	Bother	L3MBTL3	37	45
N#Cc1ccc(N2CC[C@@H](N3CCOC3=O)C2)cc1C(F)(F)F	ZINC000853806504	EF	On-Demand	Mild	AR	68	55
N#Cc1ccc(N2CC[C@H](N3CCOC3=O)C2)cc1C(F)(F)F	ZINC000853806505	EF	On-Demand	Mild	AR	68	55
O=C1OCCN1[C@H]1CCN(c2nc3ccccc3s2)C1	ZINC000853806510	CE	On-Demand	Anodyne	LTA4H	19	53
O=C1OCCN1[C@@H]1CCN(c2nc3ccccc3s2)C1	ZINC000853806511	CE	On-Demand	Anodyne	LTA4H	19	53
Nc1nc(Cl)cc(N2CC[C@@H](N3CCOC3=O)C2)n1	ZINC000853806530	CC	On-Demand	Anodyne	HRH4	40	39
Nc1nc(Cl)cc(N2CC[C@H](N3CCOC3=O)C2)n1	ZINC000853806531	CC	On-Demand	Anodyne	HRH4	40	39
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000853806549	DE	On-Demand	Anodyne	PDE3A	41	38
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000853806549	DE	On-Demand	Anodyne	HRP1_PLAFA	66	33
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000853806549	DE	On-Demand	Anodyne	PDE3B	45	38
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000853806550	DE	On-Demand	Anodyne	PDE3A	41	38
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000853806550	DE	On-Demand	Anodyne	HRP1_PLAFA	66	33
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(Cl)ccc23)C1	ZINC000853806550	DE	On-Demand	Anodyne	PDE3B	45	38
N#Cc1ccnc(N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853806607	CC	On-Demand	Mild	MAP3K12	52	37
N#Cc1ccnc(N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853806608	CC	On-Demand	Mild	MAP3K12	52	37
O=C1OCCN1[C@@H]1CCN(c2ncnc3c2oc2ccccc23)C1	ZINC000853806632	DE	On-Demand	Anodyne	HRH4	17	54
O=C1OCCN1[C@H]1CCN(c2ncnc3c2oc2ccccc23)C1	ZINC000853806633	DE	On-Demand	Anodyne	HRH4	17	54
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000853806636	EE	On-Demand	Anodyne	NAMPT	42	42
O=C(NCc1ccc(-c2cccnc2)cc1)NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853806642	FG	On-Demand	Anodyne	NAMPT	50	41
NC(=O)c1cnc(N2CC[C@@H](N3CCOC3=O)C2)c(Cl)c1	ZINC000853806660	DC	On-Demand	Anodyne	CXCR3	32	49
NC(=O)c1cnc(N2CC[C@H](N3CCOC3=O)C2)c(Cl)c1	ZINC000853806661	DC	On-Demand	Anodyne	CXCR3	32	49
COc1ccc(-c2csc3ncnc(N4CC[C@H](N5CCOC5=O)C4)c23)cc1	ZINC000853806663	GG	On-Demand	Anodyne	ADRB3	17	55
COc1ccc(-c2csc3ncnc(N4CC[C@@H](N5CCOC5=O)C4)c23)cc1	ZINC000853806664	GG	On-Demand	Anodyne	ADRB3	17	55
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccc(Br)cc23)C1	ZINC000853806665	FE	On-Demand	Anodyne	PDE3A	41	35
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccc(Br)cc23)C1	ZINC000853806665	FE	On-Demand	Anodyne	PDE3B	45	35
O=C1OCCN1[C@H]1CCN(c2ncnc3ccc(Br)cc23)C1	ZINC000853806666	FE	On-Demand	Anodyne	PDE3A	41	35
O=C1OCCN1[C@H]1CCN(c2ncnc3ccc(Br)cc23)C1	ZINC000853806666	FE	On-Demand	Anodyne	PDE3B	45	35
C#CC[C@@H](Cc1ccccc1)NC(=O)c1nc(COC)nn1C	ZINC000853806689	DD	On-Demand	Mild	CTSV	40	34
C#CC[C@H](Cc1ccccc1)NC(=O)c1nc(COC)nn1C	ZINC000853806690	DD	On-Demand	Mild	CTSV	40	34
O=C1OCCN1[C@@H]1CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000853806749	DE	On-Demand	Anodyne	MLYCD	61	38
O=C1OCCN1[C@H]1CCN(c2ncc(C(F)(F)F)s2)C1	ZINC000853806750	DE	On-Demand	Anodyne	MLYCD	61	38
Cn1ncnc1C(=O)N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806806	GD	On-Demand	Anodyne	CTSK	21	40
Cn1ncnc1C(=O)N1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806806	GD	On-Demand	Anodyne	CTSL	22	40
Cn1ncnc1C(=O)N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806807	GD	On-Demand	Anodyne	CTSK	21	40
Cn1ncnc1C(=O)N1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806807	GD	On-Demand	Anodyne	CTSL	22	40
Cn1ncnc1C(=O)N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806808	GD	On-Demand	Anodyne	CTSK	21	40
Cn1ncnc1C(=O)N1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806808	GD	On-Demand	Anodyne	CTSL	22	40
Cn1ncnc1C(=O)N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806809	GD	On-Demand	Anodyne	CTSK	21	40
Cn1ncnc1C(=O)N1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000853806809	GD	On-Demand	Anodyne	CTSL	22	40
O=C1CCC2=C(CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)C2)N1	ZINC000853806859	FF	On-Demand	Anodyne	CYP11B2	17	40
O=C1CCC2=C(CCN(C(=O)NCc3ccc(-c4cccnc4)cc3)C2)N1	ZINC000853806859	FF	On-Demand	Anodyne	NAMPT	57	41
COc1cccc(Nc2nc(N3CC[C@@H](N4CCOC4=O)C3)nc3[nH]cnc23)c1	ZINC000853806946	GE	On-Demand	Anodyne	PDPK1	15	43
COc1cccc(Nc2nc(N3CC[C@H](N4CCOC4=O)C3)nc3[nH]cnc23)c1	ZINC000853806947	GE	On-Demand	Anodyne	PDPK1	15	43
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853807012	GF	On-Demand	Anodyne	CHRNA7	17	41
O=C(NCc1ccc(-c2cccnc2)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853807012	GF	On-Demand	Anodyne	NAMPT	61	39
C#C[C@H](NC(=O)NCc1ccc(-c2cccnc2)cc1)C1CCOCC1	ZINC000853807013	EF	On-Demand	Mild	NAMPT	67	39
C#C[C@@H](NC(=O)NCc1ccc(-c2cccnc2)cc1)C1CCOCC1	ZINC000853807014	EF	On-Demand	Mild	NAMPT	67	39
COC(=O)[C@@]1(c2ccccc2)CCN(C(=O)c2ncnn2C)C1	ZINC000853807037	DC	On-Demand	Anodyne	ADRA1A	20	41
C[C@@H](Nc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000853807043	FE	On-Demand	Bother	BCL2L1	77	36
C[C@@H](Nc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000853807043	FE	On-Demand	Bother	BCL2	55	33
C[C@@H](Nc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-])C1(CO)CC1	ZINC000853807043	FE	On-Demand	Bother	BCL2L2	46	33
O=C1OCCN1[C@@H]1CCN(c2ccc3ccccc3n2)C1	ZINC000853807074	CE	On-Demand	Anodyne	HTR3A	20	43
O=C1OCCN1[C@H]1CCN(c2ccc3ccccc3n2)C1	ZINC000853807075	CE	On-Demand	Anodyne	HTR3A	20	43
O=C1OCCN1[C@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000853807099	GF	On-Demand	Anodyne	SCD1	17	43
O=C1OCCN1[C@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000853807099	GF	On-Demand	Anodyne	SCD	17	43
O=C1OCCN1[C@@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000853807100	GF	On-Demand	Anodyne	SCD1	17	43
O=C1OCCN1[C@@H]1CCN(c2ccc(-c3ccc(Br)s3)nn2)C1	ZINC000853807100	GF	On-Demand	Anodyne	SCD	17	43
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2cccn2C)cc1	ZINC000853807146	FD	On-Demand	Anodyne	ADRB2	37	54
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2cccn2C)cc1	ZINC000853807146	FD	On-Demand	Anodyne	ADRB1	71	54
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2cccn2C)cc1	ZINC000853807146	FD	On-Demand	Anodyne	ADRB3	44	40
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2cccn2C)cc1	ZINC000853807147	FD	On-Demand	Anodyne	ADRB2	37	54
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2cccn2C)cc1	ZINC000853807147	FD	On-Demand	Anodyne	ADRB1	71	54
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2cccn2C)cc1	ZINC000853807147	FD	On-Demand	Anodyne	ADRB3	44	40
C[C@@H](NC(=O)NCCc1nnc(S)n1C1CC1)c1ccc(-n2cccn2)cc1	ZINC000853807156	GF	On-Demand	Anodyne	AMP1_PLAFQ	57	41
C[C@@H](NC(=O)NCCc1nnc(S)n1C)c1ccc(-n2cccn2)cc1	ZINC000853807187	FD	On-Demand	Anodyne	AMP1_PLAFQ	61	42
O=C1OCCN1[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000853807194	EF	On-Demand	Bother	LIPG	51	35
O=C1OCCN1[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1	ZINC000853807195	EF	On-Demand	Bother	LIPG	51	35
O[C@H](CNc1cc(N2CCOCC2)ncn1)c1cccc2ccccc12	ZINC000853807219	FF	On-Demand	Anodyne	PIK3CB	28	40
O[C@@H](CNc1cc(N2CCOCC2)ncn1)c1cccc2ccccc12	ZINC000853807220	FF	On-Demand	Anodyne	PIK3CB	28	40
CCc1ccc(N2CCN(C(=O)c3nc(COC)nn3C)CC2)cc1Cl	ZINC000853807221	GE	On-Demand	Anodyne	CCKAR	28	41
CCc1ccc(N2CCN(C(=O)c3nc(COC)nn3C)CC2)cc1Cl	ZINC000853807221	GE	On-Demand	Anodyne	CCR1	23	41
O=S(=O)(NCC1CC1)c1ccc(NC[C@H](O)c2cccc3ccccc23)nc1	ZINC000853807222	GG	On-Demand	Anodyne	NPY5R	32	43
O=S(=O)(NCC1CC1)c1ccc(NC[C@@H](O)c2cccc3ccccc23)nc1	ZINC000853807223	GG	On-Demand	Anodyne	NPY5R	32	43
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)NCc2ccc(-c3cccnc3)cc2)O1	ZINC000853807244	GD	On-Demand	Reactive	NAMPT	55	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)NCc2ccc(-c3cccnc3)cc2)O1	ZINC000853807246	GD	On-Demand	Reactive	NAMPT	55	43
O[C@H](CNc1nccc(N2CCCC2)n1)c1cccc2ccccc12	ZINC000853807262	EG	On-Demand	Anodyne	SORD	70	42
O[C@@H](CNc1nccc(N2CCCC2)n1)c1cccc2ccccc12	ZINC000853807263	EG	On-Demand	Anodyne	SORD	70	42
O=C1OCCN1[C@H]1CCN(c2nc3ccccc3o2)C1	ZINC000853807279	CD	On-Demand	Anodyne	HTR3A	15	52
O=C1OCCN1[C@@H]1CCN(c2nc3ccccc3o2)C1	ZINC000853807280	CD	On-Demand	Anodyne	HTR3A	15	52
O=C(NCCC1SCCS1)NCc1ccc(-c2cccnc2)cc1	ZINC000853807281	FH	On-Demand	Anodyne	NAMPT	47	43
CON(C)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000853807282	DE	On-Demand	Anodyne	KCNA5	16	42
CON(C)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000853807282	DE	On-Demand	Anodyne	CYP11B2	27	40
CON(C)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000853807282	DE	On-Demand	Anodyne	ROCK2	20	40
CON(C)CCNC(=O)NCc1ccc(-c2cccnc2)cc1	ZINC000853807282	DE	On-Demand	Anodyne	NAMPT	50	44
Cn1ncnc1C(=O)N1CC[C@@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853807287	FC	On-Demand	Anodyne	GPR119	47	42
Cn1ncnc1C(=O)N1CC[C@H](N2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853807288	FC	On-Demand	Anodyne	GPR119	47	42
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853807291	EG	On-Demand	Anodyne	NAMPT	45	39
O=C(NCc1ccc(-c2cccnc2)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853807292	EG	On-Demand	Anodyne	NAMPT	45	39
COc1c(C)ncnc1N1CC[C@H](N2CCOC2=O)C1	ZINC000853807297	CC	On-Demand	Anodyne	PDE3A	41	35
COc1c(C)ncnc1N1CC[C@H](N2CCOC2=O)C1	ZINC000853807297	CC	On-Demand	Anodyne	PDE3B	45	35
COc1c(C)ncnc1N1CC[C@@H](N2CCOC2=O)C1	ZINC000853807298	CC	On-Demand	Anodyne	PDE3A	41	35
COc1c(C)ncnc1N1CC[C@@H](N2CCOC2=O)C1	ZINC000853807298	CC	On-Demand	Anodyne	PDE3B	45	35
O=C1OCCN1[C@@H]1CCN(c2ncc(-c3ccc(Cl)cc3)s2)C1	ZINC000853807344	EG	On-Demand	Anodyne	LUCI_LUCLA	17	42
O=C1OCCN1[C@H]1CCN(c2ncc(-c3ccc(Cl)cc3)s2)C1	ZINC000853807345	EG	On-Demand	Anodyne	LUCI_LUCLA	17	42
CC(C)c1ccc2ncnc(N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853807346	EF	On-Demand	Anodyne	PDE3A	44	43
CC(C)c1ccc2ncnc(N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853807346	EF	On-Demand	Anodyne	PDE3B	49	43
CC(C)c1ccc2ncnc(N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853807347	EF	On-Demand	Anodyne	PDE3A	44	43
CC(C)c1ccc2ncnc(N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853807347	EF	On-Demand	Anodyne	PDE3B	49	43
O=C1OCCN1[C@H]1CCN(c2ccc(-c3ccc(Cl)s3)nn2)C1	ZINC000853807360	FF	On-Demand	Anodyne	SCD1	18	41
O=C1OCCN1[C@@H]1CCN(c2ccc(-c3ccc(Cl)s3)nn2)C1	ZINC000853807361	FF	On-Demand	Anodyne	SCD1	18	41
Cn1ncnc1C(=O)NC[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CC1	ZINC000853807394	FD	On-Demand	Anodyne	ACACB	17	46
Cn1ncnc1C(=O)NC[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CC1	ZINC000853807394	FD	On-Demand	Anodyne	CACNA1I	57	39
Cc1nc(N2CC[C@H](N3CCOC3=O)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853807395	FE	On-Demand	Anodyne	MTOR	23	41
Cc1nc(N2CC[C@@H](N3CCOC3=O)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853807396	FE	On-Demand	Anodyne	MTOR	23	41
O=C1OCCN1[C@H]1CCN(c2ccccn2)C1	ZINC000853807399	BD	On-Demand	Anodyne	DRD4	17	46
O=C1OCCN1[C@H]1CCN(c2ccccn2)C1	ZINC000853807399	BD	On-Demand	Anodyne	EBP	27	42
O=C1OCCN1[C@@H]1CCN(c2ccccn2)C1	ZINC000853807400	BD	On-Demand	Anodyne	DRD4	17	46
O=C1OCCN1[C@@H]1CCN(c2ccccn2)C1	ZINC000853807400	BD	On-Demand	Anodyne	EBP	27	42
O[C@H](CNc1ccnc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853807401	FF	On-Demand	Anodyne	PIK3CA	27	42
O[C@@H](CNc1ccnc(N2CCOCC2)n1)c1cccc2ccccc12	ZINC000853807402	FF	On-Demand	Anodyne	PIK3CA	27	42
O=C1OCCN1[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853807419	DD	On-Demand	Bother	GSTM2	91	38
O=C1OCCN1[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853807419	DD	On-Demand	Bother	GSTP1	50	38
O=C1OCCN1[C@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853807420	DD	On-Demand	Bother	GSTM2	91	38
O=C1OCCN1[C@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853807420	DD	On-Demand	Bother	GSTP1	50	38
Cc1cc(N2CC[C@H](N3CCOC3=O)C2)c2ccccc2n1	ZINC000853807451	CF	On-Demand	Anodyne	HTR1A	24	41
Cc1cc(N2CC[C@H](N3CCOC3=O)C2)c2ccccc2n1	ZINC000853807451	CF	On-Demand	Anodyne	HTR1D	53	41
Cc1cc(N2CC[C@H](N3CCOC3=O)C2)c2ccccc2n1	ZINC000853807451	CF	On-Demand	Anodyne	HTR1B	46	41
O=C(NCC[S@@](=O)CC(F)(F)F)NCc1ccc(-c2cccnc2)cc1	ZINC000853807458	GF	On-Demand	Anodyne	NAMPT	45	42
O=C(NCC[S@](=O)CC(F)(F)F)NCc1ccc(-c2cccnc2)cc1	ZINC000853807459	GF	On-Demand	Anodyne	NAMPT	45	42
O=C1OCCN1[C@@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1	ZINC000853807460	EF	On-Demand	Anodyne	CXCR3	23	41
O=C1OCCN1[C@H]1CCN(c2ncc(C(F)(F)F)cc2Cl)C1	ZINC000853807461	EF	On-Demand	Anodyne	CXCR3	23	41
O=C1OCCN1[C@H]1CCN(c2nc(NCc3ccccc3)c3ccccc3n2)C1	ZINC000853807548	GG	On-Demand	Anodyne	HRH4	16	45
O=C1OCCN1[C@@H]1CCN(c2nc(NCc3ccccc3)c3ccccc3n2)C1	ZINC000853807549	GG	On-Demand	Anodyne	HRH4	16	45
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000853807579	EF	On-Demand	Mild	AMP1_PLAFQ	61	42
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000853807581	EF	On-Demand	Mild	AMP1_PLAFQ	61	42
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccccc23)C1	ZINC000853807590	CD	On-Demand	Anodyne	PDE3A	41	37
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccccc23)C1	ZINC000853807590	CD	On-Demand	Anodyne	PDE3B	45	36
O=C1OCCN1[C@H]1CCN(c2ncnc3ccccc23)C1	ZINC000853807592	CD	On-Demand	Anodyne	PDE3A	41	37
O=C1OCCN1[C@H]1CCN(c2ncnc3ccccc23)C1	ZINC000853807592	CD	On-Demand	Anodyne	PDE3B	45	36
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(F)c(Br)cc23)C1	ZINC000853807633	GF	On-Demand	Anodyne	PDE3A	40	34
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(F)c(Br)cc23)C1	ZINC000853807633	GF	On-Demand	Anodyne	PDE3B	43	34
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(F)c(Br)cc23)C1	ZINC000853807634	GF	On-Demand	Anodyne	PDE3A	40	34
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(F)c(Br)cc23)C1	ZINC000853807634	GF	On-Demand	Anodyne	PDE3B	43	34
O=C1OCCN1[C@@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000853807739	FG	On-Demand	Anodyne	LIPG	49	34
O=C1OCCN1[C@H]1CCN(c2ccnc3cc(C(F)(F)F)ccc23)C1	ZINC000853807742	FG	On-Demand	Anodyne	LIPG	49	34
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(Br)sc23)C1	ZINC000853807758	FE	On-Demand	Anodyne	SIRT3	63	35
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(Br)sc23)C1	ZINC000853807758	FE	On-Demand	Anodyne	SIRT2	52	34
O=C1OCCN1[C@@H]1CCN(c2ncnc3cc(Br)sc23)C1	ZINC000853807758	FE	On-Demand	Anodyne	SIRT1	50	32
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(Br)sc23)C1	ZINC000853807760	FE	On-Demand	Anodyne	SIRT3	63	35
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(Br)sc23)C1	ZINC000853807760	FE	On-Demand	Anodyne	SIRT2	52	34
O=C1OCCN1[C@H]1CCN(c2ncnc3cc(Br)sc23)C1	ZINC000853807760	FE	On-Demand	Anodyne	SIRT1	50	32
COc1ccc2c(N3CC[C@@H](N4CCOC4=O)C3)ccnc2c1	ZINC000853807761	DE	On-Demand	Anodyne	CCR8	15	42
COc1ccc2c(N3CC[C@H](N4CCOC4=O)C3)ccnc2c1	ZINC000853807763	DE	On-Demand	Anodyne	CCR8	15	42
COc1ccc(-c2nnc(N3CC[C@H](N4CCOC4=O)C3)c3ccccc23)cc1	ZINC000853807771	GG	On-Demand	Anodyne	SMO	46	49
COc1ccc(-c2nnc(N3CC[C@@H](N4CCOC4=O)C3)c3ccccc23)cc1	ZINC000853807773	GG	On-Demand	Anodyne	SMO	46	49
O=C1OCCN1[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807792	CC	On-Demand	Anodyne	AKT2	56	56
O=C1OCCN1[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807792	CC	On-Demand	Anodyne	AKT3	34	42
O=C1OCCN1[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807792	CC	On-Demand	Anodyne	JAK3	21	50
O=C1OCCN1[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807792	CC	On-Demand	Anodyne	JAK1	49	35
O=C1OCCN1[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807792	CC	On-Demand	Anodyne	ROCK2	15	42
O=C1OCCN1[C@@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807792	CC	On-Demand	Anodyne	AKT1	23	42
O=C1OCCN1[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807794	CC	On-Demand	Anodyne	AKT2	56	56
O=C1OCCN1[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807794	CC	On-Demand	Anodyne	AKT3	34	42
O=C1OCCN1[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807794	CC	On-Demand	Anodyne	JAK3	21	50
O=C1OCCN1[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807794	CC	On-Demand	Anodyne	JAK1	49	35
O=C1OCCN1[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807794	CC	On-Demand	Anodyne	ROCK2	15	42
O=C1OCCN1[C@H]1CCN(c2ncnc3[nH]ccc23)C1	ZINC000853807794	CC	On-Demand	Anodyne	AKT1	23	42
N#Cc1cnc(N2CC[C@H](N3CCOC3=O)C2)c(Cl)c1	ZINC000853807824	CD	On-Demand	Mild	CXCR3	17	41
N#Cc1cnc(N2CC[C@@H](N3CCOC3=O)C2)c(Cl)c1	ZINC000853807825	CD	On-Demand	Mild	CXCR3	17	41
CCN1CC[C@H](N(CC)C(=O)NCc2cccn2C)C1	ZINC000853807838	CD	On-Demand	Anodyne	CCR5	30	53
CCN1CC[C@@H](N(CC)C(=O)NCc2cccn2C)C1	ZINC000853807839	CD	On-Demand	Anodyne	CCR5	30	53
COc1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)c1	ZINC000853807840	FD	On-Demand	Reactive	CCR3	18	41
Cn1ncnc1C(=O)N1CCC[C@@](O)(c2ccc(Cl)cc2)C1	ZINC000853807844	DD	On-Demand	Anodyne	CCR1	62	36
Cn1ncnc1C(=O)N1CCC[C@](O)(c2ccc(Cl)cc2)C1	ZINC000853807845	DD	On-Demand	Anodyne	CCR1	62	36
C[C@@H](CCNC(=O)NCC(C)(C)NC(=O)OC(C)(C)C)N(C)C	ZINC000853807850	ED	On-Demand	Anodyne	CHRNA4	17	40
CC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)c1	ZINC000853807869	GD	On-Demand	Reactive	CCR3	22	40
COc1cccc(C2(NC(=O)NCc3cccn3C)CCC2)c1	ZINC000853807892	DF	On-Demand	Anodyne	DRD4	42	32
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)c1	ZINC000853807899	FE	On-Demand	Reactive	CCKAR	27	41
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)c1	ZINC000853807899	FE	On-Demand	Reactive	CCKBR	45	41
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2nccn2C)c1	ZINC000853807899	FE	On-Demand	Reactive	KCNK3	43	37
CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853807946	CE	On-Demand	Bother	GSTM2	118	43
CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853807946	CE	On-Demand	Bother	GSTP1	73	43
Cc1nc(NC(=O)N2C[C@@H]3CCCC[C@@H]32)sc1-c1ccccc1	ZINC000853807982	EJ	On-Demand	Anodyne	PIK3CG	21	49
CON(C)CCNC(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000853808024	DD	On-Demand	Anodyne	AMP1_PLAFQ	66	46
CON(C)CCNC(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000853808027	DD	On-Demand	Anodyne	AMP1_PLAFQ	66	46
O=C(Nc1ccccc1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nn1	ZINC000853808039	FD	On-Demand	Anodyne	SCD1	51	45
O=C(Nc1ccccc1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nn1	ZINC000853808039	FD	On-Demand	Anodyne	SCD	42	45
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nn1	ZINC000853808043	FD	On-Demand	Anodyne	SCD1	51	45
O=C(Nc1ccccc1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nn1	ZINC000853808043	FD	On-Demand	Anodyne	SCD	42	45
COC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1)C2	ZINC000853808110	CD	On-Demand	Bother	SLC27A4	49	34
C#CCCN(CCOC)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000853808118	EF	On-Demand	Mild	AMP1_PLAFQ	51	34
C#CCCN(CCOC)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000853808121	EF	On-Demand	Mild	AMP1_PLAFQ	51	34
CCOc1cc2nccc(N3CC[C@H](N4CCOC4=O)C3)c2cc1OCC	ZINC000853808181	FG	On-Demand	Anodyne	PDE3B	42	39
CCOc1cc2nccc(N3CC[C@@H](N4CCOC4=O)C3)c2cc1OCC	ZINC000853808184	FG	On-Demand	Anodyne	PDE3B	42	39
CCOC(=O)CCCCCCCNC(=O)N1CCC(=O)N(C)CC1	ZINC000853808240	ED	On-Demand	Anodyne	ASAH1	70	35
Cn1ccnc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1nccs1	ZINC000853808259	FD	On-Demand	Reactive	MAP1	62	36
COc1ccc(N2CC[C@H](CNC(=O)c3ncnn3C)C2)cc1	ZINC000853808280	DD	On-Demand	Clean	CACNA1I	53	34
CCOC(=O)CCCCCCCNC(=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853808292	FE	On-Demand	Anodyne	EPHX2	17	46
CCOC(=O)CCCCCCCNC(=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853808293	FE	On-Demand	Anodyne	EPHX2	17	46
COCc1n[nH]c(CNc2ccc([N+](=O)[O-])cc2C(C)=O)n1	ZINC000853808305	DD	On-Demand	Bother	CACNA1D	62	34
Cn1nccc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1cccc2cccnc12	ZINC000853808333	GE	On-Demand	Reactive	WNT3	17	40
CCO[C@@H]1C[C@@H](Nc2c(C(=O)OC)cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000853808385	EE	On-Demand	Bother	CACNA1C	45	37
CCO[C@@H]1C[C@@H](Nc2c(C(=O)OC)cc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000853808385	EE	On-Demand	Bother	CACNA1D	75	34
Cn1nccc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1nccs1	ZINC000853808386	FD	On-Demand	Reactive	MAP1	73	35
O=C1OCCN1[C@@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000853808471	EE	On-Demand	Anodyne	GRM5	21	46
O=C1OCCN1[C@H]1CCN(c2nc(-c3cccc(Cl)c3)no2)C1	ZINC000853808472	EE	On-Demand	Anodyne	GRM5	21	46
O=C1OCCN1[C@@H]1CCN(c2nc3ccccc3n3cccc23)C1	ZINC000853808491	DF	On-Demand	Anodyne	HTR3A	25	40
O=C1OCCN1[C@H]1CCN(c2nc3ccccc3n3cccc23)C1	ZINC000853808494	DF	On-Demand	Anodyne	HTR3A	25	40
C[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1cccc(C#N)c1	ZINC000853808511	GF	On-Demand	Mild	MAPK1	32	41
Cn1ncnc1C(=O)N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853808638	ED	On-Demand	Anodyne	SIRT3	53	48
Cn1ncnc1C(=O)N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853808638	ED	On-Demand	Anodyne	SIRT2	57	48
Cn1ncnc1C(=O)N1CCC(CCNC(=O)OC(C)(C)C)CC1	ZINC000853808638	ED	On-Demand	Anodyne	SIRT1	54	48
Cn1ccnc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1cccnc1Cl	ZINC000853808670	GD	On-Demand	Reactive	G2YM83_BOTF4	45	33
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000853808691	II	On-Demand	Anodyne	PTGER3	50	36
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000853808691	II	On-Demand	Anodyne	ACACA	19	40
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000853808691	II	On-Demand	Anodyne	F7	15	41
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000853808691	II	On-Demand	Anodyne	KCNK3	63	37
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)c1	ZINC000853808691	II	On-Demand	Anodyne	KCNK9	57	37
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)c1	ZINC000853808692	II	On-Demand	Anodyne	PTGER3	50	36
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)c1	ZINC000853808692	II	On-Demand	Anodyne	ACACA	19	40
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)c1	ZINC000853808692	II	On-Demand	Anodyne	F7	15	41
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)c1	ZINC000853808692	II	On-Demand	Anodyne	KCNK3	63	37
CC(=O)Nc1cccc(OCC(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)c1	ZINC000853808692	II	On-Demand	Anodyne	KCNK9	57	37
Cn1ncnc1C(=O)N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853808693	EC	On-Demand	Anodyne	CAPN2	46	32
Cn1ncnc1C(=O)N1C[C@H]2C[C@H]1[C@@H]2NC(=O)OCc1ccccc1	ZINC000853808693	EC	On-Demand	Anodyne	NAAA	40	39
Cn1ncnc1C(=O)N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853808694	EC	On-Demand	Anodyne	CAPN2	46	32
Cn1ncnc1C(=O)N1C[C@H]2C[C@H]1[C@H]2NC(=O)OCc1ccccc1	ZINC000853808694	EC	On-Demand	Anodyne	NAAA	40	39
Cn1cccc1CNC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853808701	DD	On-Demand	Anodyne	CASR	56	41
CCOC(=O)CCCCCCCNC(=O)N1CC2CC1(C)C2	ZINC000853808716	DG	On-Demand	Anodyne	EPHX2	30	55
CCOC(=O)CCCCCCCNC(=O)N1C[C@@H]2CCCC[C@@H]21	ZINC000853808718	DG	On-Demand	Anodyne	ASAH1	64	35
Cn1nccc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1ccccc1Cl	ZINC000853808757	GE	On-Demand	Reactive	EPHB3	49	33
CN1CCN(c2ccccc2NC(=O)N2C[C@@H]3CCCC[C@@H]32)CC1	ZINC000853808768	EF	On-Demand	Anodyne	KCNQ2	78	43
C[C@@H](NC(=O)NCCc1nnc(S)n1C)c1cccc(-n2cccn2)c1	ZINC000853808776	FD	On-Demand	Anodyne	AMP1_PLAFQ	50	34
O=C(CCn1cncn1)NNC(=S)Nc1cccc(Cl)c1	ZINC000853808778	DD	On-Demand	Reactive	HIS3	45	33
CC(C)n1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853808787	GF	On-Demand	Anodyne	G2YM83_BOTF4	46	34
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](N4CCOC4=O)C3)nc2)cc1	ZINC000853808826	FF	On-Demand	Anodyne	PRNP	41	37
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](N4CCOC4=O)C3)nc2)cc1	ZINC000853808826	FF	On-Demand	Anodyne	HDAC1	19	41
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](N4CCOC4=O)C3)nc2)cc1	ZINC000853808826	FF	On-Demand	Anodyne	MTOR	62	33
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](N4CCOC4=O)C3)nc2)cc1	ZINC000853808828	FF	On-Demand	Anodyne	PRNP	41	37
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](N4CCOC4=O)C3)nc2)cc1	ZINC000853808828	FF	On-Demand	Anodyne	HDAC1	19	41
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](N4CCOC4=O)C3)nc2)cc1	ZINC000853808828	FF	On-Demand	Anodyne	MTOR	62	33
CS(=O)(=O)c1ccc2ncnc(N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853808870	FD	On-Demand	Anodyne	PDE3A	41	35
CS(=O)(=O)c1ccc2ncnc(N3CC[C@@H](N4CCOC4=O)C3)c2c1	ZINC000853808870	FD	On-Demand	Anodyne	PDE3B	45	35
CS(=O)(=O)c1ccc2ncnc(N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853808872	FD	On-Demand	Anodyne	PDE3A	41	35
CS(=O)(=O)c1ccc2ncnc(N3CC[C@H](N4CCOC4=O)C3)c2c1	ZINC000853808872	FD	On-Demand	Anodyne	PDE3B	45	35
Cn1cccc1CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853808885	CD	On-Demand	Anodyne	CPT1A	102	38
Cn1cccc1CNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853808887	CD	On-Demand	Anodyne	CPT1A	102	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000853808918	GF	On-Demand	Mild	AMP1_PLAFQ	62	48
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000853808919	GF	On-Demand	Mild	AMP1_PLAFQ	62	48
COC(=O)c1nc(N2CC[C@@H](N3CCOC3=O)C2)sc1C	ZINC000853808950	DD	On-Demand	Anodyne	PARE	57	39
COC(=O)c1nc(N2CC[C@H](N3CCOC3=O)C2)sc1C	ZINC000853808951	DD	On-Demand	Anodyne	PARE	57	39
COc1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2ccnn2C)c1	ZINC000853808966	FD	On-Demand	Reactive	EPHX2	16	40
Cn1cccc1CNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853809003	DD	On-Demand	Anodyne	L3MBTL3	89	40
Cn1cccc1CNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853809004	DD	On-Demand	Anodyne	L3MBTL3	89	40
Cn1ncnc1C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000853809007	DC	On-Demand	Anodyne	GRIN2B	22	44
Cn1ncnc1C(=O)NC1CN(C(=O)OCc2ccccc2)C1	ZINC000853809007	DC	On-Demand	Anodyne	NPR	41	32
COCc1n[nH]c(CNc2ccc([N+](=O)[O-])c3nonc23)n1	ZINC000853809019	DD	On-Demand	Bother	GSTM2	108	40
COCc1n[nH]c(CNc2ccc([N+](=O)[O-])c3nonc23)n1	ZINC000853809019	DD	On-Demand	Bother	GSTP1	67	40
CCCNC(=O)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nc1	ZINC000853809039	DD	On-Demand	Anodyne	PLD1	42	34
CCCNC(=O)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nc1	ZINC000853809040	DD	On-Demand	Anodyne	PLD1	42	34
Cn1cccc1CNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853809073	FE	On-Demand	Anodyne	HTR1A	29	44
Cn1cccc1CNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853809073	FE	On-Demand	Anodyne	DRD2	15	43
Cn1cccc1CNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853809073	FE	On-Demand	Anodyne	DRD3	21	40
Cn1ccnc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1cccc(C#N)c1	ZINC000853809098	FD	On-Demand	Reactive	CCR3	17	40
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853809105	GF	On-Demand	Anodyne	CTSB	24	40
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853809105	GF	On-Demand	Anodyne	PAPA1_CARPA	44	44
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853809105	GF	On-Demand	Anodyne	TACR3	17	45
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853809105	GF	On-Demand	Anodyne	NPY5R	16	42
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@H](CO)Cc1ccccc1	ZINC000853809105	GF	On-Demand	Anodyne	FPR1	47	39
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853809106	GF	On-Demand	Anodyne	CTSB	24	40
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853809106	GF	On-Demand	Anodyne	PAPA1_CARPA	44	44
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853809106	GF	On-Demand	Anodyne	TACR3	17	45
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853809106	GF	On-Demand	Anodyne	NPY5R	16	42
CN(C(=O)NCC(C)(C)NC(=O)OC(C)(C)C)[C@@H](CO)Cc1ccccc1	ZINC000853809106	GF	On-Demand	Anodyne	FPR1	47	39
Cn1cccc1CNC(=O)N1CCn2c(O)nnc2C1	ZINC000853809143	CC	On-Demand	Anodyne	P2RX7	15	40
O=C1OCCN1[C@@H]1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853809282	ED	On-Demand	Bother	PDE3B	43	34
O=C1OCCN1[C@H]1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)C1	ZINC000853809284	ED	On-Demand	Bother	PDE3B	43	34
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853809290	GD	On-Demand	Anodyne	HTR3A	22	45
CN1CCN(c2nc3ccccc3nc2N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853809290	GD	On-Demand	Anodyne	HRH4	19	45
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853809292	GD	On-Demand	Anodyne	HTR3A	22	45
CN1CCN(c2nc3ccccc3nc2N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853809292	GD	On-Demand	Anodyne	HRH4	19	45
O=C(NCc1ccccc1)c1cc(N2CC[C@H](N3CCOC3=O)C2)ccn1	ZINC000853809405	FE	On-Demand	Anodyne	PDE11A	45	31
O=C(NCc1ccccc1)c1cc(N2CC[C@@H](N3CCOC3=O)C2)ccn1	ZINC000853809407	FE	On-Demand	Anodyne	PDE11A	45	31
Nc1nc(N2CC[C@H](N3CCOC3=O)C2)nc2ccccc12	ZINC000853809409	CD	On-Demand	Anodyne	HTR3A	16	49
Nc1nc(N2CC[C@@H](N3CCOC3=O)C2)nc2ccccc12	ZINC000853809411	CD	On-Demand	Anodyne	HTR3A	16	49
O=C1OCCN1[C@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000853809428	FD	On-Demand	Anodyne	PIK3CA	19	44
O=C1OCCN1[C@@H]1CCN(c2nc3ccccc3nc2N2CCOCC2)C1	ZINC000853809430	FD	On-Demand	Anodyne	PIK3CA	19	44
COCc1n[nH]c(CNc2ccnc3cc(OC)ccc23)n1	ZINC000853809431	CE	On-Demand	Anodyne	HRP1_PLAFA	65	44
COCc1n[nH]c(CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)n1	ZINC000853809465	ED	On-Demand	Bother	CACNA1D	49	33
CCOC(=O)CCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(=O)C2	ZINC000853809497	EF	On-Demand	Anodyne	EPHX2	15	46
CCOC(=O)CCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(=O)C2	ZINC000853809497	EF	On-Demand	Anodyne	ASAH1	76	36
C[C@H]1CN(c2ccc(NC(=O)N3C[C@@H]4CCCC[C@@H]43)cc2F)C[C@@H](C)O1	ZINC000853809542	FH	On-Demand	Anodyne	NPY2R	55	36
C[C@H]1CN(c2ccc(NC(=O)N3C[C@@H]4CCCC[C@@H]43)cc2F)C[C@H](C)O1	ZINC000853809543	FH	On-Demand	Anodyne	NPY2R	55	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000853809566	GF	On-Demand	Mild	AMP1_PLAFQ	44	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000853809567	GF	On-Demand	Mild	AMP1_PLAFQ	44	40
Cn1nccc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1cccnc1Cl	ZINC000853809604	GD	On-Demand	Reactive	G2YM83_BOTF4	58	34
O=C(NCc1ccnc(-n2ccnc2)c1)C(=O)C1CCSCC1	ZINC000853809608	ED	On-Demand	Anodyne	NOS2	102	40
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nc1	ZINC000853809621	GG	On-Demand	Anodyne	HDAC1	19	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nc1	ZINC000853809621	GG	On-Demand	Anodyne	TAAR1	23	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nc1	ZINC000853809621	GG	On-Demand	Anodyne	DGAT1	23	43
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nc1	ZINC000853809622	GG	On-Demand	Anodyne	HDAC1	19	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nc1	ZINC000853809622	GG	On-Demand	Anodyne	TAAR1	23	41
O=C(Nc1cccc(Cl)c1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nc1	ZINC000853809622	GG	On-Demand	Anodyne	DGAT1	23	43
O=C(Nc1nncs1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nc1	ZINC000853809641	FD	On-Demand	Anodyne	HDAC1	18	41
O=C(Nc1nncs1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nc1	ZINC000853809642	FD	On-Demand	Anodyne	HDAC1	18	41
O=C(NC1CCCC1)c1ccc(N2CC[C@@H](N3CCOC3=O)C2)nn1	ZINC000853809645	ED	On-Demand	Anodyne	SCD1	41	36
O=C(NC1CCCC1)c1ccc(N2CC[C@H](N3CCOC3=O)C2)nn1	ZINC000853809646	ED	On-Demand	Anodyne	SCD1	41	36
Cn1cccc1CNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853809707	EE	On-Demand	Anodyne	SLC6A3	24	46
CCOC(=O)CCCCCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853809730	EE	On-Demand	Anodyne	EPHX2	18	48
Cn1ccnc1[C@@H]1OCCC[C@H]1C(=O)NNC(=O)Nc1ccc(F)cc1	ZINC000853809777	FD	On-Demand	Reactive	CCR3	41	35
O=c1c2sc(-c3ccccc3)cc2nc(SCc2ccc(Cl)nc2)n1CCN1CCOCC1	ZINC000853809794	JJ	On-Demand	Anodyne	MCHR1	25	46
CON(C)CCNC(=O)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000853809818	DD	On-Demand	Anodyne	AMP1_PLAFQ	54	37
CON(C)CCNC(=O)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000853809819	DD	On-Demand	Anodyne	AMP1_PLAFQ	54	37
COC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1F)C2	ZINC000853809820	CD	On-Demand	Bother	CACNA1D	40	34
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2ccnn2C)c1	ZINC000853809841	FE	On-Demand	Reactive	KDR	18	41
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CCCO[C@H]2c2ccnn2C)c1	ZINC000853809841	FE	On-Demand	Reactive	KCNK3	43	37
COC(=O)C12CC(CN1c1ccc(C(C)=O)cc1[N+](=O)[O-])C2	ZINC000853809864	DD	On-Demand	Bother	TAAR1	19	40
Cn1cccc1CNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853809922	CF	On-Demand	Mild	IMDH_CRYPV	46	32
COCc1n[nH]c(CNc2cc([N+](=O)[O-])ccc2C(C)=O)n1	ZINC000853809946	DD	On-Demand	Bother	CACNA1D	62	33
COCc1n[nH]c(CNc2ccc(S(=O)(=O)C(F)(F)F)cc2)n1	ZINC000853810002	FD	On-Demand	Anodyne	GHSR	15	42
O=C1OCCN1[C@H]1CCN(c2cncc(Br)c2)C1	ZINC000853810034	DD	On-Demand	Anodyne	CHRNA3	25	49
Cn1ncnc1C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853810035	ED	On-Demand	Anodyne	SIRT3	56	40
Cn1ncnc1C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853810035	ED	On-Demand	Anodyne	SIRT2	58	40
Cn1ncnc1C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853810035	ED	On-Demand	Anodyne	SIRT1	56	40
Cn1ncnc1C(=O)NCCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853810035	ED	On-Demand	Anodyne	GPR119	54	44
O=C1OCCN1[C@@H]1CCN(c2cncc(Br)c2)C1	ZINC000853810036	DD	On-Demand	Anodyne	CHRNA3	25	49
Cn1ncnc1C(=O)NC[C@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853810047	DC	On-Demand	Anodyne	CACNA1I	63	34
Cn1ncnc1C(=O)NC[C@@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853810049	DC	On-Demand	Anodyne	CACNA1I	63	34
COC[C@H](NC(=O)NCc1cccn1C)c1cccc(OC)c1	ZINC000853810053	DE	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)NCc1cccn1C)c1cccc(OC)c1	ZINC000853810055	DE	On-Demand	Anodyne	DRD4	40	31
O=C(c1cccnc1N1CC[C@H](N2CCOC2=O)C1)N1CCCCC1	ZINC000853810108	ED	On-Demand	Anodyne	L3MBTL3	53	39
Cn1nc(C2CC2)nc1C(=O)NCc1ccnc(-n2ccnc2)c1	ZINC000853810134	DD	On-Demand	Anodyne	NOS2	109	40
CCO[C@@H]1C[C@@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853810153	CE	On-Demand	Anodyne	HRH4	15	41
CCO[C@@H]1C[C@@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853810153	CE	On-Demand	Anodyne	MAPK9	33	41
CCO[C@@H]1C[C@@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853810153	CE	On-Demand	Anodyne	MAPK8	38	40
COC(=O)C12CC(CN1c1ccnc(C(C)C)n1)C2	ZINC000853810157	CD	On-Demand	Anodyne	SORD	91	38
O=C(c1cccnc1N1CC[C@@H](N2CCOC2=O)C1)N1CCCCC1	ZINC000853810213	ED	On-Demand	Anodyne	L3MBTL3	53	39
Cn1cccc1CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853810244	ED	On-Demand	Anodyne	SIGMAR1	25	44
Cn1cccc1CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853810244	ED	On-Demand	Anodyne	CCR3	43	42
Cn1cccc1CNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853810244	ED	On-Demand	Anodyne	MCHR1	25	47
Cn1cccc1CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853810245	ED	On-Demand	Anodyne	SIGMAR1	25	44
Cn1cccc1CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853810245	ED	On-Demand	Anodyne	CCR3	43	42
Cn1cccc1CNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853810245	ED	On-Demand	Anodyne	MCHR1	25	47
Cn1cccc1CNC(=O)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853810261	DC	On-Demand	Anodyne	L3MBTL3	52	34
Cn1cccc1CNC(=O)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853810263	DC	On-Demand	Anodyne	L3MBTL3	52	34
N#Cc1cc(N2CC[C@@H](N3CCOC3=O)C2)ccc1C(F)(F)F	ZINC000853810391	EF	On-Demand	Mild	AR	31	44
N#Cc1cc(N2CC[C@H](N3CCOC3=O)C2)ccc1C(F)(F)F	ZINC000853810392	EF	On-Demand	Mild	AR	31	44
O=C1OCCN1[C@@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000853810485	DF	On-Demand	Anodyne	LUCI_LUCLA	19	43
O=C1OCCN1[C@H]1CCN(c2ncc(-c3ccccc3)s2)C1	ZINC000853810486	DF	On-Demand	Anodyne	LUCI_LUCLA	19	43
N#Cc1ccc(N2CC[C@@H](N3CCOC3=O)C2)cc1Cl	ZINC000853810515	CE	On-Demand	Mild	AR	31	50
N#Cc1ccc(N2CC[C@H](N3CCOC3=O)C2)cc1Cl	ZINC000853810516	CE	On-Demand	Mild	AR	31	50
Cn1ncnc1C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F	ZINC000853810521	FD	On-Demand	Anodyne	GPR119	41	37
Cn1ncnc1C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)CC1(F)F	ZINC000853810522	FD	On-Demand	Anodyne	GPR119	41	37
C#Cc1cccnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810583	DF	On-Demand	Mild	ACHE	24	46
C#Cc1cccnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810583	DF	On-Demand	Mild	GRIN2B	17	40
C#Cc1cccnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810583	DF	On-Demand	Mild	SIGMAR1	17	46
O=S(=O)(c1ccccc1NCC1CCN(Cc2ccncc2)CC1)C(F)F	ZINC000853810602	GG	On-Demand	Anodyne	ACHE	35	43
O=S(=O)(c1ccccc1NCC1CCN(Cc2ccncc2)CC1)C(F)F	ZINC000853810602	GG	On-Demand	Anodyne	SIGMAR1	29	44
O=[N+]([O-])c1c(NCC2CCN(Cc3ccncc3)CC2)nc2ccccn12	ZINC000853810624	FF	On-Demand	Bother	ACHE	26	42
O=[N+]([O-])c1c(NCC2CCN(Cc3ccncc3)CC2)nc2ccccn12	ZINC000853810624	FF	On-Demand	Bother	SIGMAR1	16	40
O=[N+]([O-])c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810627	EG	On-Demand	Bother	ACHE	28	42
O=[N+]([O-])c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810627	EG	On-Demand	Bother	SIGMAR1	26	46
CCC1(CNC(=O)NNc2nc3ccc(Cl)cc3s2)CCOCC1	ZINC000853810630	FH	On-Demand	Reactive	CSNK1D	37	42
COc1cc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853810644	GG	On-Demand	Bother	DRD4	17	41
COc1cc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853810644	GG	On-Demand	Bother	ACHE	34	47
COc1cc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853810644	GG	On-Demand	Bother	SSTR5	57	40
O=[N+]([O-])c1ccc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])c1	ZINC000853810663	FG	On-Demand	Bother	ACHE	33	45
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	CA2	81	48
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	CA1	72	48
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	CA7	49	45
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	CA4	66	46
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	CA14	36	45
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	CA12	50	46
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	CA9	56	48
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	MTCA1	47	42
CC[C@@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810672	ED	On-Demand	Anodyne	P96878_MYCTU	60	42
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	CA2	81	48
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	CA1	72	48
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	CA7	49	45
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	CA4	66	46
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	CA14	36	45
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	CA12	50	46
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	CA9	56	48
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	MTCA1	47	42
CC[C@H]1CN(C)CCCN1C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853810673	ED	On-Demand	Anodyne	P96878_MYCTU	60	42
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA2	102	49
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA1	90	49
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA7	49	41
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CCR3	50	48
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA4	75	46
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA5A	42	38
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA14	46	41
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	EPHX2	44	45
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	TGM2	46	38
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA12	80	49
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CA9	79	47
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	CACNA1I	60	38
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	F13A1	75	40
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	NCE103	32	45
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	MTCA1	56	49
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	P96878_MYCTU	70	49
NS(=O)(=O)c1ccc(NC(=O)NCC2CCN(CC(F)F)CC2)cc1	ZINC000853810689	GD	On-Demand	Anodyne	NAMPT	42	41
COc1ccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc2c1	ZINC000853810703	FH	On-Demand	Anodyne	ACHE	22	43
COc1ccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc2c1	ZINC000853810703	FH	On-Demand	Anodyne	HRP1_PLAFA	118	48
COc1ccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc2c1	ZINC000853810703	FH	On-Demand	Anodyne	FGFR2	24	40
COc1ccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc2c1	ZINC000853810703	FH	On-Demand	Anodyne	SIGMAR1	17	47
COc1ccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc2c1	ZINC000853810703	FH	On-Demand	Anodyne	SSTR5	57	37
COc1ccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc2c1	ZINC000853810703	FH	On-Demand	Anodyne	HNMT	67	39
COc1ccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc2c1	ZINC000853810703	FH	On-Demand	Anodyne	MCHR1	18	47
Nc1ccc([N+](=O)[O-])c(NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853810704	EF	On-Demand	Bother	ACHE	22	40
O=C(NCC1CCN(CC(F)F)CC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853810709	FC	On-Demand	Anodyne	CACNA1I	46	38
O=C(NCC1CCN(CC(F)F)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853810713	GF	On-Demand	Bother	CCR3	20	43
O=C(NCC1CCN(CC(F)F)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853810713	GF	On-Demand	Bother	CACNA1I	55	38
Cn1ccnc1C(=O)N[C@@H]1CCCN(CC(F)(F)F)C1	ZINC000853810715	CD	On-Demand	Anodyne	HPGDS	37	42
Cn1ccnc1C(=O)N[C@H]1CCCN(CC(F)(F)F)C1	ZINC000853810716	CD	On-Demand	Anodyne	HPGDS	37	42
O=C(NCC1CCN(CC(F)F)CC1)OCC(F)(F)F	ZINC000853810719	DE	On-Demand	Anodyne	CACNA1I	61	41
N#Cc1c(NCC2CCN(Cc3ccncc3)CC2)cccc1S(N)(=O)=O	ZINC000853810721	GD	On-Demand	Mild	ACHE	17	42
CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2S(=O)(=O)N(C)OC)C1	ZINC000853810740	FD	On-Demand	Bother	TBXA2R	20	42
c1cc(CN2CCC(CNc3ncnc4c3CCC4)CC2)ccn1	ZINC000853810757	DF	On-Demand	Anodyne	ACHE	17	43
C#CCNC(=O)c1ccc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853810773	FE	On-Demand	Mild	ACHE	30	47
C#CCNC(=O)c1ccc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853810773	FE	On-Demand	Mild	SSTR5	51	44
C#CCNC(=O)c1ccc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853810773	FE	On-Demand	Mild	IKBKB	17	42
C#CCNC(=O)c1ccc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853810773	FE	On-Demand	Mild	MCHR1	23	42
C#CCNC(=O)c1ccc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853810773	FE	On-Demand	Mild	CACNA1I	82	45
N#Cc1cc(S(N)(=O)=O)ccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810780	GD	On-Demand	Mild	ACHE	28	42
N#Cc1cc(S(N)(=O)=O)ccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810780	GD	On-Demand	Mild	SSTR5	15	40
COC(=O)c1sc(NCC2CCN(Cc3ccncc3)CC2)nc1Cl	ZINC000853810781	GG	On-Demand	Anodyne	ACHE	28	45
COC(=O)c1sc(NCC2CCN(Cc3ccncc3)CC2)nc1Cl	ZINC000853810781	GG	On-Demand	Anodyne	SIGMAR1	27	42
COC(=O)c1sc(NCC2CCN(Cc3ccncc3)CC2)nc1Cl	ZINC000853810781	GG	On-Demand	Anodyne	SSTR5	42	34
COC(=O)c1sc(NCC2CCN(Cc3ccncc3)CC2)nc1Cl	ZINC000853810781	GG	On-Demand	Anodyne	PDK1	33	40
COC(=O)c1sc(NCC2CCN(Cc3ccncc3)CC2)nc1Cl	ZINC000853810781	GG	On-Demand	Anodyne	CACNA1I	52	39
O=C(NCC1CCN(CC(F)F)CC1)C(=O)C1CCSCC1	ZINC000853810800	ED	On-Demand	Anodyne	CACNA1I	39	40
COC[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810801	EG	On-Demand	Bother	CACNA1D	44	34
COC[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810801	EG	On-Demand	Bother	TAAR1	20	46
COC[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810802	EG	On-Demand	Bother	CACNA1D	44	34
COC[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810802	EG	On-Demand	Bother	TAAR1	20	46
O=[N+]([O-])c1ccc2nc(NCC3CCN(Cc4ccncc4)CC3)sc2c1	ZINC000853810803	GH	On-Demand	Bother	SSTR5	23	40
CC(=O)c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810806	EH	On-Demand	Anodyne	ACHE	39	46
CC(=O)c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810806	EH	On-Demand	Anodyne	HTR4	45	39
CC(=O)c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810806	EH	On-Demand	Anodyne	SIGMAR1	34	45
CC(=O)c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810806	EH	On-Demand	Anodyne	SSTR5	43	33
CC(=O)c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810806	EH	On-Demand	Anodyne	CCR3	56	41
CC(=O)c1c(F)cccc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810806	EH	On-Demand	Anodyne	CACNA1I	51	38
O=C(NNC(=S)Nc1cccc(Cl)c1)C1C[C@@H]2CCC[C@H](C1)C2=O	ZINC000853810813	FG	On-Demand	Reactive	GRM5	15	46
Nc1ccc(NCC2CCN(Cc3ccncc3)CC2)c([N+](=O)[O-])c1	ZINC000853810835	EF	On-Demand	Bother	ACHE	33	42
COC[C@@H](Nc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810837	GH	On-Demand	Bother	NR1H4	37	41
COC[C@@H](Nc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810837	GH	On-Demand	Bother	TAAR1	22	48
COC[C@H](Nc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810838	GH	On-Demand	Bother	NR1H4	37	41
COC[C@H](Nc1ccc(/C=C\C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810838	GH	On-Demand	Bother	TAAR1	22	48
COC[C@H](Nc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810839	GH	On-Demand	Bother	NR1H4	37	41
COC[C@H](Nc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810839	GH	On-Demand	Bother	TAAR1	22	48
COC[C@@H](Nc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810840	GH	On-Demand	Bother	NR1H4	37	41
COC[C@@H](Nc1ccc(/C=C/C(=O)OC)cc1[N+](=O)[O-])c1cccc(OC)c1	ZINC000853810840	GH	On-Demand	Bother	TAAR1	22	48
Cc1nc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)sc1-c1ccccc1	ZINC000853810859	FF	On-Demand	Anodyne	PIK3CG	19	50
Cc1nc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)sc1-c1ccccc1	ZINC000853810859	FF	On-Demand	Anodyne	PI4KB	38	44
O=C(NCC1CCN(CC(F)F)CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853810879	GF	On-Demand	Bother	CACNA1I	54	38
c1ccc(COc2cc(NCC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000853810883	GH	On-Demand	Anodyne	DRD4	23	40
c1ccc(COc2cc(NCC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000853810883	GH	On-Demand	Anodyne	ACHE	48	45
c1ccc(COc2cc(NCC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000853810883	GH	On-Demand	Anodyne	GRIN2B	28	50
c1ccc(COc2cc(NCC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000853810883	GH	On-Demand	Anodyne	SIGMAR1	38	45
c1ccc(COc2cc(NCC3CCN(Cc4ccncc4)CC3)ncn2)cc1	ZINC000853810883	GH	On-Demand	Anodyne	SSTR5	42	34
COC(=O)c1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853810887	EF	On-Demand	Anodyne	DRD4	28	42
COC(=O)c1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853810887	EF	On-Demand	Anodyne	ACHE	43	44
COC(=O)c1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853810887	EF	On-Demand	Anodyne	GRIN2B	21	40
COC(=O)c1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853810887	EF	On-Demand	Anodyne	SIGMAR1	38	41
COC(=O)c1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853810887	EF	On-Demand	Anodyne	SSTR5	52	35
COC(=O)c1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853810887	EF	On-Demand	Anodyne	FAAH	20	42
COC(=O)c1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853810887	EF	On-Demand	Anodyne	CACNA1I	48	38
FC(F)(F)c1ccc(NCC2CCN(Cc3ccncc3)CC2)nc1Cl	ZINC000853810888	GI	On-Demand	Anodyne	ACHE	18	40
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810893	FH	On-Demand	Bother	ACHE	27	44
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810893	FH	On-Demand	Bother	SIGMAR1	17	44
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810893	FH	On-Demand	Bother	CACNA1I	43	37
O=[N+]([O-])c1ccc(NCC2CCN(Cc3ccncc3)CC2)c2nonc12	ZINC000853810909	FF	On-Demand	Bother	ACHE	23	41
O=[N+]([O-])c1ccc(NCC2CCN(Cc3ccncc3)CC2)c2nonc12	ZINC000853810909	FF	On-Demand	Bother	GSTM2	107	43
O=[N+]([O-])c1ccc(NCC2CCN(Cc3ccncc3)CC2)c2nonc12	ZINC000853810909	FF	On-Demand	Bother	GSTP1	67	43
O=[N+]([O-])c1ccc(NCC2CCN(Cc3ccncc3)CC2)c2nonc12	ZINC000853810909	FF	On-Demand	Bother	EPAS1	41	31
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1SCC(=O)N1CCc2ccccc21	ZINC000853810911	JJ	On-Demand	Reactive	AVPR2	51	38
Cc1nc(C(=O)N2CCN(c3cccc(Cl)c3)C[C@@H]2C)no1	ZINC000853810914	DE	On-Demand	Anodyne	LIMK2	42	42
Cc1nc(C(=O)N2CCN(c3cccc(Cl)c3)C[C@H]2C)no1	ZINC000853810915	DE	On-Demand	Anodyne	LIMK2	42	42
Fc1cccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc12	ZINC000853810916	FI	On-Demand	Anodyne	ACHE	22	44
Fc1cccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc12	ZINC000853810916	FI	On-Demand	Anodyne	HRP1_PLAFA	48	37
Fc1cccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc12	ZINC000853810916	FI	On-Demand	Anodyne	SIGMAR1	21	48
Fc1cccc2c(NCC3CCN(Cc4ccncc4)CC3)ccnc12	ZINC000853810916	FI	On-Demand	Anodyne	HNMT	51	33
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853810922	FC	On-Demand	Anodyne	STAT6	47	32
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810926	FG	On-Demand	Bother	ACHE	37	47
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810926	FG	On-Demand	Bother	SIGMAR1	28	44
Cc1nc(C(=O)NCC2CCN(CC(F)F)CC2)no1	ZINC000853810927	CD	On-Demand	Anodyne	HTR4	51	40
Cc1nc(C(=O)NCC2CCN(CC(F)F)CC2)no1	ZINC000853810927	CD	On-Demand	Anodyne	CACNA1I	69	44
Fc1cnc(NCC2CCN(Cc3ccncc3)CC2)cn1	ZINC000853810956	DE	On-Demand	Anodyne	ACHE	17	41
Fc1cnc(NCC2CCN(Cc3ccncc3)CC2)cn1	ZINC000853810956	DE	On-Demand	Anodyne	SIGMAR1	21	54
CC(C)(C)OC(=O)CCCNC(=O)N[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853810961	GF	On-Demand	Anodyne	EPHX2	18	51
CC(C)(C)OC(=O)CCCNC(=O)N[C@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853810962	GF	On-Demand	Anodyne	EPHX2	18	51
NC(=O)c1cc(Cl)nnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810978	FD	On-Demand	Anodyne	ACHE	40	48
NC(=O)c1cc(Cl)nnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810978	FD	On-Demand	Anodyne	GRIN2B	19	41
NC(=O)c1cc(Cl)nnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810978	FD	On-Demand	Anodyne	SIGMAR1	30	42
NC(=O)c1cc(Cl)nnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810978	FD	On-Demand	Anodyne	SSTR5	46	35
NC(=O)c1cc(Cl)nnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810978	FD	On-Demand	Anodyne	MCHR1	25	49
NC(=O)c1cc(Cl)nnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810978	FD	On-Demand	Anodyne	CACNA1I	62	41
FC(F)(F)c1cc(Cl)nc(NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853810987	GI	On-Demand	Anodyne	ACHE	28	45
FC(F)(F)c1cc(Cl)nc(NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853810987	GI	On-Demand	Anodyne	SIGMAR1	17	45
FC(F)(F)c1cc(Cl)nc(NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853810987	GI	On-Demand	Anodyne	MCHR1	21	40
FC(F)(F)c1cc(Cl)nc(NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000853810987	GI	On-Demand	Anodyne	CACNA1I	51	43
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	CA2	62	62
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	CA1	56	62
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	CA4	51	44
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	EPHX2	62	43
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	CA12	47	62
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	CA9	47	62
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	NCE103	15	46
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	MTCA1	54	62
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810990	GD	On-Demand	Anodyne	P96878_MYCTU	67	62
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	CA2	62	62
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	CA1	56	62
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	CA4	51	44
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	EPHX2	62	43
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	CA12	47	62
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	CA9	47	62
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	NCE103	15	46
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	MTCA1	54	62
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCN(CC(F)(F)F)C2)cc1	ZINC000853810991	GD	On-Demand	Anodyne	P96878_MYCTU	67	62
Cn1ccnc1C(=O)NCC1CCN(CC(F)F)CC1	ZINC000853811006	CD	On-Demand	Anodyne	HTR4	62	42
Cn1ccnc1C(=O)NCC1CCN(CC(F)F)CC1	ZINC000853811006	CD	On-Demand	Anodyne	CACNA1I	82	46
Fc1ncnc(NCC2CCN(Cc3ccncc3)CC2)c1Br	ZINC000853811009	GG	On-Demand	Anodyne	ACHE	17	44
Fc1ncnc(NCC2CCN(Cc3ccncc3)CC2)c1Br	ZINC000853811009	GG	On-Demand	Anodyne	SIGMAR1	19	52
CCO[C@@H]1C[C@@H](Nc2nc3c(F)cccc3o2)C1	ZINC000853811020	CF	On-Demand	Anodyne	SSTR5	48	43
CC(=O)c1ccc(C#N)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811025	EG	On-Demand	Mild	ACHE	30	43
CC(=O)c1ccc(C#N)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811025	EG	On-Demand	Mild	SIGMAR1	23	43
CC(=O)c1ccc(C#N)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811025	EG	On-Demand	Mild	CCR3	29	42
CC(=O)c1ccc(C#N)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811025	EG	On-Demand	Mild	CACNA1I	51	38
COCCc1nsc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811036	EE	On-Demand	Anodyne	ACHE	16	44
Cc1cc(C(F)(F)F)c(NCC2CCN(Cc3ccncc3)CC2)nn1	ZINC000853811038	FH	On-Demand	Anodyne	ACHE	27	43
CC(C)(C)OC(=O)C(=O)NCC1CCN(CC(F)F)CC1	ZINC000853811051	DD	On-Demand	Anodyne	CACNA1I	66	46
Fc1cccc2oc(NCC3CCN(Cc4ccncc4)CC3)nc12	ZINC000853811085	EH	On-Demand	Anodyne	ACHE	25	46
Fc1cccc2oc(NCC3CCN(Cc4ccncc4)CC3)nc12	ZINC000853811085	EH	On-Demand	Anodyne	SIGMAR1	26	48
Fc1cccc2oc(NCC3CCN(Cc4ccncc4)CC3)nc12	ZINC000853811085	EH	On-Demand	Anodyne	SSTR5	38	40
C#Cc1cnc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853811091	DE	On-Demand	Mild	ACHE	15	40
C#Cc1cnc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853811091	DE	On-Demand	Mild	GRIN2B	18	44
C#Cc1cnc(NCC2CCN(Cc3ccncc3)CC2)nc1	ZINC000853811091	DE	On-Demand	Mild	SIGMAR1	18	50
O=C(Nc1ccc(Cl)nc1)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853811093	DD	On-Demand	Anodyne	CCKBR	15	47
CCO[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2C(C)=O)C1	ZINC000853811101	CF	On-Demand	Bother	SLC27A4	43	33
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853811112	FD	On-Demand	Anodyne	CCKBR	46	35
c1cc(CN2CCC(CNc3nccc(N4CCCC4)n3)CC2)ccn1	ZINC000853811114	FF	On-Demand	Anodyne	ACHE	24	41
c1cc(CN2CCC(CNc3nccc(N4CCCC4)n3)CC2)ccn1	ZINC000853811114	FF	On-Demand	Anodyne	GRIN2B	19	45
c1cc(CN2CCC(CNc3nccc(N4CCCC4)n3)CC2)ccn1	ZINC000853811114	FF	On-Demand	Anodyne	SIGMAR1	16	46
c1cc(CN2CCC(CNc3nccc(N4CCCC4)n3)CC2)ccn1	ZINC000853811114	FF	On-Demand	Anodyne	MRGPRX1	46	42
N#Cc1cc2ccccc2nc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811117	FH	On-Demand	Mild	ACHE	39	53
N#Cc1cc2ccccc2nc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811117	FH	On-Demand	Mild	SIGMAR1	21	45
Cc1noc(C)c1COc1ccccc1C(=O)NNC(=S)Nc1cccc(Cl)c1	ZINC000853811123	II	On-Demand	Reactive	PPIA	30	40
Cc1noc(C)c1COc1ccccc1C(=O)NNC(=S)Nc1cccc(Cl)c1	ZINC000853811123	II	On-Demand	Reactive	KCNK3	60	40
Cc1noc(C)c1COc1ccccc1C(=O)NNC(=S)Nc1cccc(Cl)c1	ZINC000853811123	II	On-Demand	Reactive	KCNK9	64	40
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	CA2	68	50
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	CA1	65	42
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	CA4	48	47
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	CA14	40	38
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	CA12	59	50
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	CA9	58	50
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	NCE103	23	40
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	MTCA1	57	50
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	P96878_MYCTU	71	50
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)cc1	ZINC000853811166	FC	On-Demand	Anodyne	NAMPT	44	37
CCO[C@@H]1C[C@@H](Nc2ccnc3cc(OC)ccc23)C1	ZINC000853811181	CG	On-Demand	Anodyne	HRP1_PLAFA	48	39
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@H](O)[C@H]2n2cccn2)CC1	ZINC000853811187	FD	On-Demand	Anodyne	KCNQ2	70	38
Fc1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811188	DF	On-Demand	Anodyne	ACHE	31	43
Fc1cccc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811188	DF	On-Demand	Anodyne	SIGMAR1	31	51
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](CCO)CC(C)C)C2)cc1	ZINC000853811191	FF	On-Demand	Clean	MTNR1A	15	45
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](CCO)CC(C)C)C2)cc1	ZINC000853811192	FF	On-Demand	Clean	MTNR1A	15	45
Nc1nc(Cl)cc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811202	EE	On-Demand	Anodyne	ACHE	26	43
Nc1nc(Cl)cc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811202	EE	On-Demand	Anodyne	SIGMAR1	18	45
Nc1nc(Cl)cc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811202	EE	On-Demand	Anodyne	SSTR5	40	35
Nc1nc(Cl)cc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811202	EE	On-Demand	Anodyne	HRH4	20	42
Nc1nc(Cl)cc(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853811202	EE	On-Demand	Anodyne	CACNA1I	48	39
O=[N+]([O-])c1ccc(Cl)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811212	FH	On-Demand	Bother	ACHE	22	41
O=[N+]([O-])c1ccc(Cl)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811212	FH	On-Demand	Bother	SIGMAR1	19	43
O=[N+]([O-])c1ccc(Cl)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811212	FH	On-Demand	Bother	PRKCQ	24	40
O=[N+]([O-])c1ccc(Cl)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811212	FH	On-Demand	Bother	MCHR1	17	41
O=[N+]([O-])c1ccc(Cl)cc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811212	FH	On-Demand	Bother	CACNA1I	47	38
Fc1nc(F)c(F)c(NCC2CCN(Cc3ccncc3)CC2)c1F	ZINC000853811225	FG	On-Demand	Anodyne	ACHE	22	42
Fc1nc(F)c(F)c(NCC2CCN(Cc3ccncc3)CC2)c1F	ZINC000853811225	FG	On-Demand	Anodyne	SIGMAR1	24	53
NC(=O)c1cc(=NCC2CCN(Cc3ccncc3)CC2)cc[nH]1	ZINC000853811226	ED	On-Demand	Anodyne	ACHE	20	42
CN(C)C(=O)c1cc(=NCC2CCN(Cc3ccncc3)CC2)cc[nH]1	ZINC000853811229	FD	On-Demand	Anodyne	ACHE	22	44
Fc1cc(NCC2CCN(Cc3ccncc3)CC2)ncn1	ZINC000853811231	DE	On-Demand	Anodyne	ACHE	22	40
Fc1cc(NCC2CCN(Cc3ccncc3)CC2)ncn1	ZINC000853811231	DE	On-Demand	Anodyne	SIGMAR1	22	53
Fc1cc(NCC2CCN(Cc3ccncc3)CC2)ncn1	ZINC000853811231	DE	On-Demand	Anodyne	SSTR5	46	35
C#CCCCOc1cccnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811233	FH	On-Demand	Mild	ACHE	18	45
C#CCCCOc1cccnc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853811233	FH	On-Demand	Mild	GRIN2B	15	40
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853811237	JI	On-Demand	Reactive	PPIA	31	48
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853811237	JI	On-Demand	Reactive	GRM4	23	42
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853811237	JI	On-Demand	Reactive	PRTN3	50	36
CCN(CC)C(=O)CN1CCC(NC(=O)c2nccn2C)CC1	ZINC000853811257	DC	On-Demand	Anodyne	SSTR5	49	40
CON(C)CCNC(=O)Nc1cccc(CN(C)C)c1	ZINC000853811292	CD	On-Demand	Anodyne	ROCK2	27	47
C[C@H]1CN(c2ccc(NC(=O)N(C)Cc3cnc[nH]3)cc2F)C[C@@H](C)O1	ZINC000853811335	FF	On-Demand	Anodyne	NPY2R	63	34
C[C@H]1CN(c2ccc(NC(=O)N(C)Cc3cnc[nH]3)cc2F)C[C@H](C)O1	ZINC000853811337	FF	On-Demand	Anodyne	NPY2R	63	34
CON(C)CCNC(=O)Nc1ccccc1C(C)C	ZINC000853811355	CE	On-Demand	Anodyne	SOAT1	54	39
CON(C)CCNC(=O)Nc1ccc(Cl)cc1Cl	ZINC000853811362	CF	On-Demand	Anodyne	PYGL	19	42
CON(C)CCNC(=O)Nc1ccc(Cl)cc1Cl	ZINC000853811362	CF	On-Demand	Anodyne	ALPL	40	37
O=C(N1C[C@@H](Nc2nccc(N3CCCC3)n2)Cc2ccccc21)C(F)(F)F	ZINC000853811366	GG	On-Demand	Anodyne	MAPK9	26	40
O=C(N1C[C@H](Nc2nccc(N3CCCC3)n2)Cc2ccccc21)C(F)(F)F	ZINC000853811367	GG	On-Demand	Anodyne	MAPK9	26	40
CON(C)CCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853811427	CE	On-Demand	Anodyne	EPHX2	15	46
CON(C)CCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853811427	CE	On-Demand	Anodyne	ERBB4	40	37
CON(C)CCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853811427	CE	On-Demand	Anodyne	MCHR1	30	45
COC(=O)c1ccc(C)c(NC(=O)NCCN(C)OC)c1	ZINC000853811513	CD	On-Demand	Anodyne	MAPK14	15	40
CON(C)CCNC(=O)N1CCc2ccccc2C1	ZINC000853811514	CD	On-Demand	Anodyne	BCL2	15	40
CON(C)CCNC(=O)N1CCc2ccccc2C1	ZINC000853811514	CD	On-Demand	Anodyne	NOD2	41	37
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	HTR1A	47	39
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	DRD2	41	40
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	ADRA1D	35	42
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	HTR1D	16	40
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	HTR1B	20	40
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	ADRA1A	31	42
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	DRD3	58	38
CON(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853811521	DD	On-Demand	Anodyne	KCNQ2	82	44
CON(C)CCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853811538	DC	On-Demand	Anodyne	F10	42	33
CON(C)CCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853811538	DC	On-Demand	Anodyne	EPHB4	57	32
CON(C)CCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853811538	DC	On-Demand	Anodyne	STAT6	55	37
Cn1cnc2c(N[C@@H]3Cc4ccccc4N(C(=O)C(F)(F)F)C3)ncnc21	ZINC000853811544	GE	On-Demand	Anodyne	ADORA1	19	48
Cn1cnc2c(N[C@H]3Cc4ccccc4N(C(=O)C(F)(F)F)C3)ncnc21	ZINC000853811545	GE	On-Demand	Anodyne	ADORA1	19	48
CON(C)CCNC(=O)Nc1cc(C)nn1-c1cccc(C(F)(F)F)c1	ZINC000853811600	FF	On-Demand	Anodyne	MAPK14	17	46
CON(C)CCNC(=O)Nc1cc(C)nn1-c1cccc(C(F)(F)F)c1	ZINC000853811600	FF	On-Demand	Anodyne	CARM1	42	36
CON(C)CCNC(=O)Nc1cc(C)nn1-c1cccc(C(F)(F)F)c1	ZINC000853811600	FF	On-Demand	Anodyne	PDS	41	36
CON(C)CCNC(=O)Nc1ccc(F)cc1	ZINC000853811601	BD	On-Demand	Anodyne	ADRB1	24	40
CON(C)CCNC(=O)Nc1ccc(F)cc1	ZINC000853811601	BD	On-Demand	Anodyne	CCR3	24	42
CC[C@H](C)N(CC)C(=O)Nc1cccc(NC(C)=O)c1	ZINC000853811605	CG	On-Demand	Anodyne	KCNK3	107	39
CC[C@H](C)N(CC)C(=O)Nc1cccc(NC(C)=O)c1	ZINC000853811605	CG	On-Demand	Anodyne	KCNK9	80	39
CC[C@H](C)N(CC)C(=O)Nc1cccc(Br)c1	ZINC000853811609	CI	On-Demand	Anodyne	EGFR	46	43
CC[C@H](C)N(CC)C(=O)Nc1cccc(Br)c1	ZINC000853811609	CI	On-Demand	Anodyne	KCNK3	55	34
CC[C@H](C)N(CC)C(=O)Nc1cccc(Br)c1	ZINC000853811609	CI	On-Demand	Anodyne	KCNK9	52	34
CC[C@H](C)N(CC)C(=O)Nc1ccc2c(c1)OCO2	ZINC000853811618	CG	On-Demand	Anodyne	DYRK2	41	35
CON(C)CCNC(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000853811620	GG	On-Demand	Anodyne	RAF1	17	40
CON(C)CCNC(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000853811620	GG	On-Demand	Anodyne	SCD1	45	59
CON(C)CCNC(=O)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000853811620	GG	On-Demand	Anodyne	SCD	53	59
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)c3c[nH]c(C#N)c3)CC2)C1	ZINC000853811624	GG	On-Demand	Mild	GPR119	25	44
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)c3c[nH]c(C#N)c3)CC2)C1	ZINC000853811625	GG	On-Demand	Mild	GPR119	25	44
CC[C@H](C)N(CC)C(=O)Nc1nc(CN2CCOCC2)cs1	ZINC000853811633	EF	On-Demand	Anodyne	CASR	31	41
CON(C)CCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853811639	CD	On-Demand	Bother	CACNA1C	55	37
CON(C)CCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853811639	CD	On-Demand	Bother	CACNA1D	83	38
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)C(=O)NC3CC3)CC2)C1	ZINC000853811648	GE	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)C(=O)NC3CC3)CC2)C1	ZINC000853811649	GE	On-Demand	Anodyne	GPR119	18	42
CON(C)CCNC(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000853811651	DC	On-Demand	Anodyne	CCR3	41	40
CON(C)CCNC(=O)Nc1cccc(F)c1	ZINC000853811655	BD	On-Demand	Anodyne	CCR3	38	42
CON(C)CCNC(=O)Nc1cccc(F)c1	ZINC000853811655	BD	On-Demand	Anodyne	KCNK3	51	39
CON(C)CCNC(=O)Nc1cccc(F)c1	ZINC000853811655	BD	On-Demand	Anodyne	KCNK9	53	39
CON(C)CCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853811663	ED	On-Demand	Anodyne	NPY1R	29	40
CON(C)CCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853811663	ED	On-Demand	Anodyne	CCR3	55	41
CON(C)CCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853811663	ED	On-Demand	Anodyne	CCKBR	48	36
COC(=O)c1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811665	CD	On-Demand	Anodyne	ROCK2	17	40
COC(=O)c1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811665	CD	On-Demand	Anodyne	EPHX2	15	49
COC(=O)c1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811665	CD	On-Demand	Anodyne	KCNK3	96	37
COC(=O)c1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811665	CD	On-Demand	Anodyne	KCNK9	67	35
Cc1nc(C(=O)N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n(C)n1	ZINC000853811669	GF	On-Demand	Anodyne	GPR119	18	42
Cc1nc(C(=O)N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n(C)n1	ZINC000853811670	GF	On-Demand	Anodyne	GPR119	18	42
Cc1nsc(C(=O)N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853811688	GG	On-Demand	Anodyne	GPR119	17	42
Cc1nsc(C(=O)N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)n1	ZINC000853811689	GG	On-Demand	Anodyne	GPR119	17	42
CCOC(=O)c1coc(N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)n1	ZINC000853811695	GF	On-Demand	Anodyne	TPP2	58	36
CCOC(=O)c1coc(N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)n1	ZINC000853811696	GF	On-Demand	Anodyne	TPP2	58	36
CN(Cc1cnc[nH]1)C(=O)C(C)(F)F	ZINC000853811751	BD	On-Demand	Anodyne	TAAR1	27	42
CN(C(=O)Nc1cccnc1Cl)[C@@H](CO)Cc1ccccc1	ZINC000853811776	DF	On-Demand	Anodyne	NPY5R	25	45
CN(C(=O)Nc1cccnc1Cl)[C@@H](CO)Cc1ccccc1	ZINC000853811776	DF	On-Demand	Anodyne	G2YM83_BOTF4	65	33
CN(C(=O)Nc1cccnc1Cl)[C@H](CO)Cc1ccccc1	ZINC000853811777	DF	On-Demand	Anodyne	NPY5R	25	45
CN(C(=O)Nc1cccnc1Cl)[C@H](CO)Cc1ccccc1	ZINC000853811777	DF	On-Demand	Anodyne	G2YM83_BOTF4	65	33
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA2	87	57
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA1	83	50
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA7	36	42
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA5B	58	33
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA4	83	55
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA5A	62	33
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA14	30	42
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA12	64	57
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CA9	70	50
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	CYNT	16	47
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	NCE103	25	44
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	MTCA1	46	41
CON(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853811793	DB	On-Demand	Anodyne	P96878_MYCTU	59	41
Cc1nc(NC(=O)N[C@@H]2CCNC2=O)sc1-c1ccccc1	ZINC000853811795	DE	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)N[C@H]2CCNC2=O)sc1-c1ccccc1	ZINC000853811796	DE	On-Demand	Anodyne	PIK3CG	21	43
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	DRD4	43	33
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	HRH2	17	50
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	PDGFRB	15	43
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	NPY1R	21	40
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	CCR3	32	50
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	RAF1	16	50
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	MTNR1A	80	47
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	MTNR1B	72	50
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	ROCK2	36	47
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	EPHX2	20	48
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	TAAR1	36	45
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	KCNK3	52	45
COc1cccc(NC(=O)NCCN(C)OC)c1	ZINC000853811797	CD	On-Demand	Anodyne	KCNK9	51	39
CON(C)CCNC(=O)Nc1cccnc1Cl	ZINC000853811803	CD	On-Demand	Anodyne	G2YM83_BOTF4	69	35
CON(C)CCNC(=O)Nc1ccc2c(c1)OCCO2	ZINC000853811806	CD	On-Demand	Anodyne	QPCT	18	41
CON(C)CCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853811807	CC	On-Demand	Anodyne	CASP3	15	48
CON(C)CCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853811807	CC	On-Demand	Anodyne	CASP2	19	43
CON(C)CCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853811807	CC	On-Demand	Anodyne	CASP6	16	43
CON(C)CCNC(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1	ZINC000853811808	GE	On-Demand	Anodyne	ROCK1	21	41
CON(C)CCNC(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1	ZINC000853811808	GE	On-Demand	Anodyne	ROCK2	15	41
CC[C@H](C)N(CC)C(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853811819	CG	On-Demand	Anodyne	KCNK3	91	39
CC[C@H](C)N(CC)C(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853811819	CG	On-Demand	Anodyne	KCNK9	54	38
CC[C@H](C)N(CC)C(=O)Nc1cccc(Cl)c1Cl	ZINC000853811832	CJ	On-Demand	Anodyne	CXCL8	45	36
CC[C@H](C)N(CC)C(=O)Nc1cccc(Cl)c1Cl	ZINC000853811832	CJ	On-Demand	Anodyne	KCNQ2	42	34
CON(C)CCNC(=O)Nc1ccc(C)c(Cl)c1	ZINC000853811837	CE	On-Demand	Anodyne	RAF1	22	47
CON(C)CCNC(=O)Nc1cccnc1	ZINC000853811838	BC	On-Demand	Anodyne	CHRNA7	18	40
CON(C)CCNC(=O)Nc1cccnc1	ZINC000853811838	BC	On-Demand	Anodyne	NAMPT	50	43
CC[C@H](C)N(CC)C(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853811847	DF	On-Demand	Anodyne	STAT6	55	34
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCNC2=O)CC1	ZINC000853811849	DC	On-Demand	Anodyne	KCNQ2	74	40
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCNC2=O)CC1	ZINC000853811850	DC	On-Demand	Anodyne	KCNQ2	74	40
CC[C@H](C)N(CC)C(=O)Nc1ccc(Cl)cn1	ZINC000853811854	CG	On-Demand	Anodyne	KLKB1	19	40
CC[C@H](C)N(CC)C(=O)Nc1ccc(Cl)cn1	ZINC000853811854	CG	On-Demand	Anodyne	F10	48	32
CON(C)CCNC(=O)Nc1ccccc1C(F)(F)F	ZINC000853811859	CE	On-Demand	Anodyne	TRPV1	15	45
CON(C)CCNC(=O)Nc1ccccc1C(F)(F)F	ZINC000853811859	CE	On-Demand	Anodyne	RBP4	32	44
CC[C@H](C)N(CC)C(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853811867	EF	On-Demand	Anodyne	TRHR	42	35
CC[C@H](C)N(CC)C(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853811868	EF	On-Demand	Anodyne	TRHR	42	35
O=C(NNC(=S)Nc1cccc(Cl)c1)[C@@H]1CSCN1C(=O)c1ccccc1	ZINC000853811869	HF	On-Demand	Reactive	CFTR	44	37
O=C(NNC(=S)Nc1cccc(Cl)c1)[C@@H]1CSCN1C(=O)c1ccccc1	ZINC000853811869	HF	On-Demand	Reactive	KCNK3	32	40
O=C(NNC(=S)Nc1cccc(Cl)c1)[C@H]1CSCN1C(=O)c1ccccc1	ZINC000853811870	HF	On-Demand	Reactive	CFTR	44	37
O=C(NNC(=S)Nc1cccc(Cl)c1)[C@H]1CSCN1C(=O)c1ccccc1	ZINC000853811870	HF	On-Demand	Reactive	KCNK3	32	40
CON(C)CCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853811883	CF	On-Demand	Anodyne	RAF1	30	46
CON(C)CCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853811883	CF	On-Demand	Anodyne	PRMT3	43	32
O=C1CCC2=C(CCN(C(=O)Nc3cnc(-c4ccccc4)nc3)C2)N1	ZINC000853811922	EF	On-Demand	Anodyne	NPY5R	15	50
O=C1CCC2=C(CCN(C(=O)Nc3cnc(-c4ccccc4)nc3)C2)N1	ZINC000853811922	EF	On-Demand	Anodyne	P2RY14	42	36
Cc1nc(Nc2ccc3c(c2)[C@@H](O)CCCC3)ccc1C#N	ZINC000853811925	CH	On-Demand	Mild	CSNK2A1	48	37
Cc1nc(Nc2ccc3c(c2)[C@H](O)CCCC3)ccc1C#N	ZINC000853811926	CH	On-Demand	Mild	CSNK2A1	48	37
O=C1CCC2=C(CCN(C(=O)Nc3ccc(F)c(Cl)c3)C2)N1	ZINC000853811949	DF	On-Demand	Anodyne	CACNA1H	51	41
O=C1CCC2=C(CCN(C(=O)Nc3ccc(F)c(Cl)c3)C2)N1	ZINC000853811949	DF	On-Demand	Anodyne	EPHX2	15	42
O=C1CCC2=C(CCN(C(=O)Nc3nccs3)C2)N1	ZINC000853811950	CD	On-Demand	Anodyne	MAP1	59	36
C#CCCN(CCOC)C(=O)N[C@H](CC(C)C)c1ccccc1OC	ZINC000853811953	EG	On-Demand	Mild	ABCC8	20	41
C#CCCN(CCOC)C(=O)N[C@@H](CC(C)C)c1ccccc1OC	ZINC000853811954	EG	On-Demand	Mild	ABCC8	20	41
CCn1cc(NC(=O)NC[C@H]2CCN(C(C)(C)C)C2)ccc1=O	ZINC000853811955	DE	On-Demand	Anodyne	CACNA1I	53	35
O=C1CCC2=C(CCN(C(=O)Nc3cc(F)cc(F)c3)C2)N1	ZINC000853811956	DE	On-Demand	Anodyne	CACNA1H	33	44
CCn1cc(NC(=O)NC[C@@H]2CCN(C(C)(C)C)C2)ccc1=O	ZINC000853811959	DE	On-Demand	Anodyne	CACNA1I	53	35
CN1CCN(c2ccccc2NC(=O)N2CCC3=C(CCC(=O)N3)C2)CC1	ZINC000853811960	FD	On-Demand	Anodyne	KCNQ2	70	37
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(N3CCOCC3)cn2)C1	ZINC000853811964	FE	On-Demand	Anodyne	STAT6	54	33
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(N3CCOCC3)cn2)C1	ZINC000853811965	FE	On-Demand	Anodyne	STAT6	54	33
CC(C)(C)N1CC[C@H](CNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)C1	ZINC000853811966	FD	On-Demand	Anodyne	CCR3	53	37
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2cccc(N3C(=O)CNC3=O)c2)C1	ZINC000853811967	FD	On-Demand	Anodyne	CCR3	53	37
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000853811969	GD	On-Demand	Anodyne	NPY1R	30	43
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000853811969	GD	On-Demand	Anodyne	CCR3	73	41
Cc1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853811971	CE	On-Demand	Anodyne	P2RY14	51	37
Cc1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853811971	CE	On-Demand	Anodyne	KCNK3	43	36
CC(C)(C)N1CC[C@H](CNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000853811972	GD	On-Demand	Anodyne	NPY1R	30	43
CC(C)(C)N1CC[C@H](CNC(=O)Nc2cccc(CN3C(=O)CNC3=O)c2)C1	ZINC000853811972	GD	On-Demand	Anodyne	CCR3	73	41
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)Nc3cccnc3)C2)CC1	ZINC000853811985	GH	On-Demand	Anodyne	GPR119	48	52
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)Nc3cccnc3)C2)CC1	ZINC000853811985	GH	On-Demand	Anodyne	NAMPT	22	44
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)Nc3cccnc3)C2)CC1	ZINC000853811987	GH	On-Demand	Anodyne	GPR119	48	52
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)Nc3cccnc3)C2)CC1	ZINC000853811987	GH	On-Demand	Anodyne	NAMPT	22	44
CC(C)(C)N1CC[C@H](CNC(=O)c2nc(Br)cs2)C1	ZINC000853811993	EF	On-Demand	Anodyne	CACNA1I	69	38
CC(C)(C)N1CC[C@@H](CNC(=O)c2nc(Br)cs2)C1	ZINC000853811995	EF	On-Demand	Anodyne	CACNA1I	69	38
Cn1ccnc1C(=O)NC[C@H]1CCN(C(C)(C)C)C1	ZINC000853812001	CD	On-Demand	Anodyne	CACNA1I	70	38
Cn1ccnc1C(=O)NC[C@@H]1CCN(C(C)(C)C)C1	ZINC000853812003	CD	On-Demand	Anodyne	CACNA1I	70	38
CC(C)(C)N1CC[C@H](CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853812005	FF	On-Demand	Bother	CACNA1I	46	32
CC(C)(C)N1CC[C@@H](CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853812007	FF	On-Demand	Bother	CACNA1I	46	32
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCN2C(C)(C)C)CC1	ZINC000853812016	FE	On-Demand	Anodyne	KCNQ2	76	39
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCN2C(C)(C)C)CC1	ZINC000853812019	FE	On-Demand	Anodyne	KCNQ2	76	39
Cc1nc(NC(=O)NC[C@@H]2CCN(C(C)(C)C)C2)sc1-c1ccccc1	ZINC000853812020	FI	On-Demand	Anodyne	CCR3	43	36
Cc1nc(NC(=O)NC[C@@H]2CCN(C(C)(C)C)C2)sc1-c1ccccc1	ZINC000853812020	FI	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)NC[C@H]2CCN(C(C)(C)C)C2)sc1-c1ccccc1	ZINC000853812022	FI	On-Demand	Anodyne	CCR3	43	36
Cc1nc(NC(=O)NC[C@H]2CCN(C(C)(C)C)C2)sc1-c1ccccc1	ZINC000853812022	FI	On-Demand	Anodyne	PIK3CG	21	43
CC(C)n1nccc1NC(=O)NC[C@H]1CCN(C(C)(C)C)C1	ZINC000853812025	DF	On-Demand	Anodyne	CACNA1I	46	33
CC(C)n1nccc1NC(=O)NC[C@@H]1CCN(C(C)(C)C)C1	ZINC000853812027	DF	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)N1CC[C@H]1CNC(=O)Nc1cccnc1Cl	ZINC000853812030	CF	On-Demand	Anodyne	G2YM83_BOTF4	70	36
CC(C)(C)N1CC[C@@H]1CNC(=O)Nc1cccnc1Cl	ZINC000853812031	CF	On-Demand	Anodyne	G2YM83_BOTF4	70	36
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)Nc3nccs3)C2)CC1	ZINC000853812032	GI	On-Demand	Anodyne	MAP1	70	37
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)Nc3nccs3)C2)CC1	ZINC000853812032	GI	On-Demand	Anodyne	GPR119	41	50
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)Nc3nccs3)C2)CC1	ZINC000853812033	GI	On-Demand	Anodyne	MAP1	70	37
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)Nc3nccs3)C2)CC1	ZINC000853812033	GI	On-Demand	Anodyne	GPR119	41	50
C[C@H]1CN(c2ccc(NC(=O)NC[C@H]3CCN3C(C)(C)C)cc2F)C[C@@H](C)O1	ZINC000853812047	GG	On-Demand	Anodyne	NPY2R	73	38
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H]3CCN3C(C)(C)C)cc2F)C[C@@H](C)O1	ZINC000853812051	GG	On-Demand	Anodyne	NPY2R	73	38
Cc1nc(C(=O)NC[C@@H]2CCN(C(C)(C)C)C2)no1	ZINC000853812057	CD	On-Demand	Anodyne	CACNA1I	61	37
Cc1nc(C(=O)NC[C@H]2CCN(C(C)(C)C)C2)no1	ZINC000853812059	CD	On-Demand	Anodyne	CACNA1I	61	37
Cc1nsc(C(=O)NC[C@@H]2CCN(C(C)(C)C)C2)n1	ZINC000853812065	CD	On-Demand	Anodyne	CACNA1I	51	33
Cc1nsc(C(=O)NC[C@H]2CCN(C(C)(C)C)C2)n1	ZINC000853812066	CD	On-Demand	Anodyne	CACNA1I	51	33
CC(C)(C)N1CC[C@H](CNC(=O)C(F)(F)c2ccccc2F)C1	ZINC000853812069	EG	On-Demand	Anodyne	CACNA1I	47	33
CC(C)(C)N1CC[C@@H](CNC(=O)C(F)(F)c2ccccc2F)C1	ZINC000853812074	EG	On-Demand	Anodyne	CACNA1I	47	33
Cn1ccnc1C(=O)NC[C@@H]1CCN1C(C)(C)C	ZINC000853812089	CD	On-Demand	Anodyne	CACNA1I	49	33
Cn1ccnc1C(=O)NC[C@H]1CCN1C(C)(C)C	ZINC000853812102	CD	On-Demand	Anodyne	CACNA1I	49	33
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)N=c3cc[nH]cc3)C2)CC1	ZINC000853812104	GG	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)N=c3cc[nH]cc3)C2)CC1	ZINC000853812107	GG	On-Demand	Anodyne	GPR119	45	47
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000853812112	EF	On-Demand	Anodyne	DGAT1	43	45
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000853812114	EF	On-Demand	Anodyne	DGAT1	43	45
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)Nc3nncs3)C2)CC1	ZINC000853812124	GG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)Nc3nncs3)C2)CC1	ZINC000853812126	GG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN(C(C)(C)C)C1	ZINC000853812128	CD	On-Demand	Anodyne	CACNA1I	47	34
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812129	FG	On-Demand	Mild	ACACA	24	44
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812129	FG	On-Demand	Mild	ACACB	24	41
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN(C(C)(C)C)C1	ZINC000853812130	CD	On-Demand	Anodyne	CACNA1I	47	34
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812131	FG	On-Demand	Mild	ACACA	24	44
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812131	FG	On-Demand	Mild	ACACB	24	41
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc3oc(=O)ccc3c2)C1	ZINC000853812136	EG	On-Demand	Anodyne	CACNA1I	48	32
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc3oc(=O)ccc3c2)C1	ZINC000853812138	EG	On-Demand	Anodyne	CACNA1I	48	32
Cc1cc(NC(=O)NC[C@@H]2CCN(C(C)(C)C)C2)n(C(C)(C)C)n1	ZINC000853812140	EG	On-Demand	Anodyne	CACNA1I	58	36
Cc1cc(NC(=O)NC[C@H]2CCN(C(C)(C)C)C2)n(C(C)(C)C)n1	ZINC000853812143	EG	On-Demand	Anodyne	CACNA1I	58	36
CN(C(=O)Nc1ccc(Cl)nc1)[C@H](CO)Cc1ccccc1	ZINC000853812151	DF	On-Demand	Anodyne	NPY5R	38	53
CN(C(=O)Nc1ccc(Cl)nc1)[C@@H](CO)Cc1ccccc1	ZINC000853812152	DF	On-Demand	Anodyne	NPY5R	38	53
CON(C)CCNC(=O)Nc1ccc(C#N)cc1	ZINC000853812198	BD	On-Demand	Mild	ADRB1	44	36
CON(C)CCNC(=O)Nc1nccs1	ZINC000853812202	BC	On-Demand	Anodyne	MAP1	130	41
CC[C@H](C)N(CC)C(=O)Nc1nc2c(s1)CCC2	ZINC000853812217	CG	On-Demand	Anodyne	SLC27A1	34	40
CC[C@H](C)N(CC)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000853812219	CG	On-Demand	Anodyne	KCNK3	107	38
CC[C@H](C)N(CC)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000853812219	CG	On-Demand	Anodyne	KCNK9	79	38
CON(C)CCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853812235	EC	On-Demand	Anodyne	HRH2	33	43
CON(C)CCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853812235	EC	On-Demand	Anodyne	NPY1R	47	38
CON(C)CCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853812235	EC	On-Demand	Anodyne	CCR3	57	42
CON(C)CCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853812236	EC	On-Demand	Anodyne	HRH2	33	43
CON(C)CCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853812236	EC	On-Demand	Anodyne	NPY1R	47	38
CON(C)CCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853812236	EC	On-Demand	Anodyne	CCR3	57	42
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000853812250	FF	On-Demand	Anodyne	EPHX2	25	41
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000853812250	FF	On-Demand	Anodyne	CACNA1I	71	40
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000853812250	FF	On-Demand	Anodyne	IMDH_CRYPV	27	42
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000853812252	FF	On-Demand	Anodyne	EPHX2	25	41
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000853812252	FF	On-Demand	Anodyne	CACNA1I	71	40
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(Cl)c(C(N)=O)c2)C1	ZINC000853812252	FF	On-Demand	Anodyne	IMDH_CRYPV	27	42
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ncn(C3CCCCC3)n2)C1	ZINC000853812255	EG	On-Demand	Anodyne	CACNA1I	41	33
CON(C)CCNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853812256	DF	On-Demand	Anodyne	PIK3CG	25	49
CON(C)CCNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853812256	DF	On-Demand	Anodyne	PI4KB	41	46
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ncn(C3CCCCC3)n2)C1	ZINC000853812257	EG	On-Demand	Anodyne	CACNA1I	41	33
CON(C)CCNC(=O)C(=O)c1ccc(Cl)cc1	ZINC000853812270	CD	On-Demand	Anodyne	UTS2	45	36
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853812271	DF	On-Demand	Anodyne	EPHX2	25	41
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853812271	DF	On-Demand	Anodyne	CACNA1I	70	37
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853812273	DF	On-Demand	Anodyne	EPHX2	25	41
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853812273	DF	On-Demand	Anodyne	CACNA1I	70	37
CC(C)(C)N1CC[C@H](CNC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000853812275	FF	On-Demand	Bother	CACNA1I	41	32
CC(C)(C)N1CC[C@@H](CNC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000853812277	FF	On-Demand	Bother	CACNA1I	41	32
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)c3nccs3)CC2)C1	ZINC000853812286	GH	On-Demand	Anodyne	GPR119	33	49
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)c3nccs3)CC2)C1	ZINC000853812288	GH	On-Demand	Anodyne	GPR119	33	49
CON(C)CCNC(=O)NCC[C@H](C)N(C)Cc1ccccc1	ZINC000853812292	DD	On-Demand	Anodyne	NPR	42	35
CON(C)CCNC(=O)NCC[C@@H](C)N(C)Cc1ccccc1	ZINC000853812294	DD	On-Demand	Anodyne	NPR	42	35
CON(C)CCNC(=O)Nc1cccc(C#N)c1	ZINC000853812295	BD	On-Demand	Mild	ADRB1	42	36
CON(C)CCNC(=O)Nc1cccc(C#N)c1	ZINC000853812295	BD	On-Demand	Mild	CCR3	28	49
CON(C)CCNC(=O)Nc1cccc(C#N)c1	ZINC000853812295	BD	On-Demand	Mild	MCHR1	32	49
CON(C)CCNC(=O)Nc1ccc2c(c1)OCO2	ZINC000853812319	CD	On-Demand	Anodyne	DYRK2	57	35
O=C1CCC2=C(CCN(C(=O)Nc3cccc(-c4nnc5n4CCC5)c3)C2)N1	ZINC000853812326	GE	On-Demand	Anodyne	P2RY14	48	34
CCOc1ccccc1[C@H](CC(C)C)NC(=O)NCCN(C)OC	ZINC000853812344	EF	On-Demand	Anodyne	ANPEP	23	40
CCOc1ccccc1[C@H](CC(C)C)NC(=O)NCCN(C)OC	ZINC000853812344	EF	On-Demand	Anodyne	CAPN2	59	36
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)NCCN(C)OC	ZINC000853812345	EF	On-Demand	Anodyne	ANPEP	23	40
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)NCCN(C)OC	ZINC000853812345	EF	On-Demand	Anodyne	CAPN2	59	36
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853812348	GD	On-Demand	Anodyne	P2RY14	45	34
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853812349	GD	On-Demand	Anodyne	P2RY14	45	34
COCCN(CCF)C(=O)N[C@@H](CC(C)C)c1ccccc1OC	ZINC000853812362	EG	On-Demand	Anodyne	ABCC8	20	41
Cc1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1C	ZINC000853812386	CF	On-Demand	Anodyne	P2RY14	46	33
N#Cc1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853812394	CD	On-Demand	Mild	CCR3	16	40
N#Cc1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853812394	CD	On-Demand	Mild	P2RY14	44	38
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@@H](O)CCCC4)c2c1	ZINC000853812400	GH	On-Demand	Anodyne	EGFR	74	38
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@@H](O)CCCC4)c2c1	ZINC000853812400	GH	On-Demand	Anodyne	ERBB2	52	38
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@@H](O)CCCC4)c2c1	ZINC000853812400	GH	On-Demand	Anodyne	ERBB4	45	35
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@@H](O)CCCC4)c2c1	ZINC000853812400	GH	On-Demand	Anodyne	CD38	61	45
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@H](O)CCCC4)c2c1	ZINC000853812401	GH	On-Demand	Anodyne	EGFR	74	38
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@H](O)CCCC4)c2c1	ZINC000853812401	GH	On-Demand	Anodyne	ERBB2	52	38
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@H](O)CCCC4)c2c1	ZINC000853812401	GH	On-Demand	Anodyne	ERBB4	45	35
CS(=O)(=O)c1ccc2ncnc(Nc3ccc4c(c3)[C@H](O)CCCC4)c2c1	ZINC000853812401	GH	On-Demand	Anodyne	CD38	61	45
Cc1cccc(NC(=O)Nc2nn(C)c(C)c2CNC(=O)OC(C)(C)C)c1	ZINC000853812434	FH	On-Demand	Anodyne	KIT	18	42
Cc1cccc(NC(=O)Nc2nn(C)c(C)c2CNC(=O)OC(C)(C)C)c1	ZINC000853812434	FH	On-Demand	Anodyne	CCKAR	22	40
Cc1cccc(NC(=O)Nc2nn(C)c(C)c2CNC(=O)OC(C)(C)C)c1	ZINC000853812434	FH	On-Demand	Anodyne	KDR	20	42
Cc1cccc(NC(=O)Nc2nn(C)c(C)c2CNC(=O)OC(C)(C)C)c1	ZINC000853812434	FH	On-Demand	Anodyne	CCKBR	32	40
CN1CCN(c2ccccc2NC(=O)N(C)[C@H](CO)Cc2ccccc2)CC1	ZINC000853812456	GF	On-Demand	Anodyne	KCNQ2	78	45
CN1CCN(c2ccccc2NC(=O)N(C)[C@H](CO)Cc2ccccc2)CC1	ZINC000853812456	GF	On-Demand	Anodyne	NPY5R	23	43
CN1CCN(c2ccccc2NC(=O)N(C)[C@@H](CO)Cc2ccccc2)CC1	ZINC000853812457	GF	On-Demand	Anodyne	KCNQ2	78	45
CN1CCN(c2ccccc2NC(=O)N(C)[C@@H](CO)Cc2ccccc2)CC1	ZINC000853812457	GF	On-Demand	Anodyne	NPY5R	23	43
CN(C(=O)Nc1cccc(N2CCOC2=O)c1)[C@@H](CO)Cc1ccccc1	ZINC000853812474	FF	On-Demand	Anodyne	NPY5R	27	42
CN(C(=O)Nc1cccc(N2CCOC2=O)c1)[C@H](CO)Cc1ccccc1	ZINC000853812475	FF	On-Demand	Anodyne	NPY5R	27	42
CON(C)CCNC(=O)Nc1cccc(OCC(C)C)c1	ZINC000853812511	CE	On-Demand	Anodyne	ADRB1	38	40
CON(C)CCNC(=O)Nc1cccc(OCC(C)C)c1	ZINC000853812511	CE	On-Demand	Anodyne	HRH2	21	43
CON(C)CCNC(=O)Nc1cccc(OCC(C)C)c1	ZINC000853812511	CE	On-Demand	Anodyne	KCNK3	41	35
CON(C)CCNC(=O)Nc1cccc(OCC(C)C)c1	ZINC000853812511	CE	On-Demand	Anodyne	PDS	67	34
CC[C@H](C)N(CC)C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853812529	DG	On-Demand	Anodyne	KCNQ2	93	50
CC[C@H](C)N(CC)C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853812529	DG	On-Demand	Anodyne	NPY2R	50	37
CON(C)CCNC(=O)Nc1ccc(F)cc1F	ZINC000853812547	CD	On-Demand	Anodyne	SOAT1	36	40
CON(C)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000853812554	FG	On-Demand	Anodyne	MPL	41	47
CON(C)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000853812554	FG	On-Demand	Anodyne	ROCK1	24	46
CON(C)CCNC(=O)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000853812554	FG	On-Demand	Anodyne	ROCK2	16	46
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)n3ccnc3)CC2)C1	ZINC000853812558	FG	On-Demand	Anodyne	GPR119	35	51
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)n3ccnc3)CC2)C1	ZINC000853812559	FG	On-Demand	Anodyne	GPR119	35	51
CC[C@H](C)N(CC)C(=O)Nc1cc(Cl)ccc1OC	ZINC000853812560	CI	On-Demand	Anodyne	RBP4	18	42
O=C1NCC[C@H]1NC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853812566	DC	On-Demand	Bother	CACNA1D	48	34
O=C1NCC[C@@H]1NC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853812567	DC	On-Demand	Bother	CACNA1D	48	34
CON(C)CCNC(=O)Nc1cccc2ccccc12	ZINC000853812568	CE	On-Demand	Anodyne	TRPV1	30	46
CON(C)CCNC(=O)Nc1cccc2ccccc12	ZINC000853812568	CE	On-Demand	Anodyne	MTNR1A	46	51
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)C(=O)c3ccc[nH]3)CC2)C1	ZINC000853812569	GG	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)C(=O)c3ccc[nH]3)CC2)C1	ZINC000853812570	GG	On-Demand	Anodyne	GPR119	28	43
CON(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853812572	CD	On-Demand	Anodyne	CCR3	32	45
CON(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853812572	CD	On-Demand	Anodyne	AKR1C3	19	44
CON(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853812572	CD	On-Demand	Anodyne	IMDH_CRYPV	42	34
CON(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853812572	CD	On-Demand	Anodyne	KCNK3	102	37
CON(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853812572	CD	On-Demand	Anodyne	KCNK9	68	35
O=C(NNC(=S)Nc1cccc(Cl)c1)c1occc1-c1ccccc1	ZINC000853812581	FI	On-Demand	Reactive	PPIA	15	40
O=C(NNC(=S)Nc1cccc(Cl)c1)c1occc1-c1ccccc1	ZINC000853812581	FI	On-Demand	Reactive	KCNK3	42	42
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA2	168	61
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA1	158	61
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA7	73	47
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA13	24	40
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA5B	53	44
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA4	123	54
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA5A	56	44
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA14	64	50
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA12	122	51
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CA9	135	51
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	UREA_CANEN	28	40
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	CYNT	50	43
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	NCE103	52	57
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	MTCA1	67	53
CON(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853812583	DB	On-Demand	Anodyne	P96878_MYCTU	83	53
CON(C)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000853812588	DD	On-Demand	Bother	KCNMA1	19	40
CON(C)CCNC(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853812589	EE	On-Demand	Anodyne	SCD1	39	43
CON(C)CCNC(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853812589	EE	On-Demand	Anodyne	SCD	33	43
CON(C)CCNC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853812602	CD	On-Demand	Anodyne	CCR3	21	40
CON(C)CCNC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853812602	CD	On-Demand	Anodyne	KCNK3	97	39
CON(C)CCNC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853812602	CD	On-Demand	Anodyne	KCNK9	67	35
CON(C)CCNC(=O)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000853812608	EE	On-Demand	Anodyne	DDR2	20	40
O=C1CCC2=C(CCN(C(=O)Nc3cccnc3Cl)C2)N1	ZINC000853812636	DE	On-Demand	Anodyne	G2YM83_BOTF4	53	34
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCN(C(C)(C)C)C2)CC1	ZINC000853812660	FF	On-Demand	Anodyne	KCNQ2	74	41
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCN(C(C)(C)C)C2)CC1	ZINC000853812661	FF	On-Demand	Anodyne	KCNQ2	74	41
O[C@H]1CCCCc2ccc(Nc3ncnc4c3ncn4C3CC3)cc21	ZINC000853812670	EH	On-Demand	Anodyne	ADORA1	60	45
O[C@H]1CCCCc2ccc(Nc3ncnc4c3ncn4C3CC3)cc21	ZINC000853812670	EH	On-Demand	Anodyne	ADORA3	58	39
O[C@H]1CCCCc2ccc(Nc3ncnc4c3ncn4C3CC3)cc21	ZINC000853812670	EH	On-Demand	Anodyne	Q4VQ11_PIG	40	39
O[C@@H]1CCCCc2ccc(Nc3ncnc4c3ncn4C3CC3)cc21	ZINC000853812671	EH	On-Demand	Anodyne	ADORA1	60	45
O[C@@H]1CCCCc2ccc(Nc3ncnc4c3ncn4C3CC3)cc21	ZINC000853812671	EH	On-Demand	Anodyne	ADORA3	58	39
O[C@@H]1CCCCc2ccc(Nc3ncnc4c3ncn4C3CC3)cc21	ZINC000853812671	EH	On-Demand	Anodyne	Q4VQ11_PIG	40	39
O=C1CCC2=C(CCN(C(=O)Nc3ccccc3C(F)(F)F)C2)N1	ZINC000853812691	EG	On-Demand	Anodyne	RBP4	91	43
O=C1CCC2=C(CCN(C(=O)Nc3cccnc3)C2)N1	ZINC000853812706	CD	On-Demand	Anodyne	P2RY14	36	40
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)N=c3cc[nH]cc3)CC2)C1	ZINC000853812707	GG	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)N=c3cc[nH]cc3)CC2)C1	ZINC000853812708	GG	On-Demand	Anodyne	GPR119	38	45
CON(C)CCNC(=O)Nc1cccc(NC(C)=O)c1	ZINC000853812736	CD	On-Demand	Anodyne	NQO2	22	41
CON(C)CCNC(=O)Nc1cccc(NC(C)=O)c1	ZINC000853812736	CD	On-Demand	Anodyne	MTNR1A	41	41
CON(C)CCNC(=O)Nc1cccc(NC(C)=O)c1	ZINC000853812736	CD	On-Demand	Anodyne	MTNR1B	35	41
CON(C)CCNC(=O)Nc1cccc(NC(C)=O)c1	ZINC000853812736	CD	On-Demand	Anodyne	KCNK3	92	38
CON(C)CCNC(=O)Nc1cccc(NC(C)=O)c1	ZINC000853812736	CD	On-Demand	Anodyne	KCNK9	69	38
CON(C)CCNC(=O)Nc1ccc(-c2ncon2)cc1	ZINC000853812737	CD	On-Demand	Anodyne	MTOR	54	39
CON(C)CCNC(=O)Nc1nc2c(s1)CCCCC2	ZINC000853812761	CE	On-Demand	Anodyne	SLC27A1	38	42
CON(C)CCNC(=O)Nc1cccc(Br)c1	ZINC000853812786	DE	On-Demand	Anodyne	EGFR	45	39
CON(C)CCNC(=O)Nc1cccc(Br)c1	ZINC000853812786	DE	On-Demand	Anodyne	KCNK3	40	34
CON(C)CCNC(=O)Nc1cccc(Br)c1	ZINC000853812786	DE	On-Demand	Anodyne	KCNK9	43	34
CON(C)CCNC(=O)Nc1ccccc1OC(F)(F)F	ZINC000853812787	DE	On-Demand	Anodyne	P2RY1	55	38
COCCN(CCF)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812789	EG	On-Demand	Anodyne	ACACA	24	44
COCCN(CCF)C(=O)N[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812789	EG	On-Demand	Anodyne	ACACB	23	43
COCCN(CCF)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812790	EG	On-Demand	Anodyne	ACACA	24	44
COCCN(CCF)C(=O)N[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000853812790	EG	On-Demand	Anodyne	ACACB	23	43
CON(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853812791	DC	On-Demand	Anodyne	CA1	41	38
CON(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853812791	DC	On-Demand	Anodyne	CA4	16	40
CON(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853812791	DC	On-Demand	Anodyne	NCE103	18	43
CON(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853812791	DC	On-Demand	Anodyne	MTCA1	44	39
CON(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853812791	DC	On-Demand	Anodyne	P96878_MYCTU	56	39
CN1CCN(c2ccccc2NC(=O)N(CCOCCO)C2CCC2)CC1	ZINC000853812793	GD	On-Demand	Anodyne	KCNQ2	74	38
CON(C)CCNC(=O)Nc1ccc(Cl)cc1	ZINC000853812796	CD	On-Demand	Anodyne	EPHX2	17	43
CON(C)CCNC(=O)Nc1ccc(Cl)cc1	ZINC000853812796	CD	On-Demand	Anodyne	NCE103	16	41
CN(Cc1cnc[nH]1)C(=O)N1CCCC1	ZINC000853812804	BD	On-Demand	Anodyne	TAAR1	25	40
CON(C)CCNC(=O)Nc1ccc(-c2cc(O)nc(C)n2)cc1	ZINC000853812814	ED	On-Demand	Anodyne	SMG1	59	36
CCOC(=O)c1csc(N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)n1	ZINC000853812815	GG	On-Demand	Anodyne	TPP2	53	38
CCOC(=O)c1csc(N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)n1	ZINC000853812816	GG	On-Demand	Anodyne	TPP2	53	38
CC[C@H](C)N(CC)C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853812822	DH	On-Demand	Anodyne	NPY2R	75	40
COc1ncccc1NC(=O)Nc1nn(C)c(C)c1CNC(=O)OC(C)(C)C	ZINC000853812831	GF	On-Demand	Anodyne	P2RY1	43	37
CC(=O)c1ccc(N2C[C@@]3(C)COC[C@@]3(C)C2)c([N+](=O)[O-])c1	ZINC000853812834	DF	On-Demand	Bother	TAAR1	19	43
CON(C)CCNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	ZINC000853812843	FF	On-Demand	Anodyne	TNF	46	42
CON(C)CCNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	ZINC000853812843	FF	On-Demand	Anodyne	MAPK14	33	52
CON(C)CCNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	ZINC000853812843	FF	On-Demand	Anodyne	PTK2B	39	47
CON(C)CCNC(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	ZINC000853812843	FF	On-Demand	Anodyne	DDR2	39	48
CON(C)CCNC(=O)Nc1ccccc1Cl	ZINC000853812859	CD	On-Demand	Anodyne	CXCL8	51	40
CON(C)CCNC(=O)Nc1ccccc1Cl	ZINC000853812859	CD	On-Demand	Anodyne	EPHB3	53	37
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3CCNC3=O)cc2F)C[C@@H](C)O1	ZINC000853812867	FD	On-Demand	Anodyne	NPY2R	51	35
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3CCNC3=O)cc2F)C[C@@H](C)O1	ZINC000853812868	FD	On-Demand	Anodyne	NPY2R	51	35
CC[C@H](C)N(CC)C(=O)Nc1cccc(C)n1	ZINC000853812872	BG	On-Demand	Anodyne	GRM5	23	49
CC[C@H](C)N(CC)C(=O)Nc1cccc(C)n1	ZINC000853812872	BG	On-Demand	Anodyne	SORT1	17	41
CON(C)CCNC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000853812905	CD	On-Demand	Anodyne	DGAT1	42	41
O=C1CCC2=C(CCN(C(=O)Nc3ccccc3Cl)C2)N1	ZINC000853812912	DF	On-Demand	Anodyne	EPHB3	49	31
O=C1CCC2=C(CCN(C(=O)Nc3nc4c(s3)CCCC4)C2)N1	ZINC000853812920	EE	On-Demand	Anodyne	SLC27A1	31	40
Cn1ccnc1C(=O)N1CCC([C@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853812926	GF	On-Demand	Anodyne	GPR119	35	49
Cn1ccnc1C(=O)N1CCC([C@@H]2CCCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853812928	GF	On-Demand	Anodyne	GPR119	35	49
CON(C)CCNC(=O)Nc1ccc(Cl)cn1	ZINC000853812939	CD	On-Demand	Anodyne	KLKB1	20	42
CON(C)CCNC(=O)Nc1ccc(Cl)cn1	ZINC000853812939	CD	On-Demand	Anodyne	F10	59	41
CON(C)CCNC(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000853812942	DD	On-Demand	Anodyne	ADRB1	43	34
COc1ncccc1NC(=O)NCCN(C)OC	ZINC000853812943	CC	On-Demand	Anodyne	P2RY1	45	39
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)c3cc(C#N)c[nH]3)CC2)C1	ZINC000853812944	GG	On-Demand	Mild	GPR119	25	46
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)c3cc(C#N)c[nH]3)CC2)C1	ZINC000853812946	GG	On-Demand	Mild	GPR119	25	46
Cn1cnc2c(Nc3ccc4c(c3)[C@@H](O)CCCC4)ncnc21	ZINC000853812948	DF	On-Demand	Anodyne	ADORA1	28	51
Cn1cnc2c(Nc3ccc4c(c3)[C@H](O)CCCC4)ncnc21	ZINC000853812950	DF	On-Demand	Anodyne	ADORA1	28	51
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2cccc3cccnc23)C1	ZINC000853812973	EG	On-Demand	Anodyne	TRPV1	16	42
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2cccc3cccnc23)C1	ZINC000853812973	EG	On-Demand	Anodyne	WNT3	18	41
CC(C)(C)N1CC[C@H](CNC(=O)Nc2cccc3cccnc23)C1	ZINC000853812974	EG	On-Demand	Anodyne	TRPV1	16	42
CC(C)(C)N1CC[C@H](CNC(=O)Nc2cccc3cccnc23)C1	ZINC000853812974	EG	On-Demand	Anodyne	WNT3	18	41
O=C1CCC2=C(CCN(C(=O)Nc3nc4c(s3)CCCCC4)C2)N1	ZINC000853812997	EF	On-Demand	Anodyne	SLC27A1	31	41
O=C1CCC2=C(CCN(C(=O)Nc3ccc(C(F)(F)F)cc3)C2)N1	ZINC000853813006	EG	On-Demand	Anodyne	EPHX2	46	45
O=C1CCC2=C(CCN(C(=O)Nc3ccc(C(F)(F)F)cc3)C2)N1	ZINC000853813006	EG	On-Demand	Anodyne	TRPM8	72	48
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)Nc3ccccn3)CC2)C1	ZINC000853813011	GH	On-Demand	Anodyne	GRIN2B	17	40
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)Nc3ccccn3)CC2)C1	ZINC000853813011	GH	On-Demand	Anodyne	GPR119	43	56
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)Nc3ccccn3)CC2)C1	ZINC000853813012	GH	On-Demand	Anodyne	GRIN2B	17	40
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)Nc3ccccn3)CC2)C1	ZINC000853813012	GH	On-Demand	Anodyne	GPR119	43	56
CC(=O)Nc1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853813016	EE	On-Demand	Anodyne	P2RY14	49	35
O=C1CCC2=C(CCN(C(=O)Nc3ccc(Cl)cc3)C2)N1	ZINC000853813017	DF	On-Demand	Anodyne	EPHX2	20	42
CC[C@H](C)N(CC)C(=O)Nc1cccnc1Cl	ZINC000853813043	CG	On-Demand	Anodyne	G2YM83_BOTF4	73	39
CON(C)CCNC(=O)Nc1cccc(Cl)c1Cl	ZINC000853813055	CF	On-Demand	Anodyne	CXCL8	40	39
Cc1nc(C(=O)N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)no1	ZINC000853813073	GF	On-Demand	Anodyne	GPR119	19	44
Cc1nc(C(=O)N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)no1	ZINC000853813075	GF	On-Demand	Anodyne	GPR119	19	44
CC[C@H](C)N(CC)C(=O)Nc1ccccc1OC(F)(F)F	ZINC000853813078	DI	On-Demand	Anodyne	KCNK3	25	40
CC[C@H](C)N(CC)C(=O)Nc1ccccc1OC(F)(F)F	ZINC000853813078	DI	On-Demand	Anodyne	KCNK9	30	41
COCCOc1ccc(NC(=O)NCCN(C)OC)cn1	ZINC000853813085	CC	On-Demand	Anodyne	ADRB1	23	40
CCOC(=O)c1nc(=N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)cc[nH]1	ZINC000853813098	GE	On-Demand	Anodyne	TPP2	48	39
CCOC(=O)c1nc(=N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)cc[nH]1	ZINC000853813099	GE	On-Demand	Anodyne	TPP2	48	39
CON(C)CCNC(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000853813101	FF	On-Demand	Anodyne	SCD1	40	43
CON(C)CCNC(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000853813101	FF	On-Demand	Anodyne	SCD	35	47
CON(C)CCNC(=O)Nc1ccccc1	ZINC000853813112	BD	On-Demand	Anodyne	LPL	40	44
CON(C)CCNC(=O)Nc1ccccc1	ZINC000853813112	BD	On-Demand	Anodyne	CA1	37	42
CON(C)CCNC(=O)Nc1ccccc1	ZINC000853813112	BD	On-Demand	Anodyne	ROCK2	15	40
CON(C)CCNC(=O)Nc1ccccc1	ZINC000853813112	BD	On-Demand	Anodyne	EPHX2	16	48
CON(C)CCNC(=O)Nc1ccccc1	ZINC000853813112	BD	On-Demand	Anodyne	CA9	15	42
CC[C@H](C)N(CC)C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000853813120	DH	On-Demand	Anodyne	MME	18	46
CC[C@H](C)N(CC)C(=O)Nc1nnc(-c2ccccc2)s1	ZINC000853813120	DH	On-Demand	Anodyne	GPR142	20	42
COc1cccc(NC(=O)Nc2nn(C)c(C)c2CNC(=O)OC(C)(C)C)c1	ZINC000853813165	GG	On-Demand	Anodyne	DRD4	41	32
O=C1CCC2=C(CCN(C(=O)Nc3cccc(Br)c3)C2)N1	ZINC000853813167	FF	On-Demand	Anodyne	P2RY14	46	33
Cc1nc(NC(=O)N(C)[C@H](CO)Cc2ccccc2)sc1C	ZINC000853813175	DF	On-Demand	Anodyne	NPY5R	28	45
Cc1nc(NC(=O)N(C)[C@@H](CO)Cc2ccccc2)sc1C	ZINC000853813180	DF	On-Demand	Anodyne	NPY5R	28	45
NS(=O)(=O)c1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853813187	FC	On-Demand	Anodyne	CA4	16	43
CON(C)CCNC(=O)Nc1cccc(C)n1	ZINC000853813188	BD	On-Demand	Anodyne	GRM5	21	47
CON(C)CCNC(=O)Nc1cccc(C)n1	ZINC000853813188	BD	On-Demand	Anodyne	SORT1	16	40
CON(C)CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853813198	FE	On-Demand	Anodyne	NPY2R	69	36
CON(C)CCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853813202	FE	On-Demand	Anodyne	NPY2R	69	36
CON(C)CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853813205	FE	On-Demand	Anodyne	NPY2R	69	36
CON(C)CCNC(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853813208	DD	On-Demand	Anodyne	NPY2R	57	33
COC(=O)c1sccc1NC(=O)N1CCC2=C(CCC(=O)N2)C1	ZINC000853813230	ED	On-Demand	Anodyne	FAS	27	40
CON(C)CCNC(=O)Nc1ccccc1F	ZINC000853813240	BD	On-Demand	Anodyne	CXCL8	17	40
Cc1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1Cl	ZINC000853813243	DG	On-Demand	Anodyne	PKM	23	41
Cc1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1Cl	ZINC000853813243	DG	On-Demand	Anodyne	P2RY14	46	35
Cc1nnc(C(=O)N2CCC([C@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)s1	ZINC000853813266	GG	On-Demand	Anodyne	GPR119	19	42
Cc1nnc(C(=O)N2CCC([C@@H]3CCCN(C(=O)OC(C)(C)C)C3)CC2)s1	ZINC000853813269	GG	On-Demand	Anodyne	GPR119	19	42
O=C1CCC2=C(CCN(C(=O)Nc3ccc(F)c(F)c3)C2)N1	ZINC000853813274	DE	On-Demand	Anodyne	CACNA1H	37	42
COC(=O)c1cc(NC(=O)NC[C@H]2CCN(C(C)(C)C)C2)cc(C(=O)OC)c1	ZINC000853813286	GF	On-Demand	Anodyne	EPHX2	15	41
COC(=O)c1cc(NC(=O)NC[C@H]2CCN(C(C)(C)C)C2)cc(C(=O)OC)c1	ZINC000853813286	GF	On-Demand	Anodyne	CACNA1I	70	38
COC(=O)c1cc(NC(=O)NC[C@@H]2CCN(C(C)(C)C)C2)cc(C(=O)OC)c1	ZINC000853813287	GF	On-Demand	Anodyne	EPHX2	15	41
COC(=O)c1cc(NC(=O)NC[C@@H]2CCN(C(C)(C)C)C2)cc(C(=O)OC)c1	ZINC000853813287	GF	On-Demand	Anodyne	CACNA1I	70	38
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CA2	92	49
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CA1	82	49
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CA7	44	46
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CCR3	20	41
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CA4	64	45
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CA14	46	46
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CA12	68	49
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CA9	69	49
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CACNA1I	45	34
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	F13A1	43	38
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	CYNT	38	42
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	NCE103	24	44
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	MTCA1	53	49
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	P96878_MYCTU	67	49
CC(C)(C)N1CC[C@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813298	FD	On-Demand	Anodyne	NAMPT	45	44
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CA2	92	49
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CA1	82	49
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CA7	44	46
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CCR3	20	41
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CA4	64	45
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CA14	46	46
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CA12	68	49
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CA9	69	49
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CACNA1I	45	34
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	F13A1	43	38
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	CYNT	38	42
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	NCE103	24	44
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	MTCA1	53	49
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	P96878_MYCTU	67	49
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853813299	FD	On-Demand	Anodyne	NAMPT	45	44
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)Nc3nncs3)CC2)C1	ZINC000853813315	GG	On-Demand	Anodyne	GPR119	25	43
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)Nc3nncs3)CC2)C1	ZINC000853813316	GG	On-Demand	Anodyne	GPR119	25	43
CN1CCN(c2ccccc2NC(=O)N(C)Cc2cnc[nH]2)CC1	ZINC000853813323	ED	On-Demand	Anodyne	KCNQ2	71	37
CON(C)CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853813336	DD	On-Demand	Bother	CACNA1C	44	42
CON(C)CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853813336	DD	On-Demand	Bother	CACNA1D	68	37
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853813354	GH	On-Demand	Anodyne	ABCC8	20	41
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853813354	GH	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853813354	GH	On-Demand	Anodyne	HCN4	40	31
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853813355	GH	On-Demand	Anodyne	ABCC8	20	41
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853813355	GH	On-Demand	Anodyne	HCN1	47	31
CCOc1ccccc1[C@H](CC(C)C)NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853813355	GH	On-Demand	Anodyne	HCN4	40	31
O=C1CCC2=C(CCN(C(=O)Nc3ccc4c(c3)C(=O)NC4=O)C2)N1	ZINC000853813361	EC	On-Demand	Anodyne	CASP2	16	42
O=C1CCC2=C(CCN(C(=O)Nc3nc4ccccc4s3)C2)N1	ZINC000853813397	EF	On-Demand	Anodyne	CSNK1D	15	42
O=C1CCC2=C(CCN(C(=O)Nc3cccc(Cl)c3)C2)N1	ZINC000853813398	DF	On-Demand	Anodyne	P2RY14	47	35
COC(=O)c1sc(Nc2ccc3c(c2)[C@H](O)CCCC3)nc1Cl	ZINC000853813399	FI	On-Demand	Anodyne	DHODH	17	44
COC(=O)c1sc(Nc2ccc3c(c2)[C@@H](O)CCCC3)nc1Cl	ZINC000853813400	FI	On-Demand	Anodyne	DHODH	17	44
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)Nc3nccs3)CC2)C1	ZINC000853813423	GI	On-Demand	Anodyne	MAP1	67	36
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)Nc3nccs3)CC2)C1	ZINC000853813423	GI	On-Demand	Anodyne	GPR119	29	47
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)Nc3nccs3)CC2)C1	ZINC000853813426	GI	On-Demand	Anodyne	MAP1	67	36
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)Nc3nccs3)CC2)C1	ZINC000853813426	GI	On-Demand	Anodyne	GPR119	29	47
CON(C)CCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853813439	FG	On-Demand	Anodyne	SCD1	43	55
CON(C)CCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853813439	FG	On-Demand	Anodyne	SCD	38	55
CON(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853813448	CE	On-Demand	Anodyne	TRPV1	15	44
CON(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853813448	CE	On-Demand	Anodyne	RAF1	33	46
CON(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853813448	CE	On-Demand	Anodyne	EPHX2	41	55
CON(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853813448	CE	On-Demand	Anodyne	MCHR1	15	57
CON(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853813448	CE	On-Demand	Anodyne	FPR2	18	40
CON(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853813448	CE	On-Demand	Anodyne	DOT1L	40	34
Cc1cc(C(=O)NC[C@@H]2CCN(C(C)(C)C)C2)n2nc(C)cc2n1	ZINC000853813458	EE	On-Demand	Anodyne	CACNA1I	56	35
Cc1cc(C(=O)NC[C@H]2CCN(C(C)(C)C)C2)n2nc(C)cc2n1	ZINC000853813459	EE	On-Demand	Anodyne	CACNA1I	56	35
COc1ccccc1[C@H](CC(C)C)NC(=O)NCCN(C)OC	ZINC000853813463	DF	On-Demand	Anodyne	ANPEP	25	46
CON(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853813477	DE	On-Demand	Anodyne	GCGR	16	40
CON(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853813477	DE	On-Demand	Anodyne	P2RY1	69	42
CON(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853813477	DE	On-Demand	Anodyne	RAF1	31	45
CON(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853813477	DE	On-Demand	Anodyne	EPHX2	62	47
CON(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853813477	DE	On-Demand	Anodyne	GIPR	21	40
CON(C)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853813480	DE	On-Demand	Anodyne	ADRB1	40	31
CON(C)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853813480	DE	On-Demand	Anodyne	PI4KB	20	41
CON(C)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853813480	DE	On-Demand	Anodyne	CDK5	27	41
CON(C)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853813480	DE	On-Demand	Anodyne	LIMK1	24	40
CON(C)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853813480	DE	On-Demand	Anodyne	LIMK2	19	40
CON(C)CCNC(=O)Nc1ccc(C(C)=O)cc1	ZINC000853813516	CD	On-Demand	Anodyne	CA1	18	45
CON(C)CCNC(=O)Nc1ncc(Cc2ccccc2Cl)s1	ZINC000853813524	FG	On-Demand	Anodyne	CDK5	17	40
CC[C@H](C)N(CC)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853813536	FI	On-Demand	Anodyne	NPY2R	86	42
CC[C@H](C)N(CC)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853813537	FI	On-Demand	Anodyne	NPY2R	86	42
CC[C@H](C)N(CC)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853813538	FI	On-Demand	Anodyne	NPY2R	86	42
CON(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853813539	CD	On-Demand	Anodyne	LCK	27	51
CON(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853813539	CD	On-Demand	Anodyne	CSNK1D	45	50
CON(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853813539	CD	On-Demand	Anodyne	PIK3CA	15	48
CON(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853813539	CD	On-Demand	Anodyne	PIK3CG	16	40
CON(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853813539	CD	On-Demand	Anodyne	TMPRSS6	44	32
CC(C)(C)N1CC[C@H](CNC(=O)Nc2cccnc2Cl)C1	ZINC000853813557	DF	On-Demand	Anodyne	CACNA1I	65	37
CC(C)(C)N1CC[C@H](CNC(=O)Nc2cccnc2Cl)C1	ZINC000853813557	DF	On-Demand	Anodyne	G2YM83_BOTF4	67	35
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2cccnc2Cl)C1	ZINC000853813558	DF	On-Demand	Anodyne	CACNA1I	65	37
CC(C)(C)N1CC[C@@H](CNC(=O)Nc2cccnc2Cl)C1	ZINC000853813558	DF	On-Demand	Anodyne	G2YM83_BOTF4	67	35
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)Nc3cccnc3)CC2)C1	ZINC000853813590	GH	On-Demand	Anodyne	GPR119	39	48
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)Nc3cccnc3)CC2)C1	ZINC000853813590	GH	On-Demand	Anodyne	NAMPT	22	43
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)Nc3cccnc3)CC2)C1	ZINC000853813591	GH	On-Demand	Anodyne	GPR119	39	48
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)Nc3cccnc3)CC2)C1	ZINC000853813591	GH	On-Demand	Anodyne	NAMPT	22	43
Nc1nc(Cl)cc(Nc2ccc3c(c2)[C@H](O)CCCC3)n1	ZINC000853813592	DG	On-Demand	Anodyne	AGPAT2	41	35
Nc1nc(Cl)cc(Nc2ccc3c(c2)[C@@H](O)CCCC3)n1	ZINC000853813593	DG	On-Demand	Anodyne	AGPAT2	41	35
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)N3CCCC3)CC2)C1	ZINC000853813610	FH	On-Demand	Anodyne	GPR119	27	47
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)N3CCCC3)CC2)C1	ZINC000853813611	FH	On-Demand	Anodyne	GPR119	27	47
CC(=O)c1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853813624	DE	On-Demand	Anodyne	P2RY14	50	35
COc1ccccc1[C@H](CC(C)C)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853813627	FI	On-Demand	Anodyne	ABCC8	19	41
COc1ccccc1[C@H](CC(C)C)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853813628	FI	On-Demand	Anodyne	ABCC8	19	41
COc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853813629	FI	On-Demand	Anodyne	ABCC8	19	41
COc1ccccc1[C@H](CC(C)C)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853813630	FI	On-Demand	Anodyne	ABCC8	19	41
COC(=O)c1cccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)c1	ZINC000853813631	ED	On-Demand	Anodyne	P2RY14	51	36
O=C1CCC2=C(CCN(C(=O)Nc3ccc(OC(F)(F)F)cc3)C2)N1	ZINC000853813636	FF	On-Demand	Anodyne	P2RY1	61	41
O=C1CCC2=C(CCN(C(=O)Nc3ccc(OC(F)(F)F)cc3)C2)N1	ZINC000853813636	FF	On-Demand	Anodyne	EPHX2	64	52
O=C1CCC2=C(CCN(C(=O)Nc3ccc(OC(F)(F)F)cc3)C2)N1	ZINC000853813636	FF	On-Demand	Anodyne	TRPM8	42	46
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1OCc1cn2ccccc2n1	ZINC000853813645	JI	On-Demand	Reactive	PPIA	21	41
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1OCc1cn2ccccc2n1	ZINC000853813645	JI	On-Demand	Reactive	KCNK3	55	38
O=C(NNC(=S)Nc1cccc(Cl)c1)c1ccccc1OCc1cn2ccccc2n1	ZINC000853813645	JI	On-Demand	Reactive	KCNK9	50	38
O=C1CCC2=C(CCN(C(=O)Nc3cccc(CN4C(=O)CNC4=O)c3)C2)N1	ZINC000853813646	GD	On-Demand	Anodyne	P2RY14	50	36
C#CCNC(=O)c1ccc(N2C[C@@]3(C)COC[C@@]3(C)C2)nc1	ZINC000853813651	CD	On-Demand	Mild	HDAC1	17	42
CON(C)CCNC(=O)Nc1nc2c(s1)CCCC2	ZINC000853813656	CD	On-Demand	Anodyne	SLC27A1	38	43
CON(C)CCNC(=O)Nc1ccc(C)cc1	ZINC000853813675	BD	On-Demand	Anodyne	CA12	15	44
CON(C)CCNC(=O)Nc1ccc(C)cc1	ZINC000853813675	BD	On-Demand	Anodyne	CA9	15	44
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)c3cnns3)CC2)C1	ZINC000853813683	GG	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)c3cnns3)CC2)C1	ZINC000853813684	GG	On-Demand	Anodyne	GPR119	29	44
CC[C@H](C)N(CC)C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000853813687	CG	On-Demand	Anodyne	KCNQ2	45	37
CC[C@H](C)N(CC)C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000853813687	CG	On-Demand	Anodyne	PRNP	15	41
CC[C@H](C)N(CC)C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000853813687	CG	On-Demand	Anodyne	DGAT1	38	43
CON(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853813688	BD	On-Demand	Anodyne	CCKAR	25	51
CON(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853813688	BD	On-Demand	Anodyne	KDR	22	40
CON(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853813688	BD	On-Demand	Anodyne	CCKBR	39	48
CON(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853813688	BD	On-Demand	Anodyne	KCNK3	84	42
CON(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853813688	BD	On-Demand	Anodyne	KCNK9	71	42
CON(C)CCNC(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853813689	DE	On-Demand	Anodyne	CDK5	24	40
CON(C)CCNC(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853813689	DE	On-Demand	Anodyne	SCD1	38	40
CON(C)CCNC(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853813689	DE	On-Demand	Anodyne	SCD	34	40
CC(C)(C)OC(=O)N1CCC[C@H](C2CCN(C(=O)C(C)(F)F)CC2)C1	ZINC000853813690	FH	On-Demand	Anodyne	GPR119	24	44
CC(C)(C)OC(=O)N1CCC[C@@H](C2CCN(C(=O)C(C)(F)F)CC2)C1	ZINC000853813691	FH	On-Demand	Anodyne	GPR119	24	44
CON(C)CCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853813695	EE	On-Demand	Anodyne	SCD1	41	44
CON(C)CCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853813695	EE	On-Demand	Anodyne	SCD	39	45
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	PPIA	18	41
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	NPY1R	20	41
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	CCR3	18	42
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	MCHR1	17	49
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	TAAR1	15	41
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	IMDH_CRYPV	18	40
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	KCNK3	53	39
CON(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853813707	CD	On-Demand	Anodyne	KCNK9	48	39
CON(C)CCNC(=O)Nc1cccnc1N1CCCC1	ZINC000853813709	CD	On-Demand	Anodyne	KCNQ2	65	36
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA2	162	63
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA6	26	40
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA1	142	59
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA7	73	63
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA13	28	41
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA5B	64	47
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA4	130	53
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA5A	69	47
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA14	60	63
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA12	96	56
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CA9	107	56
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CAH_METTE	27	40
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	UREA_CANEN	27	40
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	CYNT	49	45
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	NCE103	35	41
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	MTCA1	61	47
CC[C@H](C)N(CC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853813711	CD	On-Demand	Anodyne	P96878_MYCTU	76	52
O=C1NCC[C@H]1NC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853813719	DC	On-Demand	Bother	SLC27A4	42	31
O=C1NCC[C@H]1NC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853813719	DC	On-Demand	Bother	TRAR	17	40
O=C1NCC[C@@H]1NC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853813720	DC	On-Demand	Bother	SLC27A4	42	31
O=C1NCC[C@@H]1NC(=O)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853813720	DC	On-Demand	Bother	TRAR	17	40
CON(C)CCNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853813721	EC	On-Demand	Anodyne	HRH2	26	41
CON(C)CCNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853813721	EC	On-Demand	Anodyne	NPY1R	46	40
O=C1CCC2=C(CCN(C(=O)Nc3nc4c(s3)CCC4)C2)N1	ZINC000853813727	DE	On-Demand	Anodyne	SLC27A1	30	40
C[C@H]1C[C@H]1c1nnc2ccc(N[C@H]3CCN(C(=O)OC(C)(C)C)C3)nn12	ZINC000853813751	FF	On-Demand	Anodyne	GPR119	35	40
NS(=O)(=O)c1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1	ZINC000853813757	FC	On-Demand	Anodyne	CA2	43	41
NS(=O)(=O)c1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1	ZINC000853813757	FC	On-Demand	Anodyne	CA1	42	39
NS(=O)(=O)c1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1	ZINC000853813757	FC	On-Demand	Anodyne	CA9	35	41
NS(=O)(=O)c1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1	ZINC000853813757	FC	On-Demand	Anodyne	MTCA1	46	40
NS(=O)(=O)c1ccc(NC(=O)N2CCC3=C(CCC(=O)N3)C2)cc1	ZINC000853813757	FC	On-Demand	Anodyne	P96878_MYCTU	58	40
COC[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1ccc(C)o1	ZINC000853813765	GH	On-Demand	Reactive	CSNK1D	37	43
COC[C@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1ccc(C)o1	ZINC000853813766	GH	On-Demand	Reactive	CSNK1D	37	43
C=CC[C@@H]1CCCC[C@@H]1NC(=O)Nc1cccnc1Cl	ZINC000853813767	CH	On-Demand	Mild	G2YM83_BOTF4	66	34
C=CC[C@H]1CCCC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853813768	CH	On-Demand	Mild	G2YM83_BOTF4	66	34
C=CC[C@H]1CCCC[C@@H]1NC(=O)Nc1cccnc1Cl	ZINC000853813769	CH	On-Demand	Mild	G2YM83_BOTF4	66	34
C=CC[C@@H]1CCCC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853813770	CH	On-Demand	Mild	G2YM83_BOTF4	66	34
CN1CCN(c2ccccc2NC(=O)NNC(=O)c2cn(C)nn2)CC1	ZINC000853813772	FC	On-Demand	Reactive	KCNQ2	73	40
Cc1nc(C(=O)N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n(C)n1	ZINC000853813775	GF	On-Demand	Anodyne	GPR119	23	44
Cc1nc(C(=O)N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n(C)n1	ZINC000853813776	GF	On-Demand	Anodyne	GPR119	23	44
CON(C)CCNC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C	ZINC000853813787	ED	On-Demand	Anodyne	UTS2	45	35
CON(C)CCNC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C	ZINC000853813788	ED	On-Demand	Anodyne	UTS2	45	35
COCCc1ccc(OC[C@@H](O)CNC(=O)n2ccnc2)cc1	ZINC000853813821	DD	On-Demand	Anodyne	ADRB2	38	55
COCCc1ccc(OC[C@@H](O)CNC(=O)n2ccnc2)cc1	ZINC000853813821	DD	On-Demand	Anodyne	ADRB1	71	61
COCCc1ccc(OC[C@@H](O)CNC(=O)n2ccnc2)cc1	ZINC000853813821	DD	On-Demand	Anodyne	ADRB3	50	42
COCCc1ccc(OC[C@H](O)CNC(=O)n2ccnc2)cc1	ZINC000853813822	DD	On-Demand	Anodyne	ADRB2	38	55
COCCc1ccc(OC[C@H](O)CNC(=O)n2ccnc2)cc1	ZINC000853813822	DD	On-Demand	Anodyne	ADRB1	71	61
COCCc1ccc(OC[C@H](O)CNC(=O)n2ccnc2)cc1	ZINC000853813822	DD	On-Demand	Anodyne	ADRB3	50	42
Cc1nsc(C(=O)N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853813829	GG	On-Demand	Anodyne	GPR119	25	44
Cc1nsc(C(=O)N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)n1	ZINC000853813830	GG	On-Demand	Anodyne	GPR119	25	44
COCCN(CCF)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853813902	GE	On-Demand	Anodyne	GRIN2B	68	39
COCCN(CCF)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853813902	GE	On-Demand	Anodyne	CCR3	37	40
COCCN(CCF)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853813902	GE	On-Demand	Anodyne	ACKR3	51	32
COCCc1ccc(OC[C@@H](O)CNC(=O)c2cc(C)nc3cc(C)nn23)cc1	ZINC000853813930	GD	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@@H](O)CNC(=O)c2cc(C)nc3cc(C)nn23)cc1	ZINC000853813930	GD	On-Demand	Anodyne	ADRB1	54	49
COCCc1ccc(OC[C@H](O)CNC(=O)c2cc(C)nc3cc(C)nn23)cc1	ZINC000853813931	GD	On-Demand	Anodyne	ADRB2	31	49
COCCc1ccc(OC[C@H](O)CNC(=O)c2cc(C)nc3cc(C)nn23)cc1	ZINC000853813931	GD	On-Demand	Anodyne	ADRB1	54	49
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1COC2(CCC2)C1	ZINC000853813933	GE	On-Demand	Anodyne	GRIN2B	50	39
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@H]1COC2(CCC2)C1	ZINC000853813934	GE	On-Demand	Anodyne	GRIN2B	50	39
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)C(=O)NC3CC3)C2)CC1	ZINC000853813936	GE	On-Demand	Anodyne	GPR119	30	44
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)C(=O)NC3CC3)C2)CC1	ZINC000853813937	GE	On-Demand	Anodyne	GPR119	30	44
COC1CC(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853813943	DI	On-Demand	Anodyne	CA1	22	40
COC1CC(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853813943	DI	On-Demand	Anodyne	CCR3	24	40
COC1CC(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853813943	DI	On-Demand	Anodyne	TIMP3	40	31
COC1CC(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853813943	DI	On-Demand	Anodyne	ROCK2	19	45
C[C@@H](CNC(=O)Nc1ccccc1N1CCN(C)CC1)c1ccccn1	ZINC000853813948	FF	On-Demand	Anodyne	KCNQ2	77	42
Cc1nnc(C(=O)N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)s1	ZINC000853813963	GG	On-Demand	Anodyne	GPR119	26	45
Cc1nnc(C(=O)N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)s1	ZINC000853813964	GG	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)Nc3ccccn3)C2)CC1	ZINC000853813968	GH	On-Demand	Anodyne	GRIN2B	18	42
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)Nc3ccccn3)C2)CC1	ZINC000853813968	GH	On-Demand	Anodyne	GPR119	51	60
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)Nc3ccccn3)C2)CC1	ZINC000853813969	GH	On-Demand	Anodyne	GRIN2B	18	42
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)Nc3ccccn3)C2)CC1	ZINC000853813969	GH	On-Demand	Anodyne	GPR119	51	60
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCOCC2)cc1	ZINC000853813980	EC	On-Demand	Anodyne	ADRB2	38	59
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCOCC2)cc1	ZINC000853813980	EC	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCOCC2)cc1	ZINC000853813980	EC	On-Demand	Anodyne	ADRB3	47	44
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCOCC2)cc1	ZINC000853813981	EC	On-Demand	Anodyne	ADRB2	38	59
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCOCC2)cc1	ZINC000853813981	EC	On-Demand	Anodyne	ADRB1	72	59
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCOCC2)cc1	ZINC000853813981	EC	On-Demand	Anodyne	ADRB3	47	44
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)c3cnns3)C2)CC1	ZINC000853814011	GG	On-Demand	Anodyne	GPR119	43	47
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)c3cnns3)C2)CC1	ZINC000853814012	GG	On-Demand	Anodyne	GPR119	43	47
COCCc1ccc(OC[C@@H](O)CNC(=O)C(=O)C2CCSCC2)cc1	ZINC000853814034	GD	On-Demand	Anodyne	ADRB2	40	54
COCCc1ccc(OC[C@@H](O)CNC(=O)C(=O)C2CCSCC2)cc1	ZINC000853814034	GD	On-Demand	Anodyne	ADRB1	75	54
COCCc1ccc(OC[C@@H](O)CNC(=O)C(=O)C2CCSCC2)cc1	ZINC000853814034	GD	On-Demand	Anodyne	ADRB3	48	42
COCCc1ccc(OC[C@H](O)CNC(=O)C(=O)C2CCSCC2)cc1	ZINC000853814035	GD	On-Demand	Anodyne	ADRB2	40	54
COCCc1ccc(OC[C@H](O)CNC(=O)C(=O)C2CCSCC2)cc1	ZINC000853814035	GD	On-Demand	Anodyne	ADRB1	75	54
COCCc1ccc(OC[C@H](O)CNC(=O)C(=O)C2CCSCC2)cc1	ZINC000853814035	GD	On-Demand	Anodyne	ADRB3	48	42
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)c3nccs3)C2)CC1	ZINC000853814038	GH	On-Demand	Anodyne	GPR119	44	52
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)c3nccs3)C2)CC1	ZINC000853814039	GH	On-Demand	Anodyne	GPR119	44	52
Cn1ccnc1C(=O)N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853814044	GF	On-Demand	Anodyne	GPR119	43	52
Cn1ccnc1C(=O)N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853814045	GF	On-Demand	Anodyne	GPR119	43	52
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)C(C)(F)F)C2)CC1	ZINC000853814046	FH	On-Demand	Anodyne	GPR119	29	47
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)C(C)(F)F)C2)CC1	ZINC000853814047	FH	On-Demand	Anodyne	GPR119	29	47
COCCc1ccc(OC[C@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814067	DD	On-Demand	Anodyne	ADRB2	49	61
COCCc1ccc(OC[C@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814067	DD	On-Demand	Anodyne	ADRB1	76	61
COCCc1ccc(OC[C@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814067	DD	On-Demand	Anodyne	GRIN1	21	41
COCCc1ccc(OC[C@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814067	DD	On-Demand	Anodyne	ADRB3	48	45
COCCc1ccc(OC[C@@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814068	DD	On-Demand	Anodyne	ADRB2	49	61
COCCc1ccc(OC[C@@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814068	DD	On-Demand	Anodyne	ADRB1	76	61
COCCc1ccc(OC[C@@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814068	DD	On-Demand	Anodyne	GRIN1	21	41
COCCc1ccc(OC[C@@H](O)CNC(=O)C(C)(F)F)cc1	ZINC000853814068	DD	On-Demand	Anodyne	ADRB3	48	45
C#CCCN(CCOC)C(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C	ZINC000853814085	FF	On-Demand	Mild	UTS2	42	33
C#CCCN(CCOC)C(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C	ZINC000853814086	FF	On-Demand	Mild	UTS2	42	33
Cc1nc(NC(=O)N[C@H]2COC(C)(C)C2)sc1-c1ccccc1	ZINC000853814087	EH	On-Demand	Anodyne	PIK3CG	21	44
Cc1nc(NC(=O)N[C@@H]2COC(C)(C)C2)sc1-c1ccccc1	ZINC000853814088	EH	On-Demand	Anodyne	PIK3CG	21	44
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3cn(C)nn3)cc2F)C[C@@H](C)O1	ZINC000853814108	GD	On-Demand	Reactive	NPY2R	62	34
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3cn(C)nn3)cc2F)C[C@H](C)O1	ZINC000853814109	GD	On-Demand	Reactive	NPY2R	62	34
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)c3c[nH]c(C#N)c3)C2)CC1	ZINC000853814123	GG	On-Demand	Mild	GPR119	31	46
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)c3c[nH]c(C#N)c3)C2)CC1	ZINC000853814124	GG	On-Demand	Mild	GPR119	31	46
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853814132	EE	On-Demand	Anodyne	GRIN2B	74	43
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853814132	EE	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@@H]1C=CCC1	ZINC000853814132	EE	On-Demand	Anodyne	CCR3	48	45
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853814133	EE	On-Demand	Anodyne	GRIN2B	74	43
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853814133	EE	On-Demand	Anodyne	SIGMAR1	18	41
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)N[C@H]1C=CCC1	ZINC000853814133	EE	On-Demand	Anodyne	CCR3	48	45
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814139	ED	On-Demand	Anodyne	ADRB2	46	61
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814139	ED	On-Demand	Anodyne	ADRB1	78	61
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814139	ED	On-Demand	Anodyne	ADRB3	53	46
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814139	ED	On-Demand	Anodyne	ABCB1	31	42
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814140	ED	On-Demand	Anodyne	ADRB2	46	61
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814140	ED	On-Demand	Anodyne	ADRB1	78	61
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814140	ED	On-Demand	Anodyne	ADRB3	53	46
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCCC2)cc1	ZINC000853814140	ED	On-Demand	Anodyne	ABCB1	31	42
COC1CC(CCNC(=O)Nc2cccnc2Cl)C1	ZINC000853814186	CF	On-Demand	Anodyne	G2YM83_BOTF4	71	37
COC1CC(CCNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853814191	EE	On-Demand	Bother	CACNA1C	49	41
COC1CC(CCNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853814191	EE	On-Demand	Bother	CACNA1D	74	37
CN1CCN(c2ccccc2NC(=O)N[C@@H]2COC(C)(C)C2)CC1	ZINC000853814206	EE	On-Demand	Anodyne	KCNQ2	72	39
CN1CCN(c2ccccc2NC(=O)N[C@H]2COC(C)(C)C2)CC1	ZINC000853814207	EE	On-Demand	Anodyne	KCNQ2	72	39
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3COC(C)(C)C3)cc2F)C[C@@H](C)O1	ZINC000853814214	FG	On-Demand	Anodyne	ENV	42	41
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3COC(C)(C)C3)cc2F)C[C@@H](C)O1	ZINC000853814217	FG	On-Demand	Anodyne	ENV	42	41
Cc1nc(C(=O)N2CCC[C@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)no1	ZINC000853814242	GF	On-Demand	Anodyne	GPR119	26	46
Cc1nc(C(=O)N2CCC[C@@H](C3CCN(C(=O)OC(C)(C)C)CC3)C2)no1	ZINC000853814243	GF	On-Demand	Anodyne	GPR119	26	46
COCCc1ccc(OC[C@@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814260	GF	On-Demand	Anodyne	ADRB2	42	53
COCCc1ccc(OC[C@@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814260	GF	On-Demand	Anodyne	ADRB1	72	53
COCCc1ccc(OC[C@@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814260	GF	On-Demand	Anodyne	GRIN1	16	40
COCCc1ccc(OC[C@@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814260	GF	On-Demand	Anodyne	ADRB3	44	40
COCCc1ccc(OC[C@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814261	GF	On-Demand	Anodyne	ADRB2	42	53
COCCc1ccc(OC[C@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814261	GF	On-Demand	Anodyne	ADRB1	72	53
COCCc1ccc(OC[C@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814261	GF	On-Demand	Anodyne	GRIN1	16	40
COCCc1ccc(OC[C@H](O)CNC(=O)C(F)(F)c2ccccc2F)cc1	ZINC000853814261	GF	On-Demand	Anodyne	ADRB3	44	40
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)N3CCCC3)C2)CC1	ZINC000853814276	FH	On-Demand	Anodyne	GPR119	32	49
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)N3CCCC3)C2)CC1	ZINC000853814277	FH	On-Demand	Anodyne	GPR119	32	49
C#CCCN(CCOC)C(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814287	GE	On-Demand	Mild	GRIN2B	51	38
COCCc1ccc(OC[C@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814298	EC	On-Demand	Anodyne	ADRB2	41	55
COCCc1ccc(OC[C@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814298	EC	On-Demand	Anodyne	ADRB1	65	55
COCCc1ccc(OC[C@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814298	EC	On-Demand	Anodyne	ADRB3	42	43
COCCc1ccc(OC[C@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814298	EC	On-Demand	Anodyne	TPSAB1	44	35
COCCc1ccc(OC[C@@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814299	EC	On-Demand	Anodyne	ADRB2	41	55
COCCc1ccc(OC[C@@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814299	EC	On-Demand	Anodyne	ADRB1	65	55
COCCc1ccc(OC[C@@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814299	EC	On-Demand	Anodyne	ADRB3	42	43
COCCc1ccc(OC[C@@H](O)CNC(=O)c2noc(C)n2)cc1	ZINC000853814299	EC	On-Demand	Anodyne	TPSAB1	44	35
O=C(NNc1cccc2c1OC(F)(F)O2)Nc1ccc(N2CCOCC2)cn1	ZINC000853814305	GE	On-Demand	Reactive	STAT6	53	34
COC1CC(CCNC(=O)Nc2nc(C)c(-c3ccccc3)s2)C1	ZINC000853814306	EI	On-Demand	Anodyne	PIK3CG	24	47
COC1CC(CCNC(=O)Nc2nc(C)c(-c3ccccc3)s2)C1	ZINC000853814306	EI	On-Demand	Anodyne	PI4KB	41	44
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814327	GE	On-Demand	Anodyne	ADRB2	43	53
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814327	GE	On-Demand	Anodyne	ADRB1	88	53
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814327	GE	On-Demand	Anodyne	GRIN1	29	43
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814327	GE	On-Demand	Anodyne	ADRB3	55	48
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814328	GE	On-Demand	Anodyne	ADRB2	43	53
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814328	GE	On-Demand	Anodyne	ADRB1	88	53
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814328	GE	On-Demand	Anodyne	GRIN1	29	43
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2ccc(Cl)nc2)cc1	ZINC000853814328	GE	On-Demand	Anodyne	ADRB3	55	48
COC1CC(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853814329	EE	On-Demand	Anodyne	HTR1A	41	41
COC1CC(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853814329	EE	On-Demand	Anodyne	HTR1D	15	40
COC1CC(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853814329	EE	On-Demand	Anodyne	HTR1B	18	40
COC1CC(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853814329	EE	On-Demand	Anodyne	DRD3	52	36
COC1CC(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853814329	EE	On-Demand	Anodyne	KCNQ2	76	41
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814342	GE	On-Demand	Anodyne	ADRB2	41	52
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814342	GE	On-Demand	Anodyne	ADRB1	77	52
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814342	GE	On-Demand	Anodyne	ADRB3	48	42
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814342	GE	On-Demand	Anodyne	G2YM83_BOTF4	64	32
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814343	GE	On-Demand	Anodyne	ADRB2	41	52
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814343	GE	On-Demand	Anodyne	ADRB1	77	52
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814343	GE	On-Demand	Anodyne	ADRB3	48	42
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2cccnc2Cl)cc1	ZINC000853814343	GE	On-Demand	Anodyne	G2YM83_BOTF4	64	32
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814350	DD	On-Demand	Anodyne	ADRB2	49	62
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814350	DD	On-Demand	Anodyne	ADRB1	80	62
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814350	DD	On-Demand	Anodyne	ADRB3	54	46
COCCc1ccc(OC[C@@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814350	DD	On-Demand	Anodyne	ABCB1	33	41
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814351	DD	On-Demand	Anodyne	ADRB2	49	62
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814351	DD	On-Demand	Anodyne	ADRB1	80	62
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814351	DD	On-Demand	Anodyne	ADRB3	54	46
COCCc1ccc(OC[C@H](O)CNC(=O)N2CCCC2)cc1	ZINC000853814351	DD	On-Demand	Anodyne	ABCB1	33	41
C[C@@H](CNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccn1	ZINC000853814366	GH	On-Demand	Anodyne	NPY2R	86	41
C[C@@H](CNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)c1ccccn1	ZINC000853814366	GH	On-Demand	Anodyne	PRNP	16	43
C[C@H]1CN(c2ccc(NC(=O)NC[C@H](C)c3ccccn3)cc2F)C[C@@H](C)O1	ZINC000853814368	GH	On-Demand	Anodyne	NPY2R	86	41
C[C@H]1CN(c2ccc(NC(=O)NC[C@H](C)c3ccccn3)cc2F)C[C@@H](C)O1	ZINC000853814368	GH	On-Demand	Anodyne	PRNP	16	43
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H](C)c3ccccn3)cc2F)C[C@@H](C)O1	ZINC000853814369	GH	On-Demand	Anodyne	NPY2R	86	41
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H](C)c3ccccn3)cc2F)C[C@@H](C)O1	ZINC000853814369	GH	On-Demand	Anodyne	PRNP	16	43
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCc1ncccn1	ZINC000853814380	FD	On-Demand	Anodyne	GRIN2B	91	47
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCc1ncccn1	ZINC000853814380	FD	On-Demand	Anodyne	SIGMAR1	15	42
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCc1ncccn1	ZINC000853814380	FD	On-Demand	Anodyne	CCR3	44	47
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCc1ncccn1	ZINC000853814380	FD	On-Demand	Anodyne	EPHX2	18	42
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCc1ncccn1	ZINC000853814380	FD	On-Demand	Anodyne	SCD	22	42
COC1CC(CCNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1	ZINC000853814405	GG	On-Demand	Anodyne	NPY2R	58	36
COC1CC(CCNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853814406	GG	On-Demand	Anodyne	NPY2R	58	36
COC1CC(CCNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853814407	GG	On-Demand	Anodyne	NPY2R	58	36
COCCN(CCF)C(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)C	ZINC000853814410	EF	On-Demand	Anodyne	UTS2	44	35
COCCN(CCF)C(=O)NC[C@H](c1ccc(Cl)cc1)N(C)C	ZINC000853814411	EF	On-Demand	Anodyne	UTS2	44	35
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)n3ccnc3)C2)CC1	ZINC000853814415	FG	On-Demand	Anodyne	GPR119	36	52
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)n3ccnc3)C2)CC1	ZINC000853814416	FG	On-Demand	Anodyne	GPR119	36	52
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)C(=O)c3ccc[nH]3)C2)CC1	ZINC000853814422	GG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)C(=O)c3ccc[nH]3)C2)CC1	ZINC000853814423	GG	On-Demand	Anodyne	GPR119	40	46
CC(C)(C)OC(=O)N1CCC([C@H]2CCCN(C(=O)c3cc(C#N)c[nH]3)C2)CC1	ZINC000853814453	GG	On-Demand	Mild	GPR119	28	48
CC(C)(C)OC(=O)N1CCC([C@@H]2CCCN(C(=O)c3cc(C#N)c[nH]3)C2)CC1	ZINC000853814454	GG	On-Demand	Mild	GPR119	28	48
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814475	GF	On-Demand	Anodyne	ADRB2	43	53
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814475	GF	On-Demand	Anodyne	ADRB1	76	53
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814475	GF	On-Demand	Anodyne	ADRB3	47	44
COCCc1ccc(OC[C@@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814475	GF	On-Demand	Anodyne	ACOX1	43	31
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814476	GF	On-Demand	Anodyne	ADRB2	43	53
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814476	GF	On-Demand	Anodyne	ADRB1	76	53
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814476	GF	On-Demand	Anodyne	ADRB3	47	44
COCCc1ccc(OC[C@H](O)CNC(=O)Nc2nc(C)c(C)s2)cc1	ZINC000853814476	GF	On-Demand	Anodyne	ACOX1	43	31
Cn1ncnc1C(=O)N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853814481	GE	On-Demand	Anodyne	GPR119	44	49
Cn1ncnc1C(=O)N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853814482	GE	On-Demand	Anodyne	GPR119	44	49
CN1CCN(c2ccccc2NC(=O)NCCc2noc3ccccc23)CC1	ZINC000853814483	GF	On-Demand	Anodyne	HTR1A	16	46
CN1CCN(c2ccccc2NC(=O)NCCc2noc3ccccc23)CC1	ZINC000853814483	GF	On-Demand	Anodyne	DRD2	16	46
CN1CCN(c2ccccc2NC(=O)NCCc2noc3ccccc23)CC1	ZINC000853814483	GF	On-Demand	Anodyne	KCNQ2	71	36
COCCc1ccc(OC[C@@H](O)CNC(=O)c2nccn2C)cc1	ZINC000853814516	EC	On-Demand	Anodyne	ADRB2	46	58
COCCc1ccc(OC[C@@H](O)CNC(=O)c2nccn2C)cc1	ZINC000853814516	EC	On-Demand	Anodyne	ADRB1	75	58
COCCc1ccc(OC[C@@H](O)CNC(=O)c2nccn2C)cc1	ZINC000853814516	EC	On-Demand	Anodyne	ADRB3	51	42
COCCc1ccc(OC[C@H](O)CNC(=O)c2nccn2C)cc1	ZINC000853814517	EC	On-Demand	Anodyne	ADRB2	46	58
COCCc1ccc(OC[C@H](O)CNC(=O)c2nccn2C)cc1	ZINC000853814517	EC	On-Demand	Anodyne	ADRB1	75	58
COCCc1ccc(OC[C@H](O)CNC(=O)c2nccn2C)cc1	ZINC000853814517	EC	On-Demand	Anodyne	ADRB3	51	42
COC(=O)N(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814522	GD	On-Demand	Anodyne	GRIN2B	66	41
COC(=O)N(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814522	GD	On-Demand	Anodyne	CCR3	51	44
COC(=O)N(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814522	GD	On-Demand	Anodyne	CCR5	15	41
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCC1SCCS1	ZINC000853814537	GF	On-Demand	Anodyne	GRIN2B	81	44
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCC1SCCS1	ZINC000853814537	GF	On-Demand	Anodyne	CCR3	40	43
O=C(NCC(=O)N1CCC(Cc2ccccc2)CC1)NCC1SCCS1	ZINC000853814537	GF	On-Demand	Anodyne	GRIN2C	19	40
CON(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814549	FD	On-Demand	Anodyne	GRIN2B	76	42
CON(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814549	FD	On-Demand	Anodyne	SIGMAR1	15	43
CON(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814549	FD	On-Demand	Anodyne	CCR3	58	46
CON(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814549	FD	On-Demand	Anodyne	CCR5	19	42
CON(C)CCNC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853814549	FD	On-Demand	Anodyne	AMP1_PLAFQ	16	45
COCCc1ccc(OC[C@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814554	FD	On-Demand	Anodyne	ADRB2	48	56
COCCc1ccc(OC[C@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814554	FD	On-Demand	Anodyne	ADRB1	74	56
COCCc1ccc(OC[C@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814554	FD	On-Demand	Anodyne	GRIN1	26	40
COCCc1ccc(OC[C@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814554	FD	On-Demand	Anodyne	ADRB3	50	46
COCCc1ccc(OC[C@@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814555	FD	On-Demand	Anodyne	ADRB2	48	56
COCCc1ccc(OC[C@@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814555	FD	On-Demand	Anodyne	ADRB1	74	56
COCCc1ccc(OC[C@@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814555	FD	On-Demand	Anodyne	GRIN1	26	40
COCCc1ccc(OC[C@@H](O)CNC(=O)c2nc(C)ns2)cc1	ZINC000853814555	FD	On-Demand	Anodyne	ADRB3	50	46
C#C[C@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)C1CCOCC1	ZINC000853814558	GE	On-Demand	Mild	GRIN2B	59	39
C#C[C@@H](NC(=O)NCC(=O)N1CCC(Cc2ccccc2)CC1)C1CCOCC1	ZINC000853814559	GE	On-Demand	Mild	GRIN2B	59	39
O=C(Nc1cccc(CN2CCCS2(=O)=O)c1)N1CCCCC1	ZINC000853814596	EE	On-Demand	Anodyne	FAAH	17	46
O=C(Nc1cccc(CN2CCCS2(=O)=O)c1)N1CCCCC1	ZINC000853814596	EE	On-Demand	Anodyne	P2RY14	46	35
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(Cl)nc2)CC1	ZINC000853814606	EE	On-Demand	Anodyne	NAMPT	31	45
CS(=O)(=O)CC1(CCNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CC1	ZINC000853814623	GD	On-Demand	Bother	CACNA1D	46	34
COC[C@H](Cc1ccccc1)NC(=O)NNc1ccc(C)c(F)c1	ZINC000853814655	EG	On-Demand	Reactive	MME	40	38
COC[C@H](Cc1ccccc1)NC(=O)NNc1ccc(C)c(F)c1	ZINC000853814655	EG	On-Demand	Reactive	PAPA1_CARPA	43	34
COC[C@@H](Cc1ccccc1)NC(=O)NNc1ccc(C)c(F)c1	ZINC000853814658	EG	On-Demand	Reactive	MME	40	38
COC[C@@H](Cc1ccccc1)NC(=O)NNc1ccc(C)c(F)c1	ZINC000853814658	EG	On-Demand	Reactive	PAPA1_CARPA	43	34
Cc1nnc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)s1	ZINC000853814679	FH	On-Demand	Anodyne	ROCK2	27	45
CCn1cc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)ccc1=O	ZINC000853814698	GH	On-Demand	Anodyne	ROCK2	21	40
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)Nc1ccc2c(c1)OCCO2	ZINC000853814717	GH	On-Demand	Anodyne	NPY2R	40	37
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)Nc1ccc2c(c1)OCCO2	ZINC000853814717	GH	On-Demand	Anodyne	EPHX2	16	42
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)Nc1ccc2c(c1)OCCO2	ZINC000853814718	GH	On-Demand	Anodyne	NPY2R	40	37
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)Nc1ccc2c(c1)OCCO2	ZINC000853814718	GH	On-Demand	Anodyne	EPHX2	16	42
COc1ncccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853814727	FH	On-Demand	Anodyne	TRPV1	15	40
COc1ncccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853814727	FH	On-Demand	Anodyne	P2RY1	46	41
COc1ncccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853814727	FH	On-Demand	Anodyne	ROCK2	30	47
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1cccnc1Cl	ZINC000853814733	FF	On-Demand	Anodyne	CCR3	35	40
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1cccnc1Cl	ZINC000853814733	FF	On-Demand	Anodyne	CACNA1I	50	34
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1cccnc1Cl	ZINC000853814733	FF	On-Demand	Anodyne	G2YM83_BOTF4	64	33
COCCN(CCF)C(=O)NCc1ccc(-c2ccc(OC)cc2)s1	ZINC000853814800	FH	On-Demand	Anodyne	HSD17B2	15	41
COCC1(NC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CCCC1	ZINC000853814801	GH	On-Demand	Anodyne	NPY2R	58	36
COCC1(NC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CCCC1	ZINC000853814802	GH	On-Demand	Anodyne	NPY2R	58	36
COCC1(NC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CCCC1	ZINC000853814803	GH	On-Demand	Anodyne	NPY2R	58	36
CON(C)CCNC(=O)N[C@H](C)[C@@H](C)c1ccccc1	ZINC000853814831	CD	On-Demand	Anodyne	MME	15	42
CON(C)CCNC(=O)N[C@@H](C)[C@@H](C)c1ccccc1	ZINC000853814832	CD	On-Demand	Anodyne	MME	15	42
CON(C)CCNC(=O)N[C@H](C)[C@H](C)c1ccccc1	ZINC000853814833	CD	On-Demand	Anodyne	MME	15	42
CON(C)CCNC(=O)N[C@@H](C)[C@H](C)c1ccccc1	ZINC000853814834	CD	On-Demand	Anodyne	MME	15	42
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(C2CCCCC2)CC1	ZINC000853814841	GH	On-Demand	Anodyne	SIGMAR1	25	43
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCN(C2CCCCC2)CC1	ZINC000853814841	GH	On-Demand	Anodyne	EPHX2	22	42
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(C2CCCCC2)CC1	ZINC000853814842	GH	On-Demand	Anodyne	SIGMAR1	25	43
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN(C2CCCCC2)CC1	ZINC000853814842	GH	On-Demand	Anodyne	EPHX2	22	42
CCn1cc(C(=O)C(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)cn1	ZINC000853814877	FF	On-Demand	Anodyne	PANC	51	34
CCC(=O)c1ccc(N(C)Cc2nnc(C)o2)c(S(N)(=O)=O)c1	ZINC000853814880	ED	On-Demand	Anodyne	CA13	41	37
COC(=O)c1sccc1NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C	ZINC000853814889	GG	On-Demand	Anodyne	FAS	43	45
CCN1CCC[C@H](CN(C)c2ccc([N+](=O)[O-])c3nonc23)[C@@H]1c1cnn(C)c1	ZINC000853814900	GF	On-Demand	Bother	GSTM2	58	35
CCN1CCC[C@H](CN(C)c2ccc([N+](=O)[O-])c3nonc23)[C@H]1c1cnn(C)c1	ZINC000853814903	GF	On-Demand	Bother	GSTM2	58	35
O=C(NCC1CCN(C2CCOCC2)CC1)C(F)(F)c1ccccc1F	ZINC000853814909	FF	On-Demand	Anodyne	CACNA1I	48	33
COC(=O)c1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000853814920	GG	On-Demand	Anodyne	KCNK3	42	33
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853814921	GE	On-Demand	Anodyne	REN	23	40
COC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853814922	GE	On-Demand	Anodyne	REN	23	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853814923	GE	On-Demand	Anodyne	REN	23	40
COC[C@@H](Cc1ccccc1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853814924	GE	On-Demand	Anodyne	REN	23	40
O=C(NCCOCc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853814930	EF	On-Demand	Anodyne	NAAA	33	40
O=C(NCCOCc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853814931	EF	On-Demand	Anodyne	NAAA	33	40
O=C(NCCOCc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853814932	EF	On-Demand	Anodyne	NAAA	33	40
O=C(NCCOCc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853814933	EF	On-Demand	Anodyne	NAAA	33	40
Cc1nc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)sc1C	ZINC000853814934	GI	On-Demand	Anodyne	ROCK2	22	47
COc1ccc(N2CC[C@H](NC(=O)NC3CCC(C(N)=O)CC3)C2)cc1	ZINC000853814950	FD	On-Demand	Clean	MTNR1A	19	47
COc1ccc(N2CC[C@H](NC(=O)NC3CCC(C(N)=O)CC3)C2)cc1	ZINC000853814950	FD	On-Demand	Clean	MTNR1B	19	47
O=[N+]([O-])c1ccc(N2CCC[C@H]2c2nccc(C(F)(F)F)n2)c2nonc12	ZINC000853814983	GG	On-Demand	Bother	GSTM2	71	36
O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2nccc(C(F)(F)F)n2)c2nonc12	ZINC000853814984	GG	On-Demand	Bother	GSTM2	71	36
COC[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853815023	EH	On-Demand	Anodyne	ADRB1	43	34
COC[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853815023	EH	On-Demand	Anodyne	MME	22	40
COC[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853815023	EH	On-Demand	Anodyne	CA1	27	40
COC[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)OC	ZINC000853815023	EH	On-Demand	Anodyne	ROCK2	18	45
CC(=O)Nc1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000853815042	GG	On-Demand	Anodyne	KCNK3	46	33
CC(=O)Nc1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000853815042	GG	On-Demand	Anodyne	KCNK9	52	33
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	HRH2	15	45
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	PDGFRB	15	48
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	CCR3	20	45
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	ROCK1	32	48
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	MTNR1A	40	42
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	MTNR1B	41	45
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	ROCK2	50	58
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	EPHX2	18	46
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	TAAR1	36	42
COc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815043	FI	On-Demand	Anodyne	PDS	52	40
Cn1ccnc1C(=O)NCC1CCN(C2CCOCC2)CC1	ZINC000853815056	DD	On-Demand	Anodyne	HTR4	52	41
Cn1ccnc1C(=O)NCC1CCN(C2CCOCC2)CC1	ZINC000853815056	DD	On-Demand	Anodyne	CACNA1I	66	37
Cn1c(S)nnc1CCNC(=O)NCCCc1ccc(Cl)cc1Cl	ZINC000853815066	GF	On-Demand	Anodyne	CNR1	20	41
CC(=O)c1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000853815067	FH	On-Demand	Anodyne	KCNK3	54	33
CC(=O)c1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000853815067	FH	On-Demand	Anodyne	KCNK9	46	31
COC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853815069	EF	On-Demand	Anodyne	ACE	21	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853815069	EF	On-Demand	Anodyne	MME	48	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853815070	EF	On-Demand	Anodyne	ACE	21	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853815070	EF	On-Demand	Anodyne	MME	48	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853815072	EF	On-Demand	Anodyne	ACE	21	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853815072	EF	On-Demand	Anodyne	MME	48	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853815074	EF	On-Demand	Anodyne	ACE	21	40
COC[C@H](Cc1ccccc1)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853815074	EF	On-Demand	Anodyne	MME	48	40
Cc1nsc(C(=O)NCC2CCN(C3CCOCC3)CC2)n1	ZINC000853815078	DD	On-Demand	Anodyne	HTR4	44	39
Cc1nsc(C(=O)NCC2CCN(C3CCOCC3)CC2)n1	ZINC000853815078	DD	On-Demand	Anodyne	CACNA1I	54	34
CN1CCN(c2ccccc2NC(=O)NCc2cnc(C(F)(F)F)nc2)CC1	ZINC000853815083	GF	On-Demand	Anodyne	KCNQ2	77	42
CN1CCN(c2ccccc2NC(=O)NCc2cnc(C(F)(F)F)nc2)CC1	ZINC000853815083	GF	On-Demand	Anodyne	TRPV1	20	41
CN1CCN(c2ccccc2NC(=O)NCc2cnc(C(F)(F)F)nc2)CC1	ZINC000853815083	GF	On-Demand	Anodyne	P2RY1	43	36
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853815104	EF	On-Demand	Anodyne	DRD2	21	53
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853815104	EF	On-Demand	Anodyne	DRD3	36	43
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853815104	EF	On-Demand	Anodyne	NPY2R	25	42
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853815104	EF	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853815104	EF	On-Demand	Anodyne	CACNA1I	66	38
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853815105	EF	On-Demand	Anodyne	DRD2	21	53
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853815105	EF	On-Demand	Anodyne	DRD3	36	43
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853815105	EF	On-Demand	Anodyne	NPY2R	25	42
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853815105	EF	On-Demand	Anodyne	ACACB	15	42
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853815105	EF	On-Demand	Anodyne	CACNA1I	66	38
CCCn1nccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853815123	FH	On-Demand	Anodyne	ROCK2	18	40
Cc1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000853815134	EH	On-Demand	Anodyne	KCNK3	69	38
Cc1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)c1	ZINC000853815134	EH	On-Demand	Anodyne	KCNK9	65	37
CC(=O)Nc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815137	GI	On-Demand	Anodyne	ROCK2	27	49
CC(=O)Nc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815137	GI	On-Demand	Anodyne	KCNK3	42	31
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815138	DG	On-Demand	Anodyne	DRD2	15	43
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815138	DG	On-Demand	Anodyne	DRD3	25	42
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815138	DG	On-Demand	Anodyne	KCNQ2	40	38
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815138	DG	On-Demand	Anodyne	EPHX2	22	43
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815138	DG	On-Demand	Anodyne	CACNA1I	55	32
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815139	DG	On-Demand	Anodyne	DRD2	15	43
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815139	DG	On-Demand	Anodyne	DRD3	25	42
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815139	DG	On-Demand	Anodyne	KCNQ2	40	38
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815139	DG	On-Demand	Anodyne	EPHX2	22	43
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)N1CCCCC1	ZINC000853815139	DG	On-Demand	Anodyne	CACNA1I	55	32
Cc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)n1	ZINC000853815142	FI	On-Demand	Anodyne	HTR1D	21	40
Cc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)n1	ZINC000853815142	FI	On-Demand	Anodyne	HTR1B	17	40
Cc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)n1	ZINC000853815142	FI	On-Demand	Anodyne	ROCK2	26	42
CC(=O)c1ccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000853815158	GJ	On-Demand	Anodyne	ROCK2	30	47
CC(=O)c1ccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000853815158	GJ	On-Demand	Anodyne	EPHX2	15	43
CC(=O)c1ccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000853815158	GJ	On-Demand	Anodyne	IMDH_CRYPV	49	34
CC(=O)c1ccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)cc1	ZINC000853815158	GJ	On-Demand	Anodyne	NAMPT	36	45
COC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853815162	CD	On-Demand	Anodyne	MME	65	44
COC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853815162	CD	On-Demand	Anodyne	ANPEP	40	33
COC[C@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853815162	CD	On-Demand	Anodyne	PAPA1_CARPA	46	35
COC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853815163	CD	On-Demand	Anodyne	MME	65	44
COC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853815163	CD	On-Demand	Anodyne	ANPEP	40	33
COC[C@@H](Cc1ccccc1)NC(=O)NCCN(C)OC	ZINC000853815163	CD	On-Demand	Anodyne	PAPA1_CARPA	46	35
Cc1nc(NC(=O)NCCC2(CS(C)(=O)=O)CC2)sc1-c1ccccc1	ZINC000853815166	GG	On-Demand	Anodyne	PIK3CG	19	46
Cc1nc(NC(=O)NCCC2(CS(C)(=O)=O)CC2)sc1-c1ccccc1	ZINC000853815166	GG	On-Demand	Anodyne	PI4KB	40	42
Cc1nsc(C(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853815200	EF	On-Demand	Anodyne	HTR4	43	37
Cc1nsc(C(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853815200	EF	On-Demand	Anodyne	CACNA1I	54	36
Cc1nsc(C(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853815202	EF	On-Demand	Anodyne	HTR4	43	37
Cc1nsc(C(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000853815202	EF	On-Demand	Anodyne	CACNA1I	54	36
O=C(N1CCC[C@H]([C@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815203	GG	On-Demand	Anodyne	AKT2	42	42
O=C(N1CCC[C@H]([C@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815203	GG	On-Demand	Anodyne	JAK3	27	61
O=C(N1CCC[C@H]([C@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815203	GG	On-Demand	Anodyne	JAK1	40	37
O=C(N1CCC[C@H]([C@@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815206	GG	On-Demand	Anodyne	AKT2	42	42
O=C(N1CCC[C@H]([C@@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815206	GG	On-Demand	Anodyne	JAK3	27	61
O=C(N1CCC[C@H]([C@@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815206	GG	On-Demand	Anodyne	JAK1	40	37
O=C(N1CCC[C@@H]([C@@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815207	GG	On-Demand	Anodyne	AKT2	42	42
O=C(N1CCC[C@@H]([C@@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815207	GG	On-Demand	Anodyne	JAK3	27	61
O=C(N1CCC[C@@H]([C@@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815207	GG	On-Demand	Anodyne	JAK1	40	37
O=C(N1CCC[C@@H]([C@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815208	GG	On-Demand	Anodyne	AKT2	42	42
O=C(N1CCC[C@@H]([C@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815208	GG	On-Demand	Anodyne	JAK3	27	61
O=C(N1CCC[C@@H]([C@H]2CCCCN2c2ncnc3[nH]ccc23)C1)C(F)(F)F	ZINC000853815208	GG	On-Demand	Anodyne	JAK1	40	37
O=C(NCC1CCN(C2CCOCC2)CC1)c1nc(Br)cs1	ZINC000853815211	GF	On-Demand	Anodyne	CACNA1I	64	36
Cc1cc(C(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)n2nc(C)cc2n1	ZINC000853815228	GG	On-Demand	Anodyne	CACNA1I	54	35
Cc1cc(C(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)n2nc(C)cc2n1	ZINC000853815233	GG	On-Demand	Anodyne	CACNA1I	54	35
Cn1cc(C(=O)C(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)cn1	ZINC000853815255	FE	On-Demand	Anodyne	PANC	52	35
COC[C@H](Cc1ccccc1)NC(=O)NNc1cc(F)ccc1C	ZINC000853815258	EG	On-Demand	Reactive	PAPA1_CARPA	42	34
COC[C@@H](Cc1ccccc1)NC(=O)NNc1cc(F)ccc1C	ZINC000853815260	EG	On-Demand	Reactive	PAPA1_CARPA	42	34
Cc1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1C	ZINC000853815262	FJ	On-Demand	Anodyne	ROCK2	21	40
Cc1cc(C(=O)NCC2CCN(C3CCOCC3)CC2)n2nc(C)cc2n1	ZINC000853815294	FD	On-Demand	Anodyne	HTR4	40	38
Cc1cc(C(=O)NCC2CCN(C3CCOCC3)CC2)n2nc(C)cc2n1	ZINC000853815294	FD	On-Demand	Anodyne	CACNA1I	59	35
Cc1nc(C(=O)NCC2CCN(C3CCOCC3)CC2)no1	ZINC000853815310	DC	On-Demand	Anodyne	HTR4	52	40
Cc1nc(C(=O)NCC2CCN(C3CCOCC3)CC2)no1	ZINC000853815310	DC	On-Demand	Anodyne	CACNA1I	61	37
COC[C@@H](CCNC(=O)Nc1nc(C)c(-c2ccccc2)s1)OC	ZINC000853815313	EG	On-Demand	Anodyne	PIK3CG	20	47
COC[C@@H](CCNC(=O)Nc1nc(C)c(-c2ccccc2)s1)OC	ZINC000853815313	EG	On-Demand	Anodyne	PI4KB	39	44
COc1ccccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853815321	FI	On-Demand	Anodyne	TRPV1	22	40
COc1ccccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853815321	FI	On-Demand	Anodyne	CCKAR	24	44
COc1ccccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853815321	FI	On-Demand	Anodyne	ROCK2	30	44
COc1ccccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853815321	FI	On-Demand	Anodyne	KCNK3	51	40
COc1ccccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853815321	FI	On-Demand	Anodyne	KCNK9	48	40
Cc1cccc(NC(=O)N(C)CC(C)(C)NC(=O)OC(C)(C)C)n1	ZINC000853815329	EG	On-Demand	Anodyne	GRM5	17	41
C[Si](C)(C)c1ccc(CNC(=O)NC2CCC(C(N)=O)CC2)cc1	ZINC000853815345	EE	On-Demand	Anodyne	EPHX2	18	41
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)Nc1cccnc1Cl	ZINC000853815354	FI	On-Demand	Anodyne	KCNQ2	58	39
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)Nc1cccnc1Cl	ZINC000853815354	FI	On-Demand	Anodyne	NAMPT	15	40
O=C(NC[C@H]1CCN(c2ccccc2Cl)C1)Nc1cccnc1Cl	ZINC000853815354	FI	On-Demand	Anodyne	G2YM83_BOTF4	51	33
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)Nc1cccnc1Cl	ZINC000853815355	FI	On-Demand	Anodyne	KCNQ2	58	39
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)Nc1cccnc1Cl	ZINC000853815355	FI	On-Demand	Anodyne	NAMPT	15	40
O=C(NC[C@@H]1CCN(c2ccccc2Cl)C1)Nc1cccnc1Cl	ZINC000853815355	FI	On-Demand	Anodyne	G2YM83_BOTF4	51	33
CC(C)(C)OC(=O)C(=O)NCC1CCN(C2CCOCC2)CC1	ZINC000853815412	ED	On-Demand	Anodyne	CACNA1I	54	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](COC)Cc1ccccc1	ZINC000853815441	FE	On-Demand	Mild	PAPA1_CARPA	44	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](COC)Cc1ccccc1	ZINC000853815441	FE	On-Demand	Mild	FPR1	42	37
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](COC)Cc1ccccc1	ZINC000853815443	FE	On-Demand	Mild	PAPA1_CARPA	44	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](COC)Cc1ccccc1	ZINC000853815443	FE	On-Demand	Mild	FPR1	42	37
Cn1ccnc1C(=O)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853815461	DE	On-Demand	Anodyne	CACNA1I	60	38
Cn1ccnc1C(=O)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853815463	DE	On-Demand	Anodyne	CACNA1I	60	38
COC[C@@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)OC	ZINC000853815479	FD	On-Demand	Anodyne	DRD3	47	35
COC[C@@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)OC	ZINC000853815479	FD	On-Demand	Anodyne	KCNQ2	78	42
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853815499	FG	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853815499	FG	On-Demand	Anodyne	SLC18A3	17	43
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853815499	FG	On-Demand	Anodyne	EPHX2	29	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853815499	FG	On-Demand	Anodyne	L3MBTL3	40	35
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853815500	FG	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853815500	FG	On-Demand	Anodyne	SLC18A3	17	43
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853815500	FG	On-Demand	Anodyne	EPHX2	29	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853815500	FG	On-Demand	Anodyne	L3MBTL3	40	35
CC(=O)c1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815502	GJ	On-Demand	Anodyne	CCR3	25	41
CC(=O)c1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815502	GJ	On-Demand	Anodyne	ROCK2	27	47
CC(=O)c1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815502	GJ	On-Demand	Anodyne	EPHX2	15	43
CC(=O)c1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815502	GJ	On-Demand	Anodyne	IMDH_CRYPV	54	35
CC(=O)c1cccc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)c1	ZINC000853815502	GJ	On-Demand	Anodyne	KCNK3	54	33
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853815503	FG	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853815503	FG	On-Demand	Anodyne	SLC18A3	17	43
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853815503	FG	On-Demand	Anodyne	EPHX2	29	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853815503	FG	On-Demand	Anodyne	L3MBTL3	40	35
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853815505	FG	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853815505	FG	On-Demand	Anodyne	SLC18A3	17	43
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853815505	FG	On-Demand	Anodyne	EPHX2	29	44
O=C(NC1CCN(C2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853815505	FG	On-Demand	Anodyne	L3MBTL3	40	35
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(Cl)nc1	ZINC000853815523	FF	On-Demand	Anodyne	MTOR	69	35
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(Cl)nc1	ZINC000853815523	FF	On-Demand	Anodyne	EPHX2	22	42
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(Cl)nc1	ZINC000853815523	FF	On-Demand	Anodyne	CACNA1I	54	35
Cc1nc(C(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)no1	ZINC000853815531	DE	On-Demand	Anodyne	DRD2	20	41
Cc1nc(C(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)no1	ZINC000853815531	DE	On-Demand	Anodyne	HTR4	57	37
Cc1nc(C(=O)NC[C@H]2CCN(c3ccccc3Cl)C2)no1	ZINC000853815531	DE	On-Demand	Anodyne	CACNA1I	61	38
Cc1nc(C(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)no1	ZINC000853815533	DE	On-Demand	Anodyne	DRD2	20	41
Cc1nc(C(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)no1	ZINC000853815533	DE	On-Demand	Anodyne	HTR4	57	37
Cc1nc(C(=O)NC[C@@H]2CCN(c3ccccc3Cl)C2)no1	ZINC000853815533	DE	On-Demand	Anodyne	CACNA1I	61	38
N#Cc1cc(S(N)(=O)=O)ccc1NCCS(=O)(=O)CC(F)(F)F	ZINC000853815562	FC	On-Demand	Mild	CA2	21	40
NC(=O)C1CCC(NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853815566	FF	On-Demand	Reactive	LCK	19	46
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	CCR3	47	48
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	PIK3CA	50	42
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	CHRNA7	22	45
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	MTOR	136	42
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	EPHX2	37	42
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	PIK3CG	35	42
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	CACNA1I	40	32
O=C(NCC1CCN(C2CCOCC2)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853815581	GI	On-Demand	Anodyne	NAMPT	27	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CC#N)C2)CC1	ZINC000853815582	EF	On-Demand	Mild	KCNQ2	76	40
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CC#N)C2)CC1	ZINC000853815582	EF	On-Demand	Mild	CSF1R	19	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CC#N)C2)CC1	ZINC000853815583	EF	On-Demand	Mild	KCNQ2	76	40
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CC#N)C2)CC1	ZINC000853815583	EF	On-Demand	Mild	CSF1R	19	41
NS(=O)(=O)c1cc(NCCS(=O)(=O)CC(F)(F)F)cc([N+](=O)[O-])c1	ZINC000853815592	GC	On-Demand	Bother	CYNT	22	40
O=S(=O)(CCNc1ccnc2cc(Br)ccc12)CC(F)(F)F	ZINC000853815648	GG	On-Demand	Anodyne	HRP1_PLAFA	117	38
O=S(=O)(CCNc1ccnc2cc(Br)ccc12)CC(F)(F)F	ZINC000853815648	GG	On-Demand	Anodyne	HNMT	45	37
CON(C)CCNC(=O)NCCCc1ccc(Cl)cc1Cl	ZINC000853815679	EF	On-Demand	Anodyne	MTNR1A	26	41
CON(C)CCNC(=O)NCCCc1ccc(Cl)cc1Cl	ZINC000853815679	EF	On-Demand	Anodyne	ALPL	40	36
CC(C)n1nccc1NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853815697	FI	On-Demand	Anodyne	ROCK2	22	42
C#CCCN(CCOC)C(=O)N[C@H](COC)Cc1ccccc1	ZINC000853815707	DD	On-Demand	Mild	MME	41	41
C#CCCN(CCOC)C(=O)N[C@H](COC)Cc1ccccc1	ZINC000853815707	DD	On-Demand	Mild	PIN1	19	40
C#CCCN(CCOC)C(=O)N[C@@H](COC)Cc1ccccc1	ZINC000853815708	DD	On-Demand	Mild	MME	41	41
C#CCCN(CCOC)C(=O)N[C@@H](COC)Cc1ccccc1	ZINC000853815708	DD	On-Demand	Mild	PIN1	19	40
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCOCc2ccccc2)C1	ZINC000853815712	GE	On-Demand	Anodyne	PREP	41	36
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCOCc2ccccc2)C1	ZINC000853815714	GE	On-Demand	Anodyne	PREP	41	36
O=C(NC1CCN(C2CCCCC2)CC1)N1CCC(N2CCOC2=O)CC1	ZINC000853815728	GE	On-Demand	Anodyne	L3MBTL3	41	35
Cc1nc(C(=O)N2CCC[C@@H]2c2c(C)cccc2C)no1	ZINC000853815737	CF	On-Demand	Anodyne	CPT1A	45	35
Cc1nc(C(=O)N2CCC[C@H]2c2c(C)cccc2C)no1	ZINC000853815741	CF	On-Demand	Anodyne	CPT1A	45	35
COc1ccc2c(NCCS(=O)(=O)CC(F)(F)F)ccnc2c1	ZINC000853815751	EF	On-Demand	Anodyne	HRP1_PLAFA	126	46
COc1ccc2c(NCCS(=O)(=O)CC(F)(F)F)ccnc2c1	ZINC000853815751	EF	On-Demand	Anodyne	HNMT	58	38
COc1ccc2c(NCCS(=O)(=O)CC(F)(F)F)ccnc2c1	ZINC000853815751	EF	On-Demand	Anodyne	BOTA	18	41
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853815804	FE	On-Demand	Anodyne	L3MBTL3	58	36
O=C(NC1CCN(C2CCCCC2)CC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853815807	FE	On-Demand	Anodyne	L3MBTL3	58	36
Cc1nc(NC(=O)NCc2cccc(NC(=O)OC(C)(C)C)c2)oc1C	ZINC000853815823	FH	On-Demand	Anodyne	ROCK2	24	41
O=S(=O)(CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853815840	GF	On-Demand	Anodyne	EGFR	75	38
O=S(=O)(CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853815840	GF	On-Demand	Anodyne	CLK4	51	33
O=S(=O)(CCNc1ncnc2ccc(Br)cc12)CC(F)(F)F	ZINC000853815840	GF	On-Demand	Anodyne	CD38	62	41
O=C(NCC1CCN(C2CCOCC2)CC1)N1CCCCC1	ZINC000853815841	DE	On-Demand	Anodyne	L3MBTL3	42	35
Cc1nc(NC(=O)N2CCC[C@@H](CC#N)C2)sc1-c1ccccc1	ZINC000853815860	EI	On-Demand	Mild	PIK3CG	17	46
Cc1nc(NC(=O)N2CCC[C@H](CC#N)C2)sc1-c1ccccc1	ZINC000853815862	EI	On-Demand	Mild	PIK3CG	17	46
N#CC[C@H]1CCCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853815907	EF	On-Demand	Mild	CACNA1D	61	37
N#CC[C@@H]1CCCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853815909	EF	On-Demand	Mild	CACNA1D	61	37
O=S(=O)(CCNc1ccnc2cc(F)ccc12)CC(F)(F)F	ZINC000853815923	EF	On-Demand	Anodyne	HRP1_PLAFA	121	38
O=S(=O)(CCNc1ccnc2cc(F)ccc12)CC(F)(F)F	ZINC000853815923	EF	On-Demand	Anodyne	HNMT	45	38
CS(=O)(=O)c1ccc2ncnc(NCCS(=O)(=O)CC(F)(F)F)c2c1	ZINC000853815931	GD	On-Demand	Anodyne	CLK4	42	34
CS(=O)(=O)c1ccc2ncnc(NCCS(=O)(=O)CC(F)(F)F)c2c1	ZINC000853815931	GD	On-Demand	Anodyne	CD38	45	42
COCC1(NC(=O)Nc2ccccc2N2CCN(C)CC2)CCCC1	ZINC000853815949	EF	On-Demand	Anodyne	KCNQ2	83	46
COC[C@@H](CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)OC	ZINC000853815963	ED	On-Demand	Bother	CACNA1C	50	43
COC[C@@H](CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)OC	ZINC000853815963	ED	On-Demand	Bother	CACNA1D	79	43
COC[C@@H](CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)OC	ZINC000853815963	ED	On-Demand	Bother	PDS	19	41
O=S(=O)(CCNc1ncccc1OCc1ccccc1)CC(F)(F)F	ZINC000853815979	FG	On-Demand	Anodyne	PPIA	48	48
N#Cc1ccc(NCCS(=O)(=O)CC(F)(F)F)cc1Cl	ZINC000853815982	EF	On-Demand	Mild	TRPV4	41	33
O=S(=O)(CCNc1ccnc(N2CCOCC2)n1)CC(F)(F)F	ZINC000853816017	FC	On-Demand	Anodyne	PIK3CA	15	40
O=S(=O)(CCNc1ncnc2[nH]ccc12)CC(F)(F)F	ZINC000853816019	DD	On-Demand	Anodyne	JAK1	18	42
O=S(=O)(CCNc1ccnc2cc(C(F)(F)F)ccc12)CC(F)(F)F	ZINC000853816046	GH	On-Demand	Anodyne	HRP1_PLAFA	117	38
O=S(=O)(CCNc1ccnc2cc(C(F)(F)F)ccc12)CC(F)(F)F	ZINC000853816046	GH	On-Demand	Anodyne	HNMT	45	37
COC[C@@H](CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)OC	ZINC000853816078	GF	On-Demand	Anodyne	NPY2R	66	38
CON(C)CCNC(=O)NC1CCN(C2CCCCC2)CC1	ZINC000853816141	DD	On-Demand	Anodyne	EPHX2	20	47
O=[N+]([O-])c1ccc2ncnc(NCCS(=O)(=O)CC(F)(F)F)c2c1	ZINC000853816174	FD	On-Demand	Bother	CLK4	44	34
N#Cc1cnc2c(F)cc(F)cc2c1NCCS(=O)(=O)CC(F)(F)F	ZINC000853816192	GF	On-Demand	Mild	MAP3K8	81	36
O=S(=O)(CCNc1cnc2cc(Cl)c(Cl)cc2n1)CC(F)(F)F	ZINC000853816231	GG	On-Demand	Anodyne	GLP1R	46	35
N#Cc1cc(NCCS(=O)(=O)CC(F)(F)F)nc2ccccc12	ZINC000853816245	EE	On-Demand	Mild	METG	44	39
N#Cc1cc(NCCS(=O)(=O)CC(F)(F)F)ccc1C(F)(F)F	ZINC000853816273	FF	On-Demand	Mild	AR	22	40
CO[C@H](CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)[C@H]1CCOC1	ZINC000853816321	FD	On-Demand	Bother	CACNA1D	50	34
CO[C@H](CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)[C@@H]1CCOC1	ZINC000853816323	FD	On-Demand	Bother	CACNA1D	50	34
CON(C)CCNC(=O)NCCc1cc(F)ccc1F	ZINC000853816332	CD	On-Demand	Anodyne	MTNR1A	32	41
Cc1nc(NCCS(=O)(=O)CC(F)(F)F)cc(-c2cccnc2)n1	ZINC000853816408	FE	On-Demand	Anodyne	ROS1	54	38
N#Cc1ccc(NCCS(=O)(=O)CC(F)(F)F)cc1C(F)(F)F	ZINC000853816426	FF	On-Demand	Mild	AR	64	49
C=CCNC(=O)c1ccc(NCCS(=O)(=O)CC(F)(F)F)nc1	ZINC000853816431	FD	On-Demand	Mild	HCAR3	15	51
N#CC[C@H]1CCCN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000853816435	EF	On-Demand	Mild	SLC27A4	42	31
N#CC[C@@H]1CCCN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000853816436	EF	On-Demand	Mild	SLC27A4	42	31
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	HTR1A	19	44
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	DRD2	20	44
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	DRD3	26	41
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	KCNQ2	75	40
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	CTSK	25	40
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	CCR3	24	42
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	CSF1R	27	45
CN1CCN(c2ccccc2NC(=O)NCCc2ccc(C#N)cc2)CC1	ZINC000853816507	FF	On-Demand	Mild	GPBAR1	31	46
C[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)[C@H](C)c1ccccc1	ZINC000853816543	GG	On-Demand	Anodyne	MAPK1	41	39
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(C2CCCCC2)CC1	ZINC000853816544	FH	On-Demand	Reactive	EPHX2	17	41
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)NC1CCN(C2CCCCC2)CC1	ZINC000853816560	GG	On-Demand	Anodyne	C3AR1	19	42
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)NC1CCN(C2CCCCC2)CC1	ZINC000853816560	GG	On-Demand	Anodyne	EPHX2	16	40
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)NC1CCN(C2CCCCC2)CC1	ZINC000853816562	GG	On-Demand	Anodyne	C3AR1	19	42
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)NC1CCN(C2CCCCC2)CC1	ZINC000853816562	GG	On-Demand	Anodyne	EPHX2	16	40
CS(=O)(=O)CC1(CCNC(=O)Nc2cccnc2Cl)CC1	ZINC000853816573	EE	On-Demand	Anodyne	G2YM83_BOTF4	73	37
Cc1nc(NCCS(=O)(=O)CC(F)(F)F)c2c(C)csc2n1	ZINC000853816576	FF	On-Demand	Anodyne	UL26	56	34
Cc1nc(NCCS(=O)(=O)CC(F)(F)F)c2c(C)csc2n1	ZINC000853816576	FF	On-Demand	Anodyne	SCAF_EBVB9	51	30
O=S(=O)(CCNc1nccc(N2CCOCC2)n1)CC(F)(F)F	ZINC000853816580	FC	On-Demand	Anodyne	EPHB4	50	33
O=S(=O)(CCNc1nccc(N2CCOCC2)n1)CC(F)(F)F	ZINC000853816580	FC	On-Demand	Anodyne	STAT6	41	31
O=S(=O)(CCNc1nccc(N2CCOCC2)n1)CC(F)(F)F	ZINC000853816580	FC	On-Demand	Anodyne	SMG1	29	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@H](CC#N)C3)cc2F)C[C@@H](C)O1	ZINC000853816588	FH	On-Demand	Mild	NPY2R	69	36
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@@H](CC#N)C3)cc2F)C[C@@H](C)O1	ZINC000853816590	FH	On-Demand	Mild	NPY2R	69	36
C[C@H]1CN(c2ccc(NC(=O)NCCc3ccc(C#N)cc3)cc2F)C[C@H](C)O1	ZINC000853816594	GH	On-Demand	Mild	NPY2R	46	40
C[C@H]1CN(c2ccc(NC(=O)NCCc3ccc(C#N)cc3)cc2F)C[C@H](C)O1	ZINC000853816594	GH	On-Demand	Mild	CCR3	36	43
C[C@H]1CN(c2ccc(NC(=O)NCCc3ccc(C#N)cc3)cc2F)C[C@@H](C)O1	ZINC000853816596	GH	On-Demand	Mild	NPY2R	46	40
C[C@H]1CN(c2ccc(NC(=O)NCCc3ccc(C#N)cc3)cc2F)C[C@@H](C)O1	ZINC000853816596	GH	On-Demand	Mild	CCR3	36	43
O=S(=O)(CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853816602	EE	On-Demand	Anodyne	EGFR	20	43
O=S(=O)(CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853816602	EE	On-Demand	Anodyne	ERBB2	15	43
O=S(=O)(CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853816602	EE	On-Demand	Anodyne	CLK4	53	39
O=S(=O)(CCNc1ncnc2ccc(F)cc12)CC(F)(F)F	ZINC000853816602	EE	On-Demand	Anodyne	CD38	61	41
COC(=O)N(C)CCNC(=O)NCc1ccc(-c2ccc(OC)cc2)s1	ZINC000853816627	GF	On-Demand	Anodyne	HSD17B2	28	47
Cc1nc(N2CCCC[C@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)ccc1C#N	ZINC000853816666	GG	On-Demand	Mild	NR3C2	49	43
Cc1nc(N2CCCC[C@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)ccc1C#N	ZINC000853816667	GG	On-Demand	Mild	NR3C2	49	43
Cc1nc(N2CCCC[C@@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)ccc1C#N	ZINC000853816668	GG	On-Demand	Mild	NR3C2	49	43
Cc1nc(N2CCCC[C@@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)ccc1C#N	ZINC000853816669	GG	On-Demand	Mild	NR3C2	49	43
N#Cc1ccc(CCNC(=O)N2CCCCC2)cc1	ZINC000853816674	CE	On-Demand	Mild	DPP7	47	41
N#Cc1ccc(CCNC(=O)N2CCCCC2)cc1	ZINC000853816674	CE	On-Demand	Mild	GPBAR1	35	45
N#Cc1ccc(CCNC(=O)N2CCCCC2)cc1	ZINC000853816674	CE	On-Demand	Mild	KCNJ1	18	49
COC[C@@H](CCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1)OC	ZINC000853816692	GF	On-Demand	Anodyne	ROCK1	24	40
COC[C@@H](CCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1)OC	ZINC000853816692	GF	On-Demand	Anodyne	SCD1	41	45
COC[C@@H](CCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1)OC	ZINC000853816692	GF	On-Demand	Anodyne	SCD	40	51
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	CA1	40	42
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	ROCK2	15	44
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	CA12	16	43
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	CA9	17	43
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	NCE103	18	43
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	MTCA1	15	42
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	P96878_MYCTU	22	42
CS(=O)(=O)CC1(CCNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853816721	FH	On-Demand	Anodyne	NAMPT	40	39
COC[C@@H](CCNC(=O)Nc1cccnc1Cl)OC	ZINC000853816743	CD	On-Demand	Anodyne	G2YM83_BOTF4	67	33
CN1CCN(c2ccccc2NC(=O)NCCC2(CS(C)(=O)=O)CC2)CC1	ZINC000853816764	GD	On-Demand	Anodyne	KCNQ2	75	39
N#Cc1ccc(CCNC(=O)C(F)(F)C(=O)N2CCOCC2)cc1	ZINC000853816769	EC	On-Demand	Mild	GPBAR1	33	42
C#CCNC(=O)c1ccc(N2CCC[C@@H]2c2nccc(C(F)(F)F)n2)nc1	ZINC000853816798	GF	On-Demand	Mild	HPGDS	31	40
C#CCNC(=O)c1ccc(N2CCC[C@H]2c2nccc(C(F)(F)F)n2)nc1	ZINC000853816799	GF	On-Demand	Mild	HPGDS	31	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	CA2	17	45
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	CA1	49	39
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	EPHX2	15	44
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	CA12	27	45
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	CA9	28	45
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	NCE103	18	45
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	MTCA1	28	45
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n(C)n1	ZINC000853816830	FD	On-Demand	Anodyne	P96878_MYCTU	36	45
O=S(=O)(CCNc1ccnc2c(F)cc(Cl)cc12)CC(F)(F)F	ZINC000853816843	FG	On-Demand	Anodyne	HRP1_PLAFA	98	35
O=[N+]([O-])c1cccc(Br)c1NCCS(=O)(=O)CC(F)(F)F	ZINC000853816866	GF	On-Demand	Bother	COLA	43	35
O=C(NCc1ccon1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853816874	CD	On-Demand	Anodyne	CPT1A	105	38
O=C(NCc1ccon1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853816875	CD	On-Demand	Anodyne	CPT1A	105	38
C[C@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816900	GE	On-Demand	Anodyne	ADRB1	20	43
C[C@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816900	GE	On-Demand	Anodyne	HRH2	31	42
C[C@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816900	GE	On-Demand	Anodyne	HRH3	58	47
C[C@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816900	GE	On-Demand	Anodyne	EPHX2	34	42
C[C@@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816901	GE	On-Demand	Anodyne	ADRB1	20	43
C[C@@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816901	GE	On-Demand	Anodyne	HRH2	31	42
C[C@@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816901	GE	On-Demand	Anodyne	HRH3	58	47
C[C@@H]1CCCCN1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816901	GE	On-Demand	Anodyne	EPHX2	34	42
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)sc1C	ZINC000853816902	FF	On-Demand	Anodyne	CA2	20	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)sc1C	ZINC000853816902	FF	On-Demand	Anodyne	CA1	49	36
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)sc1C	ZINC000853816902	FF	On-Demand	Anodyne	CA12	26	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)sc1C	ZINC000853816902	FF	On-Demand	Anodyne	CA9	26	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)sc1C	ZINC000853816902	FF	On-Demand	Anodyne	NCE103	15	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)sc1C	ZINC000853816902	FF	On-Demand	Anodyne	MTCA1	24	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)sc1C	ZINC000853816902	FF	On-Demand	Anodyne	P96878_MYCTU	35	45
O=S(=O)(CCNc1ncnc2[nH]c3ccccc3c12)CC(F)(F)F	ZINC000853816926	FF	On-Demand	Anodyne	UTS2R	21	41
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2ccon2)cc1	ZINC000853816928	ED	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2ccon2)cc1	ZINC000853816928	ED	On-Demand	Anodyne	ADRB1	70	53
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2ccon2)cc1	ZINC000853816928	ED	On-Demand	Anodyne	ADRB3	43	41
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2ccon2)cc1	ZINC000853816929	ED	On-Demand	Anodyne	ADRB2	35	53
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2ccon2)cc1	ZINC000853816929	ED	On-Demand	Anodyne	ADRB1	70	53
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2ccon2)cc1	ZINC000853816929	ED	On-Demand	Anodyne	ADRB3	43	41
COCCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853816939	GD	On-Demand	Anodyne	CA1	40	34
COCCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853816939	GD	On-Demand	Anodyne	KDR	17	41
COCCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853816939	GD	On-Demand	Anodyne	CA12	21	45
COCCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853816939	GD	On-Demand	Anodyne	CA9	21	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	CA2	16	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	LPL	51	37
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	CA1	49	36
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	CA12	28	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	CA9	29	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	NCE103	15	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	MTCA1	24	45
Cc1nc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)oc1C	ZINC000853816948	FE	On-Demand	Anodyne	P96878_MYCTU	35	45
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	CA2	21	50
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	ADRB1	42	38
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	CA1	59	50
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	MTNR1A	34	40
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	MTNR1B	20	40
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	CA12	31	50
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	CA9	33	50
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	NCE103	25	47
Cc1ccccc1CCNC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816955	GF	On-Demand	Anodyne	P96878_MYCTU	19	41
O=S(=O)(CCNc1ccnc2c(Cl)cccc12)CC(F)(F)F	ZINC000853816962	FG	On-Demand	Anodyne	HRP1_PLAFA	62	35
O=S(=O)(CCNc1ncc(-c2ccc(Cl)cc2)s1)CC(F)(F)F	ZINC000853816964	GH	On-Demand	Anodyne	FFAR2	17	41
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	CA2	17	46
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	PPIA	26	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	LPL	43	34
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	KIT	27	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	CA1	50	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	RAF1	22	45
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	KDR	34	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	CA12	30	46
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	PDGFRA	53	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	FLT3	49	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	CSF1R	19	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	CA9	29	46
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	RET	19	40
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	NCE103	19	46
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	MTCA1	29	46
Cc1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)no1	ZINC000853816969	EE	On-Demand	Anodyne	P96878_MYCTU	37	46
CC(C)c1ccc2ncnc(NCCS(=O)(=O)CC(F)(F)F)c2c1	ZINC000853816979	FG	On-Demand	Anodyne	CLK4	42	34
CC(C)c1ccc2ncnc(NCCS(=O)(=O)CC(F)(F)F)c2c1	ZINC000853816979	FG	On-Demand	Anodyne	CD38	45	39
CC(C)n1nccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816992	FF	On-Demand	Anodyne	CA2	15	44
CC(C)n1nccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816992	FF	On-Demand	Anodyne	CA1	48	38
CC(C)n1nccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816992	FF	On-Demand	Anodyne	CA12	26	44
CC(C)n1nccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816992	FF	On-Demand	Anodyne	CA9	27	44
CC(C)n1nccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853816992	FF	On-Demand	Anodyne	P96878_MYCTU	20	44
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)C2CCC2)CC1	ZINC000853817015	ED	On-Demand	Anodyne	HTR7	17	40
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)C2CCC2)CC1	ZINC000853817015	ED	On-Demand	Anodyne	KCNQ2	89	47
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)C2CCC2)CC1	ZINC000853817016	ED	On-Demand	Anodyne	HTR7	17	40
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)C2CCC2)CC1	ZINC000853817016	ED	On-Demand	Anodyne	KCNQ2	89	47
CCCn1nccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817027	FE	On-Demand	Anodyne	CA12	19	47
CCCn1nccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817027	FE	On-Demand	Anodyne	CA9	20	47
N#CC[C@@H]1CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853817029	CF	On-Demand	Mild	G2YM83_BOTF4	58	34
N#CC[C@H]1CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853817030	CF	On-Demand	Mild	G2YM83_BOTF4	58	34
O=S(=O)(CCNc1ncnc2c1ncn2C1CC1)CC(F)(F)F	ZINC000853817037	ED	On-Demand	Anodyne	ADORA1	44	46
O=S(=O)(CCNc1ncnc2c1ncn2C1CC1)CC(F)(F)F	ZINC000853817037	ED	On-Demand	Anodyne	ADORA3	49	35
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	CA2	24	60
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	LPL	49	35
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	KIT	24	41
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	CA1	61	60
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	KDR	39	41
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	EPHX2	20	51
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	CA12	42	60
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	TEK	19	41
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	CA9	42	60
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	NCE103	27	53
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	MTCA1	42	51
Cc1cc(C)cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1	ZINC000853817045	FG	On-Demand	Anodyne	P96878_MYCTU	51	53
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853817072	FD	On-Demand	Anodyne	CA2	16	50
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853817072	FD	On-Demand	Anodyne	PDGFRB	21	40
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853817072	FD	On-Demand	Anodyne	CA1	49	36
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853817072	FD	On-Demand	Anodyne	CA12	28	50
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853817072	FD	On-Demand	Anodyne	CA9	28	50
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853817072	FD	On-Demand	Anodyne	MTCA1	25	50
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)cn1	ZINC000853817072	FD	On-Demand	Anodyne	P96878_MYCTU	37	50
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	CA2	16	48
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	CA1	47	37
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	EPHX2	21	45
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	CA12	28	48
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	CA9	28	48
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	NCE103	18	48
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	MTCA1	32	48
CCn1cc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)ccc1=O	ZINC000853817084	GD	On-Demand	Anodyne	P96878_MYCTU	37	48
Cc1csc2c(NCCS(=O)(=O)CC(F)(F)F)ncnc12	ZINC000853817089	EE	On-Demand	Anodyne	LPAR2	18	44
O=C(NCc1ccon1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853817094	DD	On-Demand	Anodyne	L3MBTL3	75	41
O=C(NCc1ccon1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853817095	DD	On-Demand	Anodyne	L3MBTL3	75	41
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817096	FE	On-Demand	Anodyne	CA2	16	45
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817096	FE	On-Demand	Anodyne	CA1	47	37
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817096	FE	On-Demand	Anodyne	CA12	29	45
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817096	FE	On-Demand	Anodyne	CA9	29	45
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817096	FE	On-Demand	Anodyne	NCE103	18	45
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817096	FE	On-Demand	Anodyne	MTCA1	28	45
Cc1n[nH]c(C)c1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817096	FE	On-Demand	Anodyne	P96878_MYCTU	40	45
O=S(=O)(CCNc1ccnc2cc(F)c(Cl)cc12)CC(F)(F)F	ZINC000853817119	FG	On-Demand	Anodyne	HRP1_PLAFA	124	40
O=S(=O)(CCNc1cnc(-c2ccccc2)cn1)CC(F)(F)F	ZINC000853817122	EF	On-Demand	Anodyne	TPH1	25	41
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	CA2	19	46
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	CA1	57	42
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	P2RY1	90	50
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	RAF1	16	41
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	KDR	32	40
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	CA12	34	46
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	PDGFRA	45	40
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	CA9	33	46
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	NCE103	20	44
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	MTCA1	37	46
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	P96878_MYCTU	47	46
COc1ncccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817156	FE	On-Demand	Anodyne	NAMPT	24	40
O=C(NCc1ccon1)N(CCN1CCOCC1)CC1CC1	ZINC000853817161	DC	On-Demand	Anodyne	CASR	55	39
CC(=O)c1ccc(C(F)(F)F)nc1NCCS(=O)(=O)CC(F)(F)F	ZINC000853817189	GF	On-Demand	Anodyne	TRPV1	73	33
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCCS(=O)(=O)CC(F)(F)F	ZINC000853817192	FD	On-Demand	Bother	COLA	49	36
O=S(=O)(CCNc1nc(C(F)F)nc2ccc(F)cc12)CC(F)(F)F	ZINC000853817193	GG	On-Demand	Anodyne	PIK3CD	15	44
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC12CCC2	ZINC000853817212	FF	On-Demand	Bother	CACNA1C	55	38
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC12CCC2	ZINC000853817212	FF	On-Demand	Bother	CACNA1D	88	35
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC12CCC2	ZINC000853817213	FF	On-Demand	Bother	CACNA1C	55	38
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC12CCC2	ZINC000853817213	FF	On-Demand	Bother	CACNA1D	88	35
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(OC)nc3)C2)cc1	ZINC000853817219	EE	On-Demand	Clean	EPHX2	46	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(OC)nc3)C2)cc1	ZINC000853817219	EE	On-Demand	Clean	MCHR1	17	46
COCCOc1ccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cn1	ZINC000853817221	GF	On-Demand	Clean	EPHX2	44	38
COCCOc1ccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)cn1	ZINC000853817221	GF	On-Demand	Clean	MCHR1	18	45
COCCOc1ccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1	ZINC000853817222	GF	On-Demand	Clean	EPHX2	44	38
COCCOc1ccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)cn1	ZINC000853817222	GF	On-Demand	Clean	MCHR1	18	45
O=S(=O)(CCNc1nc2ccccc2s1)CC(F)(F)F	ZINC000853817231	DF	On-Demand	Anodyne	CSNK1D	25	41
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(C(N)=O)c2)CC12CCC2	ZINC000853817232	FE	On-Demand	Anodyne	S1PR2	26	44
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(C(N)=O)c2)CC12CCC2	ZINC000853817233	FE	On-Demand	Anodyne	S1PR2	26	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3F)C2)cc1	ZINC000853817235	EG	On-Demand	Clean	CCR3	38	48
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3F)C2)cc1	ZINC000853817235	EG	On-Demand	Clean	SOAT1	22	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3F)C2)cc1	ZINC000853817235	EG	On-Demand	Clean	EPHX2	40	37
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3F)C2)cc1	ZINC000853817235	EG	On-Demand	Clean	MCHR1	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCCO4)C2)cc1	ZINC000853817242	FF	On-Demand	Clean	EDNRB	56	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCCO4)C2)cc1	ZINC000853817242	FF	On-Demand	Clean	EDNRA	45	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCCO4)C2)cc1	ZINC000853817242	FF	On-Demand	Clean	MTNR1A	16	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCCO4)C2)cc1	ZINC000853817242	FF	On-Demand	Clean	MTNR1B	15	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCCO4)C2)cc1	ZINC000853817242	FF	On-Demand	Clean	EPHX2	45	38
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCCO4)C2)cc1	ZINC000853817242	FF	On-Demand	Clean	MCHR1	25	49
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(C)c2)CC12CCC2	ZINC000853817244	EG	On-Demand	Anodyne	KCNK3	53	34
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(C)c2)CC12CCC2	ZINC000853817244	EG	On-Demand	Anodyne	KCNK9	48	34
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(C)c2)CC12CCC2	ZINC000853817245	EG	On-Demand	Anodyne	KCNK3	53	34
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(C)c2)CC12CCC2	ZINC000853817245	EG	On-Demand	Anodyne	KCNK9	48	34
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(N4CCNC4=O)c3)C2)cc1	ZINC000853817246	GF	On-Demand	Clean	CCR3	33	41
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817251	FF	On-Demand	Anodyne	MTNR1B	41	44
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817251	FF	On-Demand	Anodyne	S1PR2	27	40
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817251	FF	On-Demand	Anodyne	TAAR1	33	41
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817251	FF	On-Demand	Anodyne	LIMK2	15	41
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817252	FF	On-Demand	Anodyne	MTNR1B	41	44
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817252	FF	On-Demand	Anodyne	S1PR2	27	40
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817252	FF	On-Demand	Anodyne	TAAR1	33	41
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(OC)c2)CC12CCC2	ZINC000853817252	FF	On-Demand	Anodyne	LIMK2	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(-c4ncon4)cc3)C2)cc1	ZINC000853817275	GG	On-Demand	Clean	PIK3CA	54	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(-c4ncon4)cc3)C2)cc1	ZINC000853817275	GG	On-Demand	Clean	MTOR	139	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(-c4ncon4)cc3)C2)cc1	ZINC000853817275	GG	On-Demand	Clean	EPHX2	44	38
CC(=O)c1ccc(NCCS(=O)(=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853817285	FE	On-Demand	Bother	TAAR1	16	45
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](Cn3ccnn3)C2)CC1	ZINC000853817296	FD	On-Demand	Anodyne	KCNQ2	67	36
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](Cn3ccnn3)C2)CC1	ZINC000853817297	FD	On-Demand	Anodyne	KCNQ2	67	36
COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CC3)C2)cc1	ZINC000853817302	DC	On-Demand	Clean	MTNR1A	20	53
COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CC3)C2)cc1	ZINC000853817302	DC	On-Demand	Clean	MTNR1B	21	53
COc1ccc(N2CC[C@H](NC(=O)C(=O)NC3CC3)C2)cc1	ZINC000853817302	DC	On-Demand	Clean	MCHR1	17	43
O=[N+]([O-])c1ccc2c(NCCS(=O)(=O)CC(F)(F)F)ccnc2c1	ZINC000853817323	FF	On-Demand	Bother	HRP1_PLAFA	110	44
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	CA2	17	45
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	CA1	57	39
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	GRM5	20	41
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	CA12	31	45
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	PDGFRA	40	35
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	CA9	32	45
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	NCE103	22	45
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	MTCA1	28	45
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)n1	ZINC000853817333	EE	On-Demand	Anodyne	P96878_MYCTU	39	45
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	CA2	21	46
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	LPL	51	34
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	CA1	64	44
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	P2RY1	79	40
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	CA12	38	46
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	CA9	38	46
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	NCE103	27	46
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	MTCA1	35	46
Cc1cccc(NC(=O)Nc2ccc(OCCS(C)(=O)=O)cc2)c1C	ZINC000853817348	FG	On-Demand	Anodyne	P96878_MYCTU	46	46
O=C(NCc1ccon1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853817351	CE	On-Demand	Anodyne	EPHX2	29	51
NC(=O)c1cccc([N+](=O)[O-])c1NCCS(=O)(=O)CC(F)(F)F	ZINC000853817367	FD	On-Demand	Bother	COLA	72	35
CC(=O)c1cc(NCCS(=O)(=O)CC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000853817376	FE	On-Demand	Bother	COLA	42	34
CS(=O)(=O)c1ccc(NCCS(=O)(=O)CC(F)(F)F)c(F)c1	ZINC000853817385	FD	On-Demand	Anodyne	TRPV1	81	33
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C#N)cc3)C2)cc1	ZINC000853817412	EF	On-Demand	Mild	CCR3	16	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C#N)cc3)C2)cc1	ZINC000853817412	EF	On-Demand	Mild	EPHX2	50	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C#N)cc3)C2)cc1	ZINC000853817412	EF	On-Demand	Mild	MCHR1	15	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccn3)C2)cc1	ZINC000853817428	DE	On-Demand	Clean	PDE3B	40	37
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccn3)C2)cc1	ZINC000853817428	DE	On-Demand	Clean	EPHX2	26	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3F)C2)cc1	ZINC000853817440	EG	On-Demand	Clean	CCR3	29	47
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3F)C2)cc1	ZINC000853817440	EG	On-Demand	Clean	EPHX2	41	38
COc1ccc(N2CC[C@H](NC(=O)c3cc(C(C)=O)c[nH]3)C2)cc1	ZINC000853817444	EE	On-Demand	Clean	MTNR1A	17	46
COc1ccc(N2CC[C@H](NC(=O)c3cc(C(C)=O)c[nH]3)C2)cc1	ZINC000853817444	EE	On-Demand	Clean	MTNR1B	15	46
COCc1cc([N+](=O)[O-])ccc1N1CCc2nc(-c3ccccc3)sc2C1	ZINC000853817446	GI	On-Demand	Bother	F2RL3	48	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000853817448	EG	On-Demand	Clean	CCR3	16	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000853817448	EG	On-Demand	Clean	PIK3CA	27	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000853817448	EG	On-Demand	Clean	MTNR1B	17	47
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000853817448	EG	On-Demand	Clean	MTOR	62	37
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000853817448	EG	On-Demand	Clean	EPHX2	56	57
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3)C2)cc1	ZINC000853817448	EG	On-Demand	Clean	MCHR1	22	52
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccnc2Cl)CC12CCC2	ZINC000853817454	FG	On-Demand	Anodyne	G2YM83_BOTF4	67	34
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccnc2Cl)CC12CCC2	ZINC000853817455	FG	On-Demand	Anodyne	G2YM83_BOTF4	67	34
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)cc(C)c3)C2)cc1	ZINC000853817462	EH	On-Demand	Clean	MTNR1A	15	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)cc(C)c3)C2)cc1	ZINC000853817462	EH	On-Demand	Clean	MTNR1B	15	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)cc(C)c3)C2)cc1	ZINC000853817462	EH	On-Demand	Clean	EPHX2	48	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)cc(C)c3)C2)cc1	ZINC000853817462	EH	On-Demand	Clean	MCHR1	19	46
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3)C2)cc1	ZINC000853817464	DE	On-Demand	Clean	PIK3CA	17	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3)C2)cc1	ZINC000853817464	DE	On-Demand	Clean	CHRNA7	42	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3)C2)cc1	ZINC000853817464	DE	On-Demand	Clean	C3AR1	27	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3)C2)cc1	ZINC000853817464	DE	On-Demand	Clean	MTOR	39	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3)C2)cc1	ZINC000853817464	DE	On-Demand	Clean	EPHX2	41	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3)C2)cc1	ZINC000853817464	DE	On-Demand	Clean	MCHR1	16	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)nc3)C2)cc1	ZINC000853817466	GD	On-Demand	Clean	EPHX2	44	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)nc3)C2)cc1	ZINC000853817469	EG	On-Demand	Clean	EPHX2	47	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)nc3)C2)cc1	ZINC000853817469	EG	On-Demand	Clean	MCHR1	20	46
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)on3)C2)cc1	ZINC000853817475	DE	On-Demand	Clean	EPHX2	24	45
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)on3)C2)cc1	ZINC000853817475	DE	On-Demand	Clean	PDK1	48	34
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)on3)C2)cc1	ZINC000853817475	DE	On-Demand	Clean	MCHR1	15	40
O=[N+]([O-])c1ccccc1NCCS(=O)(=O)CC(F)(F)F	ZINC000853817479	DD	On-Demand	Bother	COLA	78	37
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000853817480	FG	On-Demand	Clean	CACNA1D	41	38
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000853817480	FG	On-Demand	Clean	CCR3	22	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000853817480	FG	On-Demand	Clean	MTNR1A	16	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000853817480	FG	On-Demand	Clean	MTNR1B	16	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000853817480	FG	On-Demand	Clean	MCHR1	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000853817480	FG	On-Demand	Clean	TAAR1	26	43
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000853817480	FG	On-Demand	Clean	AKR1C2	18	46
Cc1nc(NCCS(=O)(=O)CC(F)(F)F)c2cnn(-c3ccccc3)c2n1	ZINC000853817488	GF	On-Demand	Anodyne	NR3C1	22	40
COCCN(CCF)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817491	EG	On-Demand	Anodyne	ACACA	22	41
COCCN(CCF)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817492	EG	On-Demand	Anodyne	ACACA	22	41
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(Cl)cn2)CC12CCC2	ZINC000853817493	FG	On-Demand	Anodyne	F10	47	31
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(Cl)cn2)CC12CCC2	ZINC000853817494	FG	On-Demand	Anodyne	F10	47	31
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	DRD4	41	32
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	DRD3	16	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	KCNQ2	50	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	CCR3	20	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	MTNR1A	15	47
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	MTNR1B	15	47
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	EPHX2	35	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	MCHR1	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3Cl)C2)cc1	ZINC000853817497	EH	On-Demand	Clean	EPHB3	40	37
CCn1c(=O)c(NCCS(=O)(=O)CC(F)(F)F)nc2ccccc21	ZINC000853817516	FD	On-Demand	Anodyne	PYGM	17	40
COC(=O)c1ccc(C(F)(F)F)nc1NCCS(=O)(=O)CC(F)(F)F	ZINC000853817520	GE	On-Demand	Anodyne	TRPV1	63	34
O=C(NCc1ccon1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853817531	DD	On-Demand	Anodyne	EPHX2	23	41
COc1ccc(-c2ccnc(NCCS(=O)(=O)CC(F)(F)F)n2)cc1	ZINC000853817533	GF	On-Demand	Anodyne	CLK1	19	52
COc1ccc(-c2ccnc(NCCS(=O)(=O)CC(F)(F)F)n2)cc1	ZINC000853817533	GF	On-Demand	Anodyne	CLK4	29	52
COc1ccc(-c2ccnc(NCCS(=O)(=O)CC(F)(F)F)n2)cc1	ZINC000853817533	GF	On-Demand	Anodyne	DYRK1B	16	54
COc1ccc(-c2ccnc(NCCS(=O)(=O)CC(F)(F)F)n2)cc1	ZINC000853817533	GF	On-Demand	Anodyne	SMG1	60	33
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccon1	ZINC000853817544	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccon1	ZINC000853817544	ED	On-Demand	Anodyne	CCR3	21	43
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1ccon1	ZINC000853817544	ED	On-Demand	Anodyne	MCHR1	17	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccon1	ZINC000853817545	ED	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccon1	ZINC000853817545	ED	On-Demand	Anodyne	CCR3	21	43
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1ccon1	ZINC000853817545	ED	On-Demand	Anodyne	MCHR1	17	40
N#Cc1cnc2c(Cl)cccc2c1NCCS(=O)(=O)CC(F)(F)F	ZINC000853817556	GG	On-Demand	Mild	MAP3K8	107	38
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	CA2	22	65
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	LPL	44	34
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	LTA4H	22	40
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	CA1	66	65
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	P2RY1	83	52
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	CA12	36	65
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	CA9	35	65
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	NCE103	28	59
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	MTCA1	30	45
CC(C)c1ccccc1NC(=O)Nc1ccc(OCCS(C)(=O)=O)cc1	ZINC000853817562	GH	On-Demand	Anodyne	P96878_MYCTU	40	45
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2nccs2)CC12CCC2	ZINC000853817598	EE	On-Demand	Anodyne	MAP1	97	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2nccs2)CC12CCC2	ZINC000853817599	EE	On-Demand	Anodyne	MAP1	97	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cc(OC)cc(OC)c2)CC12CCC2	ZINC000853817603	GF	On-Demand	Anodyne	S1PR2	30	43
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cc(OC)cc(OC)c2)CC12CCC2	ZINC000853817604	GF	On-Demand	Anodyne	S1PR2	30	43
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(=O)N(C)C)c3)C2)cc1	ZINC000853817610	GF	On-Demand	Clean	DRD4	43	35
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(=O)N(C)C)c3)C2)cc1	ZINC000853817610	GF	On-Demand	Clean	CCKAR	17	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(=O)N(C)C)c3)C2)cc1	ZINC000853817610	GF	On-Demand	Clean	MTNR1A	19	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(=O)N(C)C)c3)C2)cc1	ZINC000853817610	GF	On-Demand	Clean	MTNR1B	20	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(=O)N(C)C)c3)C2)cc1	ZINC000853817610	GF	On-Demand	Clean	EPHX2	42	45
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(=O)N(C)C)c3)C2)cc1	ZINC000853817610	GF	On-Demand	Clean	MCHR1	23	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	DRD4	42	37
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	F10	17	43
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	NPY1R	15	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	CCR3	29	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	MTNR1A	21	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	MTNR1B	23	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	EPHX2	56	56
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	PDGFRA	17	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	MCHR1	43	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(Cl)c3)C2)cc1	ZINC000853817612	EH	On-Demand	Clean	AKR1C2	25	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(F)(F)F)C2)cc1	ZINC000853817615	GI	On-Demand	Clean	F10	15	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(F)(F)F)C2)cc1	ZINC000853817615	GI	On-Demand	Clean	TRPV1	18	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(F)(F)F)C2)cc1	ZINC000853817615	GI	On-Demand	Clean	P2RY1	50	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(F)(F)F)C2)cc1	ZINC000853817615	GI	On-Demand	Clean	CCR3	22	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(F)(F)F)C2)cc1	ZINC000853817615	GI	On-Demand	Clean	EPHX2	55	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(F)(F)F)C2)cc1	ZINC000853817615	GI	On-Demand	Clean	RBP4	75	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(F)(F)F)C2)cc1	ZINC000853817615	GI	On-Demand	Clean	MCHR1	17	44
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3Cl)C2)cc1	ZINC000853817617	EG	On-Demand	Clean	G2YM83_BOTF4	52	34
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817622	GD	On-Demand	Anodyne	CA2	24	46
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817622	GD	On-Demand	Anodyne	CA1	18	40
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817622	GD	On-Demand	Anodyne	CA4	29	45
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817622	GD	On-Demand	Anodyne	S1PR2	26	41
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817622	GD	On-Demand	Anodyne	CA9	17	41
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817623	GD	On-Demand	Anodyne	CA2	24	46
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817623	GD	On-Demand	Anodyne	CA1	18	40
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817623	GD	On-Demand	Anodyne	CA4	29	45
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817623	GD	On-Demand	Anodyne	S1PR2	26	41
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(S(N)(=O)=O)c2)CC12CCC2	ZINC000853817623	GD	On-Demand	Anodyne	CA9	17	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)nc3)C2)cc1	ZINC000853817629	EF	On-Demand	Clean	CCR3	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)nc3)C2)cc1	ZINC000853817629	EF	On-Demand	Clean	MTOR	46	36
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)nc3)C2)cc1	ZINC000853817629	EF	On-Demand	Clean	EPHX2	48	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)nc3)C2)cc1	ZINC000853817629	EF	On-Demand	Clean	MCHR1	22	47
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817631	FG	On-Demand	Mild	ACACA	23	41
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817632	FG	On-Demand	Mild	ACACA	23	41
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccccc2)CC12CCC2	ZINC000853817633	DF	On-Demand	Anodyne	EPHX2	34	41
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccccc2)CC12CCC2	ZINC000853817634	DF	On-Demand	Anodyne	EPHX2	34	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	DRD4	45	37
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	DRD3	15	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	CCKAR	26	43
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	CCR3	49	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	KDR	20	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	MTNR1A	45	58
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	MTNR1B	46	58
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	CCKBR	26	43
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	EPHX2	63	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	PDGFRA	20	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	MCHR1	34	46
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	TAAR1	39	43
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	AKR1C3	18	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(OC)c3)C2)cc1	ZINC000853817645	EG	On-Demand	Clean	LIMK2	17	42
COc1ccc(N2CC[C@H](NC(=O)Nc3nccs3)C2)cc1	ZINC000853817657	DF	On-Demand	Clean	MAP1	111	39
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3C)C2)cc1	ZINC000853817671	EH	On-Demand	Clean	CCR3	19	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3C)C2)cc1	ZINC000853817671	EH	On-Demand	Clean	MTNR1A	15	49
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3C)C2)cc1	ZINC000853817671	EH	On-Demand	Clean	MTNR1B	15	49
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3C)C2)cc1	ZINC000853817671	EH	On-Demand	Clean	EPHX2	30	44
COc1ccc(N2CC[C@H](NC(=O)C(C)(F)F)C2)cc1	ZINC000853817697	CE	On-Demand	Clean	MCHR1	15	40
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(N3CCCC3)nc2)CC12CCC2	ZINC000853817703	GF	On-Demand	Anodyne	DGAT1	40	44
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(N3CCCC3)nc2)CC12CCC2	ZINC000853817704	GF	On-Demand	Anodyne	DGAT1	40	44
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(N4CCOC4=O)c3)C2)cc1	ZINC000853817707	GG	On-Demand	Clean	EPHX2	35	43
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(C)nc2)CC12CCC2	ZINC000853817712	EF	On-Demand	Anodyne	EPHX2	26	40
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(C)nc2)CC12CCC2	ZINC000853817713	EF	On-Demand	Anodyne	EPHX2	26	40
COc1ccc(N2CC[C@H](NC(=O)N3CCCCC3)C2)cc1	ZINC000853817733	DE	On-Demand	Clean	MMP13	26	40
COc1ccc(N2CC[C@H](NC(=O)N3CCCCC3)C2)cc1	ZINC000853817733	DE	On-Demand	Clean	MTNR1A	19	49
COc1ccc(N2CC[C@H](NC(=O)N3CCCCC3)C2)cc1	ZINC000853817733	DE	On-Demand	Clean	MTNR1B	21	49
COc1ccc(N2CC[C@H](NC(=O)N3CCCCC3)C2)cc1	ZINC000853817733	DE	On-Demand	Clean	MMP3	27	40
COc1ccc(N2CC[C@H](NC(=O)N3CCCCC3)C2)cc1	ZINC000853817733	DE	On-Demand	Clean	EPHX2	20	42
COc1ccc(N2CC[C@H](NC(=O)N3CCCCC3)C2)cc1	ZINC000853817733	DE	On-Demand	Clean	MMP1	26	40
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(C#N)c2)CC12CCC2	ZINC000853817738	EF	On-Demand	Mild	MCHR1	29	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(C#N)c2)CC12CCC2	ZINC000853817739	EF	On-Demand	Mild	MCHR1	29	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(CN(C)C)c2)CC12CCC2	ZINC000853817742	GG	On-Demand	Anodyne	P2RY14	45	35
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(CN(C)C)c2)CC12CCC2	ZINC000853817743	GG	On-Demand	Anodyne	P2RY14	45	35
COc1ccc(N2CC[C@H](NC(=O)c3cc(C#N)cn3C)C2)cc1	ZINC000853817744	DD	On-Demand	Mild	DRD4	42	35
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3OC)C2)cc1	ZINC000853817781	EE	On-Demand	Clean	P2RY1	45	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(CN(C)C)c3)C2)cc1	ZINC000853817784	FG	On-Demand	Clean	NPY1R	33	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(CN(C)C)c3)C2)cc1	ZINC000853817784	FG	On-Demand	Clean	CCR3	44	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(CN(C)C)c3)C2)cc1	ZINC000853817784	FG	On-Demand	Clean	MTNR1A	21	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(CN(C)C)c3)C2)cc1	ZINC000853817784	FG	On-Demand	Clean	MTNR1B	22	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(CN(C)C)c3)C2)cc1	ZINC000853817784	FG	On-Demand	Clean	EPHX2	44	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(CN(C)C)c3)C2)cc1	ZINC000853817784	FG	On-Demand	Clean	MCHR1	29	49
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3N3CCCC3)C2)cc1	ZINC000853817785	GG	On-Demand	Clean	KCNQ2	40	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccnc3N3CCCC3)C2)cc1	ZINC000853817785	GG	On-Demand	Clean	P2RY1	24	40
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(F)c2)CC12CCC2	ZINC000853817787	EG	On-Demand	Anodyne	CACNA1H	56	36
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(F)c2)CC12CCC2	ZINC000853817788	EG	On-Demand	Anodyne	CACNA1H	56	36
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)C(=O)NC4=O)C2)cc1	ZINC000853817794	GD	On-Demand	Clean	EPHX2	44	37
CCn1cc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O	ZINC000853817806	FE	On-Demand	Clean	EPHX2	48	43
CCn1cc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O	ZINC000853817806	FE	On-Demand	Clean	MCHR1	19	46
CCn1cc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O	ZINC000853817807	FE	On-Demand	Clean	EPHX2	48	43
CCn1cc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)ccc1=O	ZINC000853817807	FE	On-Demand	Clean	MCHR1	19	46
NS(=O)(=O)c1ccc(NCCS(=O)(=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853817812	GC	On-Demand	Bother	CA2	24	47
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCCC4)nc3)C2)cc1	ZINC000853817818	GG	On-Demand	Clean	GALR2	47	34
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCCC4)nc3)C2)cc1	ZINC000853817818	GG	On-Demand	Clean	EPHX2	44	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCCC4)nc3)C2)cc1	ZINC000853817818	GG	On-Demand	Clean	MCHR1	21	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCCC4)nc3)C2)cc1	ZINC000853817818	GG	On-Demand	Clean	DGAT1	42	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(C)=O)c3)C2)cc1	ZINC000853817820	FG	On-Demand	Clean	DRD4	43	35
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(C)=O)c3)C2)cc1	ZINC000853817820	FG	On-Demand	Clean	CCR3	47	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(C)=O)c3)C2)cc1	ZINC000853817820	FG	On-Demand	Clean	MTNR1A	26	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(C)=O)c3)C2)cc1	ZINC000853817820	FG	On-Demand	Clean	MTNR1B	28	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(C)=O)c3)C2)cc1	ZINC000853817820	FG	On-Demand	Clean	EPHX2	53	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(C)=O)c3)C2)cc1	ZINC000853817820	FG	On-Demand	Clean	MCHR1	28	44
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C(C)=O)c3)C2)cc1	ZINC000853817820	FG	On-Demand	Clean	AKR1C3	20	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C(C)=O)cc3)C2)cc1	ZINC000853817822	FG	On-Demand	Clean	CCR3	17	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C(C)=O)cc3)C2)cc1	ZINC000853817822	FG	On-Demand	Clean	PRNP	40	34
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C(C)=O)cc3)C2)cc1	ZINC000853817822	FG	On-Demand	Clean	MTNR1A	15	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C(C)=O)cc3)C2)cc1	ZINC000853817822	FG	On-Demand	Clean	MTNR1B	17	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C(C)=O)cc3)C2)cc1	ZINC000853817822	FG	On-Demand	Clean	MTOR	53	36
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C(C)=O)cc3)C2)cc1	ZINC000853817822	FG	On-Demand	Clean	EPHX2	56	55
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C(C)=O)cc3)C2)cc1	ZINC000853817822	FG	On-Demand	Clean	MCHR1	16	50
O=C(NC1CC1)c1ccc(NCCS(=O)(=O)CC(F)(F)F)nc1	ZINC000853817848	FD	On-Demand	Anodyne	MAPK11	17	41
O=C(NC1CC1)c1ccc(NCCS(=O)(=O)CC(F)(F)F)nc1	ZINC000853817848	FD	On-Demand	Anodyne	MAPK14	35	42
O=C(NC1CC1)c1ccc(NCCS(=O)(=O)CC(F)(F)F)nc1	ZINC000853817848	FD	On-Demand	Anodyne	SSTR5	23	40
O=C(NC1CC1)c1ccc(NCCS(=O)(=O)CC(F)(F)F)nc1	ZINC000853817848	FD	On-Demand	Anodyne	HPGDS	41	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3OC)C2)cc1	ZINC000853817851	EG	On-Demand	Clean	DRD2	16	52
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3OC)C2)cc1	ZINC000853817851	EG	On-Demand	Clean	KCNQ2	29	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3OC)C2)cc1	ZINC000853817851	EG	On-Demand	Clean	CCR3	28	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3OC)C2)cc1	ZINC000853817851	EG	On-Demand	Clean	MTNR1A	15	48
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3OC)C2)cc1	ZINC000853817851	EG	On-Demand	Clean	MTNR1B	15	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)cc(C)n3)C2)cc1	ZINC000853817860	EG	On-Demand	Clean	EPHX2	20	43
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(C#N)cc2)CC12CCC2	ZINC000853817862	EF	On-Demand	Mild	S1PR2	22	43
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(C#N)cc2)CC12CCC2	ZINC000853817863	EF	On-Demand	Mild	S1PR2	22	43
C[C@@H](NC(=O)N1CCC2=C(CCC(=O)N2)C1)c1ccc(-c2cccnc2)cc1	ZINC000853817875	GG	On-Demand	Anodyne	CYP11B2	20	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	CA2	30	46
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	CA1	30	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MMP13	28	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	CA4	16	44
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MTNR1A	16	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MTNR1B	18	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MMP3	28	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MMP9	23	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	EPHX2	50	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	CA12	31	46
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	CA9	29	46
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MMP1	27	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MCHR1	16	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	MTCA1	33	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(S(N)(=O)=O)c3)C2)cc1	ZINC000853817881	GD	On-Demand	Clean	P96878_MYCTU	37	41
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccc(F)c(Cl)c1	ZINC000853817913	FD	On-Demand	Reactive	MCHR1	19	44
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccc(-c2ncon2)cc1	ZINC000853817941	FC	On-Demand	Reactive	MTOR	75	36
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncnc4[nH]ccc34)CO2)C1	ZINC000853817943	EE	On-Demand	Anodyne	JAK1	24	41
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncnc4[nH]ccc34)CO2)C1	ZINC000853817944	EE	On-Demand	Anodyne	JAK1	24	41
C=CCCC1(CNC(=O)c2nccn2C)CCCC1	ZINC000853817961	CF	On-Demand	Mild	HCN1	49	31
C=CCCC1(CNC(=O)c2nccn2C)CCCC1	ZINC000853817961	CF	On-Demand	Mild	HCN4	47	31
O=C(Nc1nc2c(s1)CCC2)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853817968	GH	On-Demand	Anodyne	SLC27A1	30	40
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3nc4ccccc4o3)CO2)C1	ZINC000853817990	EG	On-Demand	Anodyne	SSTR5	32	40
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3nc4ccccc4o3)CO2)C1	ZINC000853817991	EG	On-Demand	Anodyne	SSTR5	32	40
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ccc([N+](=O)[O-])cc3F)CO2)C1	ZINC000853817992	FF	On-Demand	Bother	GPR119	16	40
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ccc([N+](=O)[O-])cc3F)CO2)C1	ZINC000853817993	FF	On-Demand	Bother	GPR119	16	40
CON(C)CCNC(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817998	EF	On-Demand	Anodyne	KCNA5	19	45
CON(C)CCNC(=O)N[C@@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817998	EF	On-Demand	Anodyne	UTS2	47	32
CON(C)CCNC(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817999	EF	On-Demand	Anodyne	KCNA5	19	45
CON(C)CCNC(=O)N[C@H](C)c1ccc(-c2cccnc2)cc1	ZINC000853817999	EF	On-Demand	Anodyne	UTS2	47	32
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	CA2	70	43
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	CA1	64	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	CA7	38	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	CA4	59	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	CA14	32	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	S1PR2	25	45
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	CA12	46	43
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	CA9	51	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	MTCA1	46	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818014	GD	On-Demand	Anodyne	P96878_MYCTU	57	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	CA2	70	43
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	CA1	64	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	CA7	38	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	CA4	59	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	CA14	32	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	S1PR2	25	45
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	CA12	46	43
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	CA9	51	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	MTCA1	46	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CC12CCC2	ZINC000853818015	GD	On-Demand	Anodyne	P96878_MYCTU	57	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C#N)c3)C2)cc1	ZINC000853818016	EF	On-Demand	Mild	CCR3	43	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C#N)c3)C2)cc1	ZINC000853818016	EF	On-Demand	Mild	MTNR1A	17	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C#N)c3)C2)cc1	ZINC000853818016	EF	On-Demand	Mild	MTNR1B	18	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C#N)c3)C2)cc1	ZINC000853818016	EF	On-Demand	Mild	EPHX2	43	37
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C#N)c3)C2)cc1	ZINC000853818016	EF	On-Demand	Mild	MCHR1	48	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)cc(OC)c3)C2)cc1	ZINC000853818026	FG	On-Demand	Clean	CCR3	26	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)cc(OC)c3)C2)cc1	ZINC000853818026	FG	On-Demand	Clean	MTNR1A	21	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)cc(OC)c3)C2)cc1	ZINC000853818026	FG	On-Demand	Clean	MTNR1B	25	50
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)cc(OC)c3)C2)cc1	ZINC000853818026	FG	On-Demand	Clean	EPHX2	49	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)cc(OC)c3)C2)cc1	ZINC000853818026	FG	On-Demand	Clean	CXCR3	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(OC)cc(OC)c3)C2)cc1	ZINC000853818026	FG	On-Demand	Clean	MCHR1	20	51
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccccc2C(F)(F)F)CC12CCC2	ZINC000853818030	GH	On-Demand	Anodyne	RBP4	63	39
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccccc2C(F)(F)F)CC12CCC2	ZINC000853818031	GH	On-Demand	Anodyne	RBP4	63	39
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(S(C)(=O)=O)cc2)CC12CCC2	ZINC000853818034	GE	On-Demand	Anodyne	S1PR2	25	43
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(S(C)(=O)=O)cc2)CC12CCC2	ZINC000853818035	GE	On-Demand	Anodyne	S1PR2	25	43
COC(=O)c1ccc(C)c(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818039	GG	On-Demand	Clean	MAPK11	23	44
COC(=O)c1ccc(C)c(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818039	GG	On-Demand	Clean	MAPK14	15	44
COC(=O)c1ccc(C)c(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818040	GG	On-Demand	Clean	MAPK11	23	44
COC(=O)c1ccc(C)c(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818040	GG	On-Demand	Clean	MAPK14	15	44
O=S(=O)(CCNc1ccnc2cc(Cl)ccc12)CC(F)(F)F	ZINC000853818052	FG	On-Demand	Anodyne	HRP1_PLAFA	162	52
O=S(=O)(CCNc1ccnc2cc(Cl)ccc12)CC(F)(F)F	ZINC000853818052	FG	On-Demand	Anodyne	HNMT	60	52
O=S(=O)(CCNc1ccnc2cc(Cl)ccc12)CC(F)(F)F	ZINC000853818052	FG	On-Demand	Anodyne	BOTA	42	57
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000853818059	FF	On-Demand	Clean	EDNRB	86	47
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000853818059	FF	On-Demand	Clean	EDNRA	79	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000853818059	FF	On-Demand	Clean	BMP1	56	36
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000853818059	FF	On-Demand	Clean	MTNR1A	15	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000853818059	FF	On-Demand	Clean	MTNR1B	15	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000853818059	FF	On-Demand	Clean	EPHX2	45	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)OCO4)C2)cc1	ZINC000853818059	FF	On-Demand	Clean	MCHR1	33	56
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C)C2)cc1	ZINC000853818061	EG	On-Demand	Clean	KCNQ2	31	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C)C2)cc1	ZINC000853818061	EG	On-Demand	Clean	CCR3	20	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C)C2)cc1	ZINC000853818061	EG	On-Demand	Clean	EPHX2	33	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C)C2)cc1	ZINC000853818061	EG	On-Demand	Clean	CCR8	55	35
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(C(N)=O)cc2)CC12CCC2	ZINC000853818063	FE	On-Demand	Anodyne	S1PR2	25	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(C(N)=O)cc2)CC12CCC2	ZINC000853818064	FE	On-Demand	Anodyne	S1PR2	25	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3C)C2)cc1	ZINC000853818071	EH	On-Demand	Clean	EPHX2	29	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)cc3C)C2)cc1	ZINC000853818071	EH	On-Demand	Clean	PDK1	42	29
COc1ccc(N2CC[C@H](NC(=O)Nc3ncn(C4CCCCC4)n3)C2)cc1	ZINC000853818082	GG	On-Demand	Clean	EPHX2	23	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)cc1	ZINC000853818086	FG	On-Demand	Clean	SSTR1	40	36
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)cc1	ZINC000853818086	FG	On-Demand	Clean	EPHX2	47	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)cc1	ZINC000853818086	FG	On-Demand	Clean	AKR1C2	17	42
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818090	FF	On-Demand	Clean	DRD4	42	35
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818090	FF	On-Demand	Clean	CCR3	43	42
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818090	FF	On-Demand	Clean	MTNR1A	20	49
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818090	FF	On-Demand	Clean	MTNR1B	22	49
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818090	FF	On-Demand	Clean	CCKBR	28	41
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818090	FF	On-Demand	Clean	EPHX2	56	56
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818090	FF	On-Demand	Clean	MCHR1	25	43
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818092	FF	On-Demand	Clean	DRD4	42	35
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818092	FF	On-Demand	Clean	CCR3	43	42
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818092	FF	On-Demand	Clean	MTNR1A	20	49
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818092	FF	On-Demand	Clean	MTNR1B	22	49
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818092	FF	On-Demand	Clean	CCKBR	28	41
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818092	FF	On-Demand	Clean	EPHX2	56	56
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(c3ccc(OC)cc3)C2)c1	ZINC000853818092	FF	On-Demand	Clean	MCHR1	25	43
COc1ccc(N2CC[C@H](NC(=O)Nc3nc4c(s3)CCCC4)C2)cc1	ZINC000853818096	FG	On-Demand	Clean	SLC27A1	47	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	DRD4	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	F10	22	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	CCR3	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	MTNR1B	15	46
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	MTOR	39	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	EPHX2	61	56
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	PDGFRA	24	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cc3)C2)cc1	ZINC000853818105	EH	On-Demand	Clean	MCHR1	27	51
CS(=O)(=O)c1ccc(NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853818113	ED	On-Demand	Anodyne	PTGS2	40	40
CS(=O)(=O)c1ccc(NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853818113	ED	On-Demand	Anodyne	CYNT	19	44
O=C(NCCCCCCCN1CCCC1)NCC1SCCS1	ZINC000853818117	EG	On-Demand	Anodyne	EPHX2	15	40
N#Cc1c(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cccc1S(N)(=O)=O	ZINC000853818121	GF	On-Demand	Mild	KCNH2	41	39
COC[C@@H](NC(=O)Nc1cccnc1Cl)C1CCOCC1	ZINC000853818129	DE	On-Demand	Anodyne	G2YM83_BOTF4	69	35
COC[C@H](NC(=O)Nc1cccnc1Cl)C1CCOCC1	ZINC000853818130	DE	On-Demand	Anodyne	G2YM83_BOTF4	69	35
O=C(NCCCCCCCN1CCCC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853818137	DG	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCCCCCCN1CCCC1)N1CCC(c2ccon2)CC1	ZINC000853818138	FH	On-Demand	Anodyne	HNMT	41	34
O=C(NCCc1ccc(C2CCCCC2)cc1)n1ccnc1	ZINC000853818153	CH	On-Demand	Anodyne	NAMPT	18	40
CN1C[C@H](CNC(=O)NCCCCCCCN2CCCC2)CC1=O	ZINC000853818154	ED	On-Demand	Anodyne	DRD3	22	40
CN1C[C@@H](CNC(=O)NCCCCCCCN2CCCC2)CC1=O	ZINC000853818155	ED	On-Demand	Anodyne	DRD3	22	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCc2ccc(O)cc21	ZINC000853818164	FH	On-Demand	Anodyne	HTR1A	18	42
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCc2ccc(O)cc21	ZINC000853818164	FH	On-Demand	Anodyne	DRD2	22	43
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCc2ccc(O)cc21	ZINC000853818164	FH	On-Demand	Anodyne	ESR2	18	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCc2ccc(O)cc21	ZINC000853818164	FH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCc2ccc(O)cc21	ZINC000853818164	FH	On-Demand	Anodyne	HNMT	42	35
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853818165	FH	On-Demand	Anodyne	HTR1A	18	42
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853818165	FH	On-Demand	Anodyne	DRD2	22	43
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853818165	FH	On-Demand	Anodyne	ESR2	18	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853818165	FH	On-Demand	Anodyne	SIGMAR1	15	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853818165	FH	On-Demand	Anodyne	HNMT	42	35
O=C(NCCCCCCCN1CCCC1)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853818184	EF	On-Demand	Anodyne	EPHX2	24	44
O=C(NCCCCCCCN1CCCC1)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853818185	EF	On-Demand	Anodyne	EPHX2	24	44
Nc1ccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c([N+](=O)[O-])c1	ZINC000853818186	EH	On-Demand	Bother	KCNH2	43	41
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncnc4ccc(F)cc34)CO2)C1	ZINC000853818200	FF	On-Demand	Anodyne	CD38	45	37
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncnc4ccc(F)cc34)CO2)C1	ZINC000853818201	FF	On-Demand	Anodyne	CD38	45	37
CN1C(=O)N[C@]2(CCC[C@@H]2CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1=O	ZINC000853818202	GD	On-Demand	Reactive	SLC27A4	47	31
CN1C(=O)N[C@]2(CCC[C@H]2CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1=O	ZINC000853818203	GD	On-Demand	Reactive	SLC27A4	47	31
CN1C(=O)N[C@@]2(CCC[C@@H]2CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1=O	ZINC000853818204	GD	On-Demand	Reactive	SLC27A4	47	31
CN1C(=O)N[C@@]2(CCC[C@H]2CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1=O	ZINC000853818205	GD	On-Demand	Reactive	SLC27A4	47	31
Cn1cnc2c(N[C@H]3COC4(C3)CN(C(=O)OC(C)(C)C)C4)ncnc21	ZINC000853818261	FD	On-Demand	Anodyne	ADORA1	21	48
Cn1cnc2c(N[C@@H]3COC4(C3)CN(C(=O)OC(C)(C)C)C4)ncnc21	ZINC000853818262	FD	On-Demand	Anodyne	ADORA1	21	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(N(C)C)n3)C2)cc1	ZINC000853818299	FF	On-Demand	Clean	EPHX2	18	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(C)C)C2)cc1	ZINC000853818301	FI	On-Demand	Clean	KCNQ2	44	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(C)C)C2)cc1	ZINC000853818301	FI	On-Demand	Clean	CCR3	22	44
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(C)C)C2)cc1	ZINC000853818301	FI	On-Demand	Clean	EPHX2	25	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccccc3C(C)C)C2)cc1	ZINC000853818301	FI	On-Demand	Clean	MCHR1	16	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)N(C)CC4)C2)cc1	ZINC000853818305	FG	On-Demand	Clean	MTNR1B	16	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)N(C)CC4)C2)cc1	ZINC000853818305	FG	On-Demand	Clean	EPHX2	44	37
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc4c(c3)N(C)CC4)C2)cc1	ZINC000853818305	FG	On-Demand	Clean	MCHR1	16	46
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000853818308	FG	On-Demand	Clean	CCR3	34	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000853818308	FG	On-Demand	Clean	MTNR1A	33	52
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000853818308	FG	On-Demand	Clean	MTNR1B	35	52
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000853818308	FG	On-Demand	Clean	EPHX2	54	49
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(NC(C)=O)c3)C2)cc1	ZINC000853818308	FG	On-Demand	Clean	MCHR1	35	45
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(C)ccc3F)C2)cc1	ZINC000853818314	EH	On-Demand	Clean	CCR3	22	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ncccc3C)C2)cc1	ZINC000853818331	EF	On-Demand	Clean	EPHX2	20	42
COc1ccc(N2CC[C@H](NC(=O)Nc3nc(C)c(C)o3)C2)cc1	ZINC000853818337	EF	On-Demand	Clean	PDK1	40	34
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(C(=O)N(C)C)c2)CC12CCC2	ZINC000853818356	GF	On-Demand	Anodyne	S1PR2	24	40
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(C(=O)N(C)C)c2)CC12CCC2	ZINC000853818357	GF	On-Demand	Anodyne	S1PR2	24	40
COc1ccc(N2CC[C@H](NC(=O)Nc3nc4c(s3)CCC4)C2)cc1	ZINC000853818370	FG	On-Demand	Clean	SLC27A1	43	47
Nc1nc(Cl)cc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853818371	EG	On-Demand	Anodyne	KCNH2	40	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	CCKAR	47	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	CCR3	36	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	KDR	25	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	MTNR1A	21	51
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	MTNR1B	24	51
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	CCKBR	56	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	EPHX2	53	55
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	PDGFRA	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	MCHR1	27	44
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	AKR1C2	22	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	KCNK3	55	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)c3)C2)cc1	ZINC000853818395	EG	On-Demand	Clean	KCNK9	44	34
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	HTR1A	33	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	DRD2	36	41
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	DRD4	18	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	DRD3	64	41
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	HRH3	17	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	CCR3	23	41
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	CHRNA7	15	50
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853818396	FH	On-Demand	Anodyne	HNMT	50	37
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	HTR1A	33	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	DRD2	36	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	DRD4	18	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	DRD3	64	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	HRH3	17	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	CCR3	23	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	CHRNA7	15	50
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853818398	FH	On-Demand	Anodyne	HNMT	50	37
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	HTR1A	33	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	DRD2	36	41
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	DRD4	18	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	DRD3	64	41
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	HRH3	17	40
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	CCR3	23	41
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	CHRNA7	15	50
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853818400	FH	On-Demand	Anodyne	HNMT	50	37
COc1ccc(N2CC[C@H](NC(=O)Nc3nc4ccccc4s3)C2)cc1	ZINC000853818401	FH	On-Demand	Clean	LTA4H	28	42
COc1ccc(N2CC[C@H](NC(=O)Nc3nc4ccccc4s3)C2)cc1	ZINC000853818401	FH	On-Demand	Clean	LCK	15	46
COc1ccc(N2CC[C@H](NC(=O)Nc3nc4ccccc4s3)C2)cc1	ZINC000853818401	FH	On-Demand	Clean	CSNK1D	32	40
COc1ccc(N2CC[C@H](NC(=O)Nc3nc4ccccc4s3)C2)cc1	ZINC000853818401	FH	On-Demand	Clean	BCL2L1	41	34
COc1ccc(N2CC[C@H](NC(=O)Nc3nc4ccccc4s3)C2)cc1	ZINC000853818401	FH	On-Demand	Clean	SLC27A1	15	46
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	HTR1A	33	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	DRD2	36	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	DRD4	18	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	DRD3	64	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	HRH3	17	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	CCR3	23	41
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	CHRNA7	15	50
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853818402	FH	On-Demand	Anodyne	HNMT	50	37
O=S(=O)(c1ccccc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2)C(F)F	ZINC000853818407	GI	On-Demand	Anodyne	GLRA1	41	33
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	CA1	22	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	MMP13	52	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	MMP3	47	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	EPHX2	51	46
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	CA12	21	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	MMP7	42	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	CA9	21	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	MMP1	44	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(C)(=O)=O)cc3)C2)cc1	ZINC000853818411	GE	On-Demand	Clean	GPR119	25	44
O=S(=O)(CCNc1nc2ccccc2[nH]1)CC(F)(F)F	ZINC000853818429	DD	On-Demand	Anodyne	KCNN3	35	44
Cc1cc(C(F)(F)F)c(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nn1	ZINC000853818462	FI	On-Demand	Anodyne	KCNH2	41	39
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	HTR1A	34	46
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	HRH2	25	42
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	HTR2A	22	44
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	DRD3	59	41
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	HRH3	27	45
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	CCR3	17	41
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	CHRNA7	19	54
O=C(NCCCCCCCN1CCCC1)NCc1ncccn1	ZINC000853818470	DE	On-Demand	Anodyne	HNMT	101	45
COC[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853818480	FH	On-Demand	Anodyne	TIMP3	47	31
COC[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853818480	FH	On-Demand	Anodyne	MTOR	76	38
COC[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853818481	FH	On-Demand	Anodyne	TIMP3	47	31
COC[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853818481	FH	On-Demand	Anodyne	MTOR	76	38
CC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853818578	EC	On-Demand	Reactive	CCR3	25	42
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1nccs1	ZINC000853818589	DC	On-Demand	Reactive	MAP1	45	38
CSc1cc(Cl)ccc1NC(=O)N1CCCCC1	ZINC000853818595	CI	On-Demand	Anodyne	CNR1	19	41
CSc1cc(Cl)ccc1NC(=O)N1CCCCC1	ZINC000853818595	CI	On-Demand	Anodyne	EPHX2	18	40
CSc1cc(Cl)ccc1NC(=O)N1CCCCC1	ZINC000853818595	CI	On-Demand	Anodyne	DPP7	28	41
CSc1cc(Cl)ccc1NC(=O)N1CCCCC1	ZINC000853818595	CI	On-Demand	Anodyne	RBP4	18	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)c(F)c3)C2)cc1	ZINC000853818605	EG	On-Demand	Clean	CCR3	30	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)c(F)c3)C2)cc1	ZINC000853818605	EG	On-Demand	Clean	EPHX2	54	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)c(F)c3)C2)cc1	ZINC000853818605	EG	On-Demand	Clean	PDGFRA	25	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)c(F)c3)C2)cc1	ZINC000853818605	EG	On-Demand	Clean	MCHR1	31	46
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc(F)cc2)CC12CCC2	ZINC000853818610	EG	On-Demand	Anodyne	S1PR2	30	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc(F)cc2)CC12CCC2	ZINC000853818611	EG	On-Demand	Anodyne	S1PR2	30	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccnc2)CC12CCC2	ZINC000853818614	DE	On-Demand	Anodyne	S1PR2	25	42
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccnc2)CC12CCC2	ZINC000853818615	DE	On-Demand	Anodyne	S1PR2	25	42
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)n3)C2)cc1	ZINC000853818622	EF	On-Demand	Clean	MTNR1A	15	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)n3)C2)cc1	ZINC000853818622	EF	On-Demand	Clean	MTNR1B	15	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)n3)C2)cc1	ZINC000853818622	EF	On-Demand	Clean	GRM5	15	43
COc1ccc(N2CC[C@H](NC(=O)Nc3cccc(C)n3)C2)cc1	ZINC000853818622	EF	On-Demand	Clean	EPHX2	24	44
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(Cl)ccc3C)C2)cc1	ZINC000853818624	FI	On-Demand	Clean	MCHR1	23	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCOCC4)cn3)C2)cc1	ZINC000853818626	GE	On-Demand	Clean	MMP13	17	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCOCC4)cn3)C2)cc1	ZINC000853818626	GE	On-Demand	Clean	MTOR	45	37
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCOCC4)cn3)C2)cc1	ZINC000853818626	GE	On-Demand	Clean	EPHX2	18	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCOCC4)cn3)C2)cc1	ZINC000853818626	GE	On-Demand	Clean	PDK1	43	31
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(N4CCOCC4)cn3)C2)cc1	ZINC000853818626	GE	On-Demand	Clean	STAT6	53	37
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC12CCC2	ZINC000853818634	FF	On-Demand	Bother	SLC27A4	44	32
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC12CCC2	ZINC000853818635	FF	On-Demand	Bother	SLC27A4	44	32
COc1ccc(N2CC[C@H](NC(=O)N3CCCC3)C2)cc1	ZINC000853818662	CE	On-Demand	Clean	MTNR1A	21	50
COc1ccc(N2CC[C@H](NC(=O)N3CCCC3)C2)cc1	ZINC000853818662	CE	On-Demand	Clean	MTNR1B	22	50
COc1ccc(N2CC[C@H](NC(=O)N3CCCC3)C2)cc1	ZINC000853818662	CE	On-Demand	Clean	EPHX2	18	42
COc1ccc(N2CC[C@H](NC(=O)Nc3ncc(C)s3)C2)cc1	ZINC000853818667	EF	On-Demand	Clean	PARE	46	31
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)c(C)c3)C2)cc1	ZINC000853818668	EH	On-Demand	Clean	CCR3	22	40
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)c(C)c3)C2)cc1	ZINC000853818668	EH	On-Demand	Clean	MTNR1B	15	47
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)c(C)c3)C2)cc1	ZINC000853818668	EH	On-Demand	Clean	EPHX2	50	46
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(C)c(C)c3)C2)cc1	ZINC000853818668	EH	On-Demand	Clean	MCHR1	33	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	CA2	74	55
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	CA1	74	54
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	CA7	49	43
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	MMP13	49	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	CA4	34	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	CA14	61	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	MMP3	46	38
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	EPHX2	51	46
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	CA12	74	55
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	MMP7	40	38
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	CA9	81	55
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	MMP1	42	38
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	NCE103	28	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	MTCA1	56	55
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(S(N)(=O)=O)cc3)C2)cc1	ZINC000853818671	GD	On-Demand	Clean	P96878_MYCTU	69	55
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000853818673	EG	On-Demand	Clean	CCR3	66	49
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000853818673	EG	On-Demand	Clean	MTNR1A	15	46
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000853818673	EG	On-Demand	Clean	MTNR1B	18	46
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000853818673	EG	On-Demand	Clean	EPHX2	63	48
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(F)cc3)C2)cc1	ZINC000853818673	EG	On-Demand	Clean	MCHR1	19	51
COc1ccc(N2CC[C@H](NC(=O)Nc3nc(C(F)(F)F)cs3)C2)cc1	ZINC000853818681	GH	On-Demand	Clean	EPHX2	41	39
COc1ccc(N2CC[C@H](NC(=O)c3cc(C#N)c[nH]3)C2)cc1	ZINC000853818689	DD	On-Demand	Mild	CSF1R	21	51
COc1ccc(N2CC[C@H](NC(=O)C(=O)c3ccc(Cl)cc3)C2)cc1	ZINC000853818690	FF	On-Demand	Clean	PTGS2	15	40
COc1ccc(N2CC[C@H](NC(=O)C(=O)c3ccc(Cl)cc3)C2)cc1	ZINC000853818690	FF	On-Demand	Clean	SLC6A5	17	41
COc1ccc(N2CC[C@H](NC(=O)C(=O)c3ccc(Cl)cc3)C2)cc1	ZINC000853818690	FF	On-Demand	Clean	MCHR1	21	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc([N+](=O)[O-])cc3F)C2)cc1	ZINC000853818693	FG	On-Demand	Clean	WDR5	34	40
C[C@H]1CN(c2ccc(NC(=O)N3CCO[C@@](C)(C4CC4)C3)cc2F)C[C@@H](C)O1	ZINC000853818699	GG	On-Demand	Anodyne	NPY2R	47	34
C[C@H]1CN(c2ccc(NC(=O)N3CCO[C@](C)(C4CC4)C3)cc2F)C[C@@H](C)O1	ZINC000853818702	GG	On-Demand	Anodyne	NPY2R	47	34
COCc1cc([N+](=O)[O-])ccc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853818705	FI	On-Demand	Bother	F2RL3	47	41
NC(=O)c1cc(Cl)nnc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853818724	FF	On-Demand	Anodyne	KCNH2	50	50
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853818768	GD	On-Demand	Reactive	P2RY1	58	40
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853818768	GD	On-Demand	Reactive	EPHX2	63	47
O=C(NCCCCCCCN1CCCC1)N[C@H]1CCNC1=O	ZINC000853818776	DD	On-Demand	Anodyne	CCR3	20	41
NC(=O)c1cc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)ccn1	ZINC000853818778	DF	On-Demand	Anodyne	KCNH2	51	49
NC(=O)c1cc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)ccn1	ZINC000853818778	DF	On-Demand	Anodyne	GLRA1	43	34
O=C(N1CCOCC1)C(F)(F)C(=O)N1CCC(c2ccco2)CC1	ZINC000853818790	ED	On-Demand	Anodyne	ITGAL	46	29
O=C(N1CCOCC1)C(F)(F)C(=O)N1CCC(c2ccco2)CC1	ZINC000853818790	ED	On-Demand	Anodyne	RBP4	27	43
O=[N+]([O-])c1cccc(Cl)c1NCCS(=O)(=O)CC(F)(F)F	ZINC000853818811	EF	On-Demand	Bother	COLA	45	33
O=C(NCCCCCCCN1CCCC1)N[C@H]1C[C@H](O)C1	ZINC000853818813	CD	On-Demand	Anodyne	EPHX2	19	45
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000853818816	EG	On-Demand	Clean	F10	57	39
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(Cl)cn3)C2)cc1	ZINC000853818816	EG	On-Demand	Clean	MCHR1	18	42
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2cccc(C(=O)OC)c2)CC12CCC2	ZINC000853818819	GF	On-Demand	Anodyne	P2RY14	43	34
CCOC(=O)[C@]1(F)CN(C(=O)Nc2cccc(C(=O)OC)c2)CC12CCC2	ZINC000853818825	GF	On-Demand	Anodyne	P2RY14	43	34
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ccc(C#N)cn3)CO2)C1	ZINC000853818829	EE	On-Demand	Mild	GPR119	20	41
COc1ccc(N2CC[C@H](NC(=O)C(=O)c3ccc(F)cc3)C2)cc1	ZINC000853818832	EE	On-Demand	Clean	CCR3	26	41
COc1ccc(N2CC[C@H](NC(=O)C(=O)c3ccc(F)cc3)C2)cc1	ZINC000853818832	EE	On-Demand	Clean	SLC18A3	22	43
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ccc(C#N)cn3)CO2)C1	ZINC000853818833	EE	On-Demand	Mild	GPR119	20	41
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818836	GE	On-Demand	Anodyne	ADORA1	58	49
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818836	GE	On-Demand	Anodyne	ADORA3	45	44
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818836	GE	On-Demand	Anodyne	OXGR1	51	33
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818836	GE	On-Demand	Anodyne	Q4VQ11_PIG	66	40
O=S(=O)(CCNc1nc(-c2ccccc2)cs1)CC(F)(F)F	ZINC000853818837	FG	On-Demand	Anodyne	NPY5R	16	47
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818838	GE	On-Demand	Anodyne	ADORA1	58	49
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818838	GE	On-Demand	Anodyne	ADORA3	45	44
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818838	GE	On-Demand	Anodyne	OXGR1	51	33
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncnc4c3ncn4C3CC3)CO2)C1	ZINC000853818838	GE	On-Demand	Anodyne	Q4VQ11_PIG	66	40
O=[N+]([O-])c1ccc(NCCS(=O)(=O)CC(F)(F)F)c2nonc12	ZINC000853818840	FD	On-Demand	Bother	GSTM2	112	43
O=[N+]([O-])c1ccc(NCCS(=O)(=O)CC(F)(F)F)c2nonc12	ZINC000853818840	FD	On-Demand	Bother	GSTP1	69	43
O=[N+]([O-])c1ccc(NCCS(=O)(=O)CC(F)(F)F)c2nonc12	ZINC000853818840	FD	On-Demand	Bother	EPAS1	62	35
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(F)ccc3F)C2)cc1	ZINC000853818847	EG	On-Demand	Clean	CCR3	39	48
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(F)ccc3F)C2)cc1	ZINC000853818847	EG	On-Demand	Clean	EPHX2	41	38
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(F)ccc3F)C2)cc1	ZINC000853818847	EG	On-Demand	Clean	MCHR1	15	41
COc1ccc(N2CC[C@H](NC(=O)Nc3ccc(=O)n(C)c3)C2)cc1	ZINC000853818849	ED	On-Demand	Clean	EPHX2	46	41
N#Cc1cc(S(N)(=O)=O)ccc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853818853	GF	On-Demand	Mild	KCNH2	42	41
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(F)cc(F)c3)C2)cc1	ZINC000853818863	EG	On-Demand	Clean	CCR3	54	47
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(F)cc(F)c3)C2)cc1	ZINC000853818863	EG	On-Demand	Clean	EPHX2	56	40
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(F)cc(F)c3)C2)cc1	ZINC000853818863	EG	On-Demand	Clean	CXCR3	20	44
COc1ccc(N2CC[C@H](NC(=O)Nc3cc(F)cc(F)c3)C2)cc1	ZINC000853818863	EG	On-Demand	Clean	MCHR1	22	46
O=C(NC1CC1)c1ccc(NCCS(=O)(=O)CC(F)(F)F)c([N+](=O)[O-])c1	ZINC000853818869	GD	On-Demand	Bother	TAAR1	17	41
COc1ccc(N2CC[C@H](NC(=O)c3cc(C(C)=O)cn3C)C2)cc1	ZINC000853818871	EE	On-Demand	Clean	DRD4	43	35
COc1ccc(N2CC[C@H](NC(=O)c3cc(C(C)=O)cn3C)C2)cc1	ZINC000853818871	EE	On-Demand	Clean	MTNR1A	19	45
COc1ccc(N2CC[C@H](NC(=O)c3cc(C(C)=O)cn3C)C2)cc1	ZINC000853818871	EE	On-Demand	Clean	MTNR1B	17	45
COc1ccc(N2CC[C@H](NC(=O)c3cc(C(C)=O)cn3C)C2)cc1	ZINC000853818871	EE	On-Demand	Clean	MCHR1	15	40
CCOC(=O)[C@@]1(F)CN(C(=O)Nc2ccccc2Cl)CC12CCC2	ZINC000853818891	FH	On-Demand	Anodyne	EPHB3	45	32
CCOC(=O)[C@]1(F)CN(C(=O)Nc2ccccc2Cl)CC12CCC2	ZINC000853818893	FH	On-Demand	Anodyne	EPHB3	45	32
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccc(Cl)cn1	ZINC000853818943	EC	On-Demand	Reactive	F10	20	40
O=C(N1CCc2ccccc2C1)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853818949	GH	On-Demand	Anodyne	NOD1	16	40
O=C(N1CCc2ccccc2C1)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853818949	GH	On-Demand	Anodyne	NOD2	42	40
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccc(C(F)(F)F)cc1	ZINC000853818952	FD	On-Demand	Reactive	EPHX2	33	44
CN(C)C(=O)c1cc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)ccn1	ZINC000853818972	FG	On-Demand	Anodyne	KCNH2	42	40
CN(C)C(=O)c1cc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)ccn1	ZINC000853818972	FG	On-Demand	Anodyne	GLRA1	44	36
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccc(N2CCOCC2)cn1	ZINC000853819034	GB	On-Demand	Reactive	STAT6	42	31
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1ccccc1C(F)(F)F	ZINC000853819038	FD	On-Demand	Reactive	RBP4	70	39
O=C(NCCCCCCCN1CCCC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853819043	GE	On-Demand	Anodyne	L3MBTL3	56	47
O=C(NCCCCCCCN1CCCC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853819045	GE	On-Demand	Anodyne	L3MBTL3	56	47
COC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853819061	FC	On-Demand	Reactive	EPHX2	15	45
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CCOCC1	ZINC000853819078	GE	On-Demand	Anodyne	KCNQ2	78	41
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CCOCC1	ZINC000853819080	GE	On-Demand	Anodyne	KCNQ2	78	41
O=C(NCCCCCCCN1CCCC1)NC1CCC2(CC1)CC2(F)F	ZINC000853819119	FI	On-Demand	Anodyne	EPHX2	17	45
NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853819140	GB	On-Demand	Reactive	CA2	15	45
NS(=O)(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853819140	GB	On-Demand	Reactive	CA4	15	42
COc1ccc2c(NCCO[C@H]3CC3(F)F)ccnc2c1	ZINC000853819199	CG	On-Demand	Anodyne	HRP1_PLAFA	123	44
COc1ccc2c(NCCO[C@H]3CC3(F)F)ccnc2c1	ZINC000853819199	CG	On-Demand	Anodyne	HNMT	64	38
COc1ccc2c(NCCO[C@H]3CC3(F)F)ccnc2c1	ZINC000853819199	CG	On-Demand	Anodyne	BOTA	22	40
COc1ccc2c(NCCO[C@@H]3CC3(F)F)ccnc2c1	ZINC000853819200	CG	On-Demand	Anodyne	HRP1_PLAFA	123	44
COc1ccc2c(NCCO[C@@H]3CC3(F)F)ccnc2c1	ZINC000853819200	CG	On-Demand	Anodyne	HNMT	64	38
COc1ccc2c(NCCO[C@@H]3CC3(F)F)ccnc2c1	ZINC000853819200	CG	On-Demand	Anodyne	BOTA	22	40
O=C(NC1CC1)C(=O)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853819212	ED	On-Demand	Anodyne	EPHX2	42	41
COCCN(CCF)c1nc(C)nc2c1cnn2-c1ccccc1	ZINC000853819231	EF	On-Demand	Anodyne	CRHR1	19	42
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853819258	DG	On-Demand	Anodyne	L3MBTL3	17	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853819259	DG	On-Demand	Anodyne	L3MBTL3	17	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]2C[C@H]2C1	ZINC000853819260	DG	On-Demand	Anodyne	L3MBTL3	17	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853819261	DG	On-Demand	Anodyne	L3MBTL3	17	45
Cc1nc(NC(=O)N2CCO[C@](C)(C3CC3)C2)sc1-c1ccccc1	ZINC000853819265	FI	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)N2CCO[C@@](C)(C3CC3)C2)sc1-c1ccccc1	ZINC000853819266	FI	On-Demand	Anodyne	PIK3CG	20	41
O=C(NCCCCCCCN1CCCC1)N1CCc2nccnc2C1	ZINC000853819289	EF	On-Demand	Anodyne	HTR1A	21	40
O=C(NCCCCCCCN1CCCC1)N1CCc2nccnc2C1	ZINC000853819289	EF	On-Demand	Anodyne	DRD3	43	35
O=C(NCCCCCCCN1CCCC1)N1CCc2nccnc2C1	ZINC000853819289	EF	On-Demand	Anodyne	HNMT	59	38
COCCN(CCF)c1nc(C)nc2c1cnn2C	ZINC000853819292	CD	On-Demand	Anodyne	CRHR1	21	43
COCCn1cc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cn1	ZINC000853819361	FB	On-Demand	Reactive	PANC	44	31
N#Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853819420	EC	On-Demand	Reactive	CCR3	17	43
O=S(=O)(c1ccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)cc1)C(F)F	ZINC000853819434	GI	On-Demand	Anodyne	GLRA1	41	31
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncnc4sccc34)CO2)C1	ZINC000853819447	FF	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncnc4sccc34)CO2)C1	ZINC000853819448	FF	On-Demand	Anodyne	GPR119	15	41
Nc1ccc([N+](=O)[O-])c(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c1	ZINC000853819490	EH	On-Demand	Bother	KCNH2	40	39
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	HTR1A	29	58
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	DRD2	38	58
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	DRD4	21	58
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	HTR2A	31	41
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	HTR2C	29	41
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	DRD3	72	58
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	CHRNA7	22	47
O=C(NCCCCCCCN1CCCC1)NNC(=O)c1cccc(F)n1	ZINC000853819491	FE	On-Demand	Reactive	HNMT	46	35
CN1CCN(c2ccccc2NC(=O)N2CCC(c3ccco3)CC2)CC1	ZINC000853819495	FG	On-Demand	Anodyne	KCNQ2	69	40
O=C(N1CCCC1)N1CCC(c2ccco2)CC1	ZINC000853819505	BF	On-Demand	Anodyne	L3MBTL3	51	36
NC(=O)c1cccc2c1CCN(C(=O)NCCCCCCCN1CCCC1)C2	ZINC000853819508	GF	On-Demand	Anodyne	DRD3	42	38
NC(=O)c1cccc2c1CCN(C(=O)NCCCCCCCN1CCCC1)C2	ZINC000853819508	GF	On-Demand	Anodyne	PARP1	16	41
COC(=O)c1sc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nc1Cl	ZINC000853819514	GI	On-Demand	Anodyne	KCNH2	40	38
COC(=O)c1sc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nc1Cl	ZINC000853819514	GI	On-Demand	Anodyne	GLRA1	45	35
CC(C)(C)OC(=O)N1CC2(C[C@@H](Nc3ncccn3)CO2)C1	ZINC000853819558	DD	On-Demand	Anodyne	GPR119	17	41
CC(C)(C)OC(=O)N1CC2(C[C@H](Nc3ncccn3)CO2)C1	ZINC000853819559	DD	On-Demand	Anodyne	GPR119	17	41
C#CCNC(=O)c1ccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nc1	ZINC000853819583	FG	On-Demand	Mild	KCNH2	43	41
COc1cc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c([N+](=O)[O-])cc1OC	ZINC000853819604	GI	On-Demand	Clean	KCNH2	40	38
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1nccn1C	ZINC000853819606	EF	On-Demand	Anodyne	HRH2	17	40
C[C@H](NC(=O)NCCCCCCCN1CCCC1)c1nccn1C	ZINC000853819606	EF	On-Demand	Anodyne	HNMT	63	38
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1nccn1C	ZINC000853819607	EF	On-Demand	Anodyne	HRH2	17	40
C[C@@H](NC(=O)NCCCCCCCN1CCCC1)c1nccn1C	ZINC000853819607	EF	On-Demand	Anodyne	HNMT	63	38
O=C(NCCCCCCCN1CCCC1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853819613	GF	On-Demand	Anodyne	L3MBTL3	70	49
O=C(NCCCCCCCN1CCCC1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853819614	GF	On-Demand	Anodyne	L3MBTL3	70	49
O=C(N1CCC(c2ccco2)CC1)C(F)(F)c1ccccc1F	ZINC000853819624	DH	On-Demand	Anodyne	RBP4	43	48
O=C(N1CCCCC1)N1CCC(c2ccco2)CC1	ZINC000853819640	CG	On-Demand	Anodyne	LIPE	45	36
O=C(N1CCCCC1)N1CCC(c2ccco2)CC1	ZINC000853819640	CG	On-Demand	Anodyne	L3MBTL3	40	36
COCCN(CCF)c1cc(Cl)nc2cc(C)nn12	ZINC000853819641	CE	On-Demand	Anodyne	CRHR1	21	43
CN1CCN(C(=O)NCCCCCCCN2CCCC2)CCC1=O	ZINC000853819651	ED	On-Demand	Anodyne	ASAH1	56	33
COC(=O)c1cccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853819677	EG	On-Demand	Anodyne	SLC6A3	21	47
COC(=O)c1cccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853819677	EG	On-Demand	Anodyne	KCNH2	43	42
COC(=O)c1cccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853819677	EG	On-Demand	Anodyne	GLRA1	47	35
CNC(=O)c1cc([N+](=O)[O-])ccc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853819692	GH	On-Demand	Bother	KCNH2	40	38
CNC(=O)c1cc([N+](=O)[O-])ccc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853819692	GH	On-Demand	Bother	GLRA1	42	33
CN1CCN(c2ccccc2NC(=O)N2CCO[C@](C)(C3CC3)C2)CC1	ZINC000853819702	FE	On-Demand	Anodyne	KCNQ2	67	37
CN1CCN(c2ccccc2NC(=O)N2CCO[C@@](C)(C3CC3)C2)CC1	ZINC000853819703	FE	On-Demand	Anodyne	KCNQ2	67	37
CS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853819734	FD	On-Demand	Anodyne	CA2	15	41
CS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853819734	FD	On-Demand	Anodyne	MTCA1	41	39
CS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853819734	FD	On-Demand	Anodyne	P96878_MYCTU	51	39
CS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853819735	FD	On-Demand	Anodyne	CA2	15	41
CS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853819735	FD	On-Demand	Anodyne	MTCA1	41	39
CS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853819735	FD	On-Demand	Anodyne	P96878_MYCTU	51	39
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853819774	GG	On-Demand	Anodyne	P2RY1	66	40
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853819774	GG	On-Demand	Anodyne	EPHX2	64	48
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853819774	GG	On-Demand	Anodyne	ACR	51	39
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853819775	GG	On-Demand	Anodyne	P2RY1	66	40
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853819775	GG	On-Demand	Anodyne	EPHX2	64	48
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853819775	GG	On-Demand	Anodyne	ACR	51	39
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819778	EG	On-Demand	Anodyne	CCKAR	36	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819778	EG	On-Demand	Anodyne	CCR3	34	41
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819778	EG	On-Demand	Anodyne	CCKBR	53	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819778	EG	On-Demand	Anodyne	EPHX2	57	50
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819778	EG	On-Demand	Anodyne	CXCR3	18	42
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819779	EG	On-Demand	Anodyne	CCKAR	36	40
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819779	EG	On-Demand	Anodyne	CCR3	34	41
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819779	EG	On-Demand	Anodyne	CCKBR	53	40
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819779	EG	On-Demand	Anodyne	EPHX2	57	50
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(Br)c2)C1	ZINC000853819779	EG	On-Demand	Anodyne	CXCR3	18	42
Cc1cc(F)ccc1C[C@H](C)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853819783	GH	On-Demand	Anodyne	KCNQ2	81	45
Cc1cc(F)ccc1C[C@H](C)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853819783	GH	On-Demand	Anodyne	CCR3	52	35
Cc1cc(F)ccc1C[C@@H](C)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853819784	GH	On-Demand	Anodyne	KCNQ2	81	45
Cc1cc(F)ccc1C[C@@H](C)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853819784	GH	On-Demand	Anodyne	CCR3	52	35
CC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819785	EE	On-Demand	Anodyne	CCR3	37	47
CC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819785	EE	On-Demand	Anodyne	EPHX2	19	42
CC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819785	EE	On-Demand	Anodyne	AKR1C3	21	45
CC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819785	EE	On-Demand	Anodyne	IMDH_CRYPV	46	39
CC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819785	EE	On-Demand	Anodyne	KCNK3	78	35
CC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819785	EE	On-Demand	Anodyne	KCNK9	57	33
CC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819786	EE	On-Demand	Anodyne	CCR3	37	47
CC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819786	EE	On-Demand	Anodyne	EPHX2	19	42
CC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819786	EE	On-Demand	Anodyne	AKR1C3	21	45
CC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819786	EE	On-Demand	Anodyne	IMDH_CRYPV	46	39
CC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819786	EE	On-Demand	Anodyne	KCNK3	78	35
CC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819786	EE	On-Demand	Anodyne	KCNK9	57	33
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](CO)C1CCC1	ZINC000853819788	DH	On-Demand	Anodyne	MME	20	44
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](CO)C1CCC1	ZINC000853819788	DH	On-Demand	Anodyne	PRNP	28	40
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](CO)C1CCC1	ZINC000853819788	DH	On-Demand	Anodyne	EPHX2	23	43
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](CO)C1CCC1	ZINC000853819788	DH	On-Demand	Anodyne	ACE2	36	44
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](CO)C1CCC1	ZINC000853819788	DH	On-Demand	Anodyne	SLC1A2	21	41
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](CO)C1CCC1	ZINC000853819788	DH	On-Demand	Anodyne	DGAT1	27	47
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](CO)C1CCC1	ZINC000853819789	DH	On-Demand	Anodyne	MME	20	44
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](CO)C1CCC1	ZINC000853819789	DH	On-Demand	Anodyne	PRNP	28	40
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](CO)C1CCC1	ZINC000853819789	DH	On-Demand	Anodyne	EPHX2	23	43
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](CO)C1CCC1	ZINC000853819789	DH	On-Demand	Anodyne	ACE2	36	44
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](CO)C1CCC1	ZINC000853819789	DH	On-Demand	Anodyne	SLC1A2	21	41
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](CO)C1CCC1	ZINC000853819789	DH	On-Demand	Anodyne	DGAT1	27	47
Cc1nc(C(=O)N[C@H](C)Cc2ccc(F)cc2C)no1	ZINC000853819792	CE	On-Demand	Anodyne	P2RX7	17	46
Cc1nc(C(=O)N[C@@H](C)Cc2ccc(F)cc2C)no1	ZINC000853819793	CE	On-Demand	Anodyne	P2RX7	17	46
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2ccccc2)CC1	ZINC000853819810	FE	On-Demand	Anodyne	P2RY12	197	44
CCOC(=O)N1CCN(C(=O)[C@H](C)SCCOc2ccccc2)CC1	ZINC000853819810	FE	On-Demand	Anodyne	PLA2G4B	45	33
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2ccccc2)CC1	ZINC000853819811	FE	On-Demand	Anodyne	P2RY12	197	44
CCOC(=O)N1CCN(C(=O)[C@@H](C)SCCOc2ccccc2)CC1	ZINC000853819811	FE	On-Demand	Anodyne	PLA2G4B	45	33
COc1ccccc1NC(=O)NCC[S@](=O)CC(F)(F)F	ZINC000853819819	DE	On-Demand	Anodyne	KCNK3	41	36
COc1ccccc1NC(=O)NCC[S@@](=O)CC(F)(F)F	ZINC000853819820	DE	On-Demand	Anodyne	KCNK3	41	36
CC(C)(C)N1CC[C@@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819858	FG	On-Demand	Anodyne	CACNA1H	17	41
CC(C)(C)N1CC[C@@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819858	FG	On-Demand	Anodyne	HRH2	17	41
CC(C)(C)N1CC[C@@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819858	FG	On-Demand	Anodyne	HTR4	17	40
CC(C)(C)N1CC[C@@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819858	FG	On-Demand	Anodyne	CCR3	19	43
CC(C)(C)N1CC[C@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819859	FG	On-Demand	Anodyne	CACNA1H	17	41
CC(C)(C)N1CC[C@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819859	FG	On-Demand	Anodyne	HRH2	17	41
CC(C)(C)N1CC[C@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819859	FG	On-Demand	Anodyne	HTR4	17	40
CC(C)(C)N1CC[C@H](NC(=O)NCCCCCCCN2CCCC2)C1	ZINC000853819859	FG	On-Demand	Anodyne	CCR3	19	43
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819864	DF	On-Demand	Anodyne	CCR3	41	43
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819864	DF	On-Demand	Anodyne	CCKBR	54	35
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819864	DF	On-Demand	Anodyne	EPHX2	64	55
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819864	DF	On-Demand	Anodyne	CXCR3	19	44
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819865	DF	On-Demand	Anodyne	CCR3	41	43
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819865	DF	On-Demand	Anodyne	CCKBR	54	35
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819865	DF	On-Demand	Anodyne	EPHX2	64	55
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819865	DF	On-Demand	Anodyne	CXCR3	19	44
Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819871	DE	On-Demand	Anodyne	CCKAR	22	48
Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819871	DE	On-Demand	Anodyne	EPHX2	15	41
Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819871	DE	On-Demand	Anodyne	KCNK3	74	41
Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853819871	DE	On-Demand	Anodyne	KCNK9	67	40
Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819872	DE	On-Demand	Anodyne	CCKAR	22	48
Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819872	DE	On-Demand	Anodyne	EPHX2	15	41
Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819872	DE	On-Demand	Anodyne	KCNK3	74	41
Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853819872	DE	On-Demand	Anodyne	KCNK9	67	40
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853819873	FD	On-Demand	Anodyne	CASP2	17	42
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853819873	FD	On-Demand	Anodyne	CASP6	15	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853819874	FD	On-Demand	Anodyne	CASP2	17	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853819874	FD	On-Demand	Anodyne	CASP6	15	42
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819886	DE	On-Demand	Anodyne	CCKAR	31	42
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819886	DE	On-Demand	Anodyne	CCR3	43	41
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819886	DE	On-Demand	Anodyne	CCKBR	48	43
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819886	DE	On-Demand	Anodyne	EPHX2	64	55
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819886	DE	On-Demand	Anodyne	CXCR3	17	56
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819887	DE	On-Demand	Anodyne	CCKAR	31	42
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819887	DE	On-Demand	Anodyne	CCR3	43	41
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819887	DE	On-Demand	Anodyne	CCKBR	48	43
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819887	DE	On-Demand	Anodyne	EPHX2	64	55
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)c1	ZINC000853819887	DE	On-Demand	Anodyne	CXCR3	17	56
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(Br)cc2F)C1	ZINC000853819890	FH	On-Demand	Anodyne	EPHX2	33	40
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(Br)cc2F)C1	ZINC000853819891	FH	On-Demand	Anodyne	EPHX2	33	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	CA2	34	52
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	CA1	27	46
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	CA4	26	47
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	EPHX2	52	47
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	CA12	31	52
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	ST14	43	39
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	CA9	31	52
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	SFRP1	52	31
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	MTCA1	43	46
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819906	ED	On-Demand	Anodyne	P96878_MYCTU	54	46
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	CA2	34	52
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	CA1	27	46
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	CA4	26	47
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	EPHX2	52	47
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	CA12	31	52
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	ST14	43	39
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	CA9	31	52
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	SFRP1	52	31
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	MTCA1	43	46
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(S(N)(=O)=O)c2)C1	ZINC000853819907	ED	On-Demand	Anodyne	P96878_MYCTU	54	46
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCN(C(C)(C)C)C2)CC1	ZINC000853820045	FE	On-Demand	Anodyne	KCNQ2	76	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)CC1	ZINC000853820046	FE	On-Demand	Anodyne	KCNQ2	76	42
Cc1nc(NC(=O)N[C@@H](CO)C2CCC2)sc1-c1ccccc1	ZINC000853820051	EG	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)N[C@@H](CO)C2CCC2)sc1-c1ccccc1	ZINC000853820051	EG	On-Demand	Anodyne	PI4KB	40	37
Cc1nc(NC(=O)N[C@H](CO)C2CCC2)sc1-c1ccccc1	ZINC000853820052	EG	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)N[C@H](CO)C2CCC2)sc1-c1ccccc1	ZINC000853820052	EG	On-Demand	Anodyne	PI4KB	40	37
Cc1cccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)n1	ZINC000853820074	CE	On-Demand	Anodyne	GRM5	17	44
Cc1cccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)n1	ZINC000853820075	CE	On-Demand	Anodyne	GRM5	17	44
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853820078	FG	On-Demand	Anodyne	RAF1	15	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853820078	FG	On-Demand	Anodyne	EPHX2	36	57
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853820078	FG	On-Demand	Anodyne	FPR2	18	41
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853820079	FG	On-Demand	Anodyne	RAF1	15	42
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853820079	FG	On-Demand	Anodyne	EPHX2	36	57
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853820079	FG	On-Demand	Anodyne	FPR2	18	41
CC(=O)c1ccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c([N+](=O)[O-])c1	ZINC000853820080	FI	On-Demand	Bother	KCNH2	45	43
CC(=O)c1ccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c([N+](=O)[O-])c1	ZINC000853820080	FI	On-Demand	Bother	GLRA1	44	34
CC(=O)c1ccc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)c([N+](=O)[O-])c1	ZINC000853820080	FI	On-Demand	Bother	TAAR1	20	43
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccnc1	ZINC000853820087	CD	On-Demand	Anodyne	NAMPT	45	40
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccnc1	ZINC000853820088	CD	On-Demand	Anodyne	NAMPT	45	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(C)(=O)=O)nc2)C1	ZINC000853820093	ED	On-Demand	Anodyne	EPHX2	45	41
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(C)(=O)=O)nc2)C1	ZINC000853820094	ED	On-Demand	Anodyne	EPHX2	45	41
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA2	120	55
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA1	110	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA7	55	46
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA13	17	41
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA5B	63	42
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA4	89	52
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA5A	67	42
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA14	48	46
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	EPHX2	18	44
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA12	89	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CA9	96	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	CYNT	49	41
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	NCE103	46	55
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	MTCA1	64	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820099	FC	On-Demand	Anodyne	P96878_MYCTU	79	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA2	120	55
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA1	110	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA7	55	46
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA13	17	41
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA5B	63	42
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA4	89	52
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA5A	67	42
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA14	48	46
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	EPHX2	18	44
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA12	89	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CA9	96	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	CYNT	49	41
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	NCE103	46	55
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	MTCA1	64	54
NS(=O)(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820100	FC	On-Demand	Anodyne	P96878_MYCTU	79	54
N#Cc1cc([N+](=O)[O-])ccc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853820106	EI	On-Demand	Mild	AR	17	44
N#Cc1cc([N+](=O)[O-])ccc1N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853820106	EI	On-Demand	Mild	KCNH2	41	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CA2	88	63
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CA1	80	63
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CA7	55	46
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CA4	59	47
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CA14	59	45
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	EPHX2	58	46
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CA12	74	63
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CA9	75	63
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	CYNT	48	45
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	NCE103	30	46
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	MTCA1	62	63
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820112	ED	On-Demand	Anodyne	P96878_MYCTU	75	63
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CA2	88	63
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CA1	80	63
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CA7	55	46
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CA4	59	47
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CA14	59	45
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	EPHX2	58	46
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CA12	74	63
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CA9	75	63
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	CYNT	48	45
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	NCE103	30	46
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	MTCA1	62	63
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853820113	ED	On-Demand	Anodyne	P96878_MYCTU	75	63
O=C(NCCCCCCCN1CCCC1)N[C@@H]1CCNC1=O	ZINC000853820125	DD	On-Demand	Anodyne	CCR3	20	41
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA2	49	54
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA1	44	46
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA7	25	40
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA5B	58	33
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA4	48	52
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA5A	62	33
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA12	36	54
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	CA9	37	54
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	NCE103	15	43
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	MTCA1	44	40
NS(=O)(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820145	FC	On-Demand	Anodyne	P96878_MYCTU	55	40
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA2	49	54
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA1	44	46
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA7	25	40
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA5B	58	33
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA4	48	52
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA5A	62	33
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA12	36	54
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	CA9	37	54
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	NCE103	15	43
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	MTCA1	44	40
NS(=O)(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820146	FC	On-Demand	Anodyne	P96878_MYCTU	55	40
Cc1nsc(C(=O)N[C@H](C)Cc2ccc(F)cc2C)n1	ZINC000853820150	CF	On-Demand	Anodyne	P2RX7	17	40
Cc1nsc(C(=O)N[C@@H](C)Cc2ccc(F)cc2C)n1	ZINC000853820151	CF	On-Demand	Anodyne	P2RX7	17	40
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000853820163	EE	On-Demand	Bother	NMBR	41	31
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000853820164	EE	On-Demand	Bother	NMBR	41	31
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	HTR1A	34	42
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	DRD2	42	42
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	DRD1	17	41
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	DRD4	22	41
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	ADRA1D	42	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	HTR2C	17	40
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	ADRA1A	64	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	ADRA1B	51	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	DRD3	45	41
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	CCR3	46	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	CHRNA7	16	51
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	PLD1	52	37
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	PLD2	61	37
O=C(NCCCCCCCN1CCCC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853820172	FI	On-Demand	Anodyne	ASAH1	81	34
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	HTR1A	34	42
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	DRD2	42	42
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	DRD1	17	41
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	DRD4	22	41
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	ADRA1D	42	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	HTR2C	17	40
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	ADRA1A	64	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	ADRA1B	51	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	DRD3	45	41
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	CCR3	46	45
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	CHRNA7	16	51
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	PLD1	52	37
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	PLD2	61	37
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853820173	FI	On-Demand	Anodyne	ASAH1	81	34
COCCOc1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cn1	ZINC000853820190	FD	On-Demand	Anodyne	ADRB1	22	40
COCCOc1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cn1	ZINC000853820191	FD	On-Demand	Anodyne	ADRB1	22	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853820206	CF	On-Demand	Anodyne	EPHX2	52	50
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853820207	CF	On-Demand	Anodyne	EPHX2	52	50
Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)n1	ZINC000853820227	DD	On-Demand	Anodyne	GRM5	17	43
Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)n1	ZINC000853820227	DD	On-Demand	Anodyne	SORT1	20	41
Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)n1	ZINC000853820228	DD	On-Demand	Anodyne	GRM5	17	43
Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)n1	ZINC000853820228	DD	On-Demand	Anodyne	SORT1	20	41
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853820229	FF	On-Demand	Anodyne	CSNK1D	44	49
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853820229	FF	On-Demand	Anodyne	TMPRSS6	44	32
O=C(NCC[S@](=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853820230	FF	On-Demand	Anodyne	CSNK1D	44	49
O=C(NCC[S@](=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853820230	FF	On-Demand	Anodyne	TMPRSS6	44	32
CC(=O)c1ccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)cc1	ZINC000853820235	EE	On-Demand	Anodyne	ACR	48	34
CC(=O)c1ccc(NC(=O)NCC[S@](=O)CC(F)(F)F)cc1	ZINC000853820236	EE	On-Demand	Anodyne	ACR	48	34
COC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820243	FD	On-Demand	Anodyne	EPHX2	21	45
COC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820243	FD	On-Demand	Anodyne	ACR	20	41
COC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820243	FD	On-Demand	Anodyne	KCNK3	69	33
COC(=O)c1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820243	FD	On-Demand	Anodyne	KCNK9	65	32
COC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820244	FD	On-Demand	Anodyne	EPHX2	21	45
COC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820244	FD	On-Demand	Anodyne	ACR	20	41
COC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820244	FD	On-Demand	Anodyne	KCNK3	69	33
COC(=O)c1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820244	FD	On-Demand	Anodyne	KCNK9	65	32
Cc1nc(NC(=O)NCC[S@@](=O)CC(F)(F)F)sc1-c1ccccc1	ZINC000853820267	GH	On-Demand	Anodyne	PIK3CG	21	49
Cc1nc(NC(=O)NCC[S@@](=O)CC(F)(F)F)sc1-c1ccccc1	ZINC000853820267	GH	On-Demand	Anodyne	PI4KB	42	46
Cc1nc(NC(=O)NCC[S@](=O)CC(F)(F)F)sc1-c1ccccc1	ZINC000853820268	GH	On-Demand	Anodyne	PIK3CG	21	49
Cc1nc(NC(=O)NCC[S@](=O)CC(F)(F)F)sc1-c1ccccc1	ZINC000853820268	GH	On-Demand	Anodyne	PI4KB	42	46
O=C(NCC[S@](=O)CC(F)(F)F)c1nccs1	ZINC000853820281	CD	On-Demand	Anodyne	HPN	41	32
O=C(NCC[S@@](=O)CC(F)(F)F)c1nccs1	ZINC000853820282	CD	On-Demand	Anodyne	HPN	41	32
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(N3CCNC3=O)c2)C1	ZINC000853820287	EE	On-Demand	Anodyne	EPHX2	43	44
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(N3CCNC3=O)c2)C1	ZINC000853820288	EE	On-Demand	Anodyne	EPHX2	43	44
Cc1cc(F)ccc1C[C@@H](C)NC(=O)Nc1cccnc1Cl	ZINC000853820289	DH	On-Demand	Anodyne	P2RY1	24	42
Cc1cc(F)ccc1C[C@@H](C)NC(=O)Nc1cccnc1Cl	ZINC000853820289	DH	On-Demand	Anodyne	G2YM83_BOTF4	57	31
Cc1cc(F)ccc1C[C@H](C)NC(=O)Nc1cccnc1Cl	ZINC000853820290	DH	On-Demand	Anodyne	P2RY1	24	42
Cc1cc(F)ccc1C[C@H](C)NC(=O)Nc1cccnc1Cl	ZINC000853820290	DH	On-Demand	Anodyne	G2YM83_BOTF4	57	31
O=C(NCCCCCCCN1CCCC1)NCc1ccc2c(=O)cc[nH]c2c1	ZINC000853820298	GG	On-Demand	Anodyne	HRH2	21	40
O=C(NCCCCCCCN1CCCC1)NCc1ccc2c(=O)cc[nH]c2c1	ZINC000853820298	GG	On-Demand	Anodyne	CCR3	23	42
O=C(NCCCCCCCN1CCCC1)NCc1ccc2c(=O)cc[nH]c2c1	ZINC000853820298	GG	On-Demand	Anodyne	HNMT	56	37
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)C1	ZINC000853820301	FD	On-Demand	Anodyne	EPHX2	41	39
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(CN3C(=O)CNC3=O)cc2)C1	ZINC000853820302	FD	On-Demand	Anodyne	EPHX2	41	39
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3CCN(C(C)(C)C)C3)cc2F)C[C@@H](C)O1	ZINC000853820313	GG	On-Demand	Anodyne	NPY2R	75	38
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3CCN(C(C)(C)C)C3)cc2F)C[C@@H](C)O1	ZINC000853820313	GG	On-Demand	Anodyne	EPHX2	42	37
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3CCN(C(C)(C)C)C3)cc2F)C[C@@H](C)O1	ZINC000853820315	GG	On-Demand	Anodyne	NPY2R	75	38
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3CCN(C(C)(C)C)C3)cc2F)C[C@@H](C)O1	ZINC000853820315	GG	On-Demand	Anodyne	EPHX2	42	37
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccc(N2CCNC2=O)c1	ZINC000853820320	GD	On-Demand	Anodyne	CCR3	37	40
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccc(N2CCNC2=O)c1	ZINC000853820321	GD	On-Demand	Anodyne	CCR3	37	40
COC(=O)c1sc(N2C[C@@H](C)C(=O)[C@H](C)C2)nc1Cl	ZINC000853820324	DE	On-Demand	Anodyne	PARE	52	32
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853820349	EC	On-Demand	Reactive	CCR3	26	45
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853820349	EC	On-Demand	Reactive	MTNR1B	15	43
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853820349	EC	On-Demand	Reactive	EPHX2	21	44
C[C@H]1C[C@H](NC(=O)Nc2cccnc2Cl)c2ncnn21	ZINC000853820367	CE	On-Demand	Anodyne	G2YM83_BOTF4	73	40
CN1CCC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1=O	ZINC000853820419	DD	On-Demand	Anodyne	ACE	20	42
CN1CCC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1=O	ZINC000853820420	DD	On-Demand	Anodyne	ACE	20	42
CN1CCC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1=O	ZINC000853820421	DD	On-Demand	Anodyne	ACE	20	42
CN1CCC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1=O	ZINC000853820422	DD	On-Demand	Anodyne	ACE	20	42
CN1CCN(c2ccccc2NC(=O)NCC[S@@](=O)CC(F)(F)F)CC1	ZINC000853820436	GD	On-Demand	Anodyne	DRD3	47	39
CN1CCN(c2ccccc2NC(=O)NCC[S@@](=O)CC(F)(F)F)CC1	ZINC000853820436	GD	On-Demand	Anodyne	KCNQ2	76	39
CN1CCN(c2ccccc2NC(=O)NCC[S@@](=O)CC(F)(F)F)CC1	ZINC000853820436	GD	On-Demand	Anodyne	P2RY1	53	40
CN1CCN(c2ccccc2NC(=O)NCC[S@](=O)CC(F)(F)F)CC1	ZINC000853820437	GD	On-Demand	Anodyne	DRD3	47	39
CN1CCN(c2ccccc2NC(=O)NCC[S@](=O)CC(F)(F)F)CC1	ZINC000853820437	GD	On-Demand	Anodyne	KCNQ2	76	39
CN1CCN(c2ccccc2NC(=O)NCC[S@](=O)CC(F)(F)F)CC1	ZINC000853820437	GD	On-Demand	Anodyne	P2RY1	53	40
COCCOc1ccc(NC(=O)N[C@H]2CCN(C(C)(C)C)C2)cn1	ZINC000853820438	EE	On-Demand	Anodyne	EPHX2	45	38
COCCOc1ccc(NC(=O)N[C@@H]2CCN(C(C)(C)C)C2)cn1	ZINC000853820439	EE	On-Demand	Anodyne	EPHX2	45	38
O=C(NCCCCCCCN1CCCC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853820446	FE	On-Demand	Anodyne	L3MBTL3	15	44
O=C(NCCCCCCCN1CCCC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853820447	FE	On-Demand	Anodyne	L3MBTL3	15	44
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccnn2Cc2ccccn2)C1	ZINC000853820450	EE	On-Demand	Anodyne	EPHX2	20	41
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccnn2Cc2ccccn2)C1	ZINC000853820451	EE	On-Demand	Anodyne	EPHX2	20	41
COc1ncccc1NC(=O)NCC[S@](=O)CC(F)(F)F	ZINC000853820473	ED	On-Demand	Anodyne	P2RY1	56	45
COc1ncccc1NC(=O)NCC[S@@](=O)CC(F)(F)F	ZINC000853820474	ED	On-Demand	Anodyne	P2RY1	56	45
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	DRD4	44	34
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	CCR3	36	49
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	RAF1	24	45
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	MTNR1A	42	42
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	MTNR1B	43	45
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	EPHX2	29	44
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	ACR	20	40
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	TAAR1	38	45
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	KCNK3	55	37
COc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820479	DE	On-Demand	Anodyne	KCNK9	47	37
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	DRD4	44	34
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	CCR3	36	49
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	RAF1	24	45
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	MTNR1A	42	42
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	MTNR1B	43	45
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	EPHX2	29	44
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	ACR	20	40
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	TAAR1	38	45
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	KCNK3	55	37
COc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820480	DE	On-Demand	Anodyne	KCNK9	47	37
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cc(F)ccc2F)C1	ZINC000853820485	CF	On-Demand	Anodyne	CCR3	31	44
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cc(F)ccc2F)C1	ZINC000853820485	CF	On-Demand	Anodyne	EPHX2	44	42
CC(C)(C)N1CC[C@H](NC(=O)Nc2cc(F)ccc2F)C1	ZINC000853820486	CF	On-Demand	Anodyne	CCR3	31	44
CC(C)(C)N1CC[C@H](NC(=O)Nc2cc(F)ccc2F)C1	ZINC000853820486	CF	On-Demand	Anodyne	EPHX2	44	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(N2CCOCC2)cn1	ZINC000853820500	GD	On-Demand	Anodyne	STAT6	64	36
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(N2CCOCC2)cn1	ZINC000853820501	GD	On-Demand	Anodyne	STAT6	64	36
O=C(NCCCCCCCN1CCCC1)N[C@H]1C=CCC1	ZINC000853820510	CG	On-Demand	Anodyne	CCR3	20	40
O=C(NCCCCCCCN1CCCC1)N[C@@H]1C=CCC1	ZINC000853820511	CG	On-Demand	Anodyne	CCR3	20	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc3c(c2)OCO3)C1	ZINC000853820515	DE	On-Demand	Anodyne	EPHX2	45	42
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc3c(c2)OCO3)C1	ZINC000853820515	DE	On-Demand	Anodyne	MCHR1	21	52
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc3c(c2)OCO3)C1	ZINC000853820516	DE	On-Demand	Anodyne	EPHX2	45	42
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc3c(c2)OCO3)C1	ZINC000853820516	DE	On-Demand	Anodyne	MCHR1	21	52
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1nc2c(s1)CCCC2	ZINC000853820517	FE	On-Demand	Anodyne	SLC27A1	32	42
O=C(NCC[S@](=O)CC(F)(F)F)Nc1nc2c(s1)CCCC2	ZINC000853820518	FE	On-Demand	Anodyne	SLC27A1	32	42
CC(C)(C)N1CC[C@H](NC(=O)Nc2cccc(Cl)c2Cl)C1	ZINC000853820519	EH	On-Demand	Anodyne	EPHX2	37	41
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cccc(Cl)c2Cl)C1	ZINC000853820520	EH	On-Demand	Anodyne	EPHX2	37	41
C[C@H]1C[C@H](NC(=O)Nc2ccccc2N2CCN(C)CC2)c2ncnn21	ZINC000853820550	FD	On-Demand	Anodyne	KCNQ2	70	37
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(C(=O)Nc2cccnc2Cl)C1	ZINC000853820552	FF	On-Demand	Anodyne	RBP4	53	33
COC(=O)[C@@H]1C[C@H](C(F)(F)F)CN(C(=O)Nc2cccnc2Cl)C1	ZINC000853820552	FF	On-Demand	Anodyne	G2YM83_BOTF4	52	34
CS(=O)(=O)CC1(CNC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853820562	GE	On-Demand	Reactive	CSNK1D	37	43
COc1cc(NCc2cccc(OC3CC3)c2F)c([N+](=O)[O-])cc1OC	ZINC000853820606	FH	On-Demand	Bother	PRKCQ	18	41
Fc1ncnc(NCc2cccc(OC3CC3)c2F)c1Br	ZINC000853820607	FH	On-Demand	Anodyne	SCN5A	41	35
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853820653	EG	On-Demand	Anodyne	KCNJ11	81	33
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853820653	EG	On-Demand	Anodyne	TRPV1	31	45
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853820653	EG	On-Demand	Anodyne	HDAH	18	41
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853820654	EG	On-Demand	Anodyne	KCNJ11	81	33
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853820654	EG	On-Demand	Anodyne	TRPV1	31	45
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853820654	EG	On-Demand	Anodyne	HDAH	18	41
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853820657	FE	On-Demand	Anodyne	KCNQ2	49	32
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853820657	FE	On-Demand	Anodyne	TRPV1	23	40
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853820657	FE	On-Demand	Anodyne	P2RY1	40	38
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853820658	FE	On-Demand	Anodyne	KCNQ2	49	32
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853820658	FE	On-Demand	Anodyne	TRPV1	23	40
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853820658	FE	On-Demand	Anodyne	P2RY1	40	38
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853820659	DE	On-Demand	Anodyne	CCR3	23	44
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853820659	DE	On-Demand	Anodyne	EPHX2	22	40
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853820660	DE	On-Demand	Anodyne	CCR3	23	44
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853820660	DE	On-Demand	Anodyne	EPHX2	22	40
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1nccs1	ZINC000853820679	DD	On-Demand	Anodyne	MAP1	112	36
O=C(NCC[S@](=O)CC(F)(F)F)Nc1nccs1	ZINC000853820680	DD	On-Demand	Anodyne	MAP1	112	36
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(Cl)c(Cl)c1	ZINC000853820681	FG	On-Demand	Anodyne	RAF1	27	42
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(Cl)c(Cl)c1	ZINC000853820681	FG	On-Demand	Anodyne	EPHX2	18	53
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(Cl)c(Cl)c1	ZINC000853820682	FG	On-Demand	Anodyne	RAF1	27	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(Cl)c(Cl)c1	ZINC000853820682	FG	On-Demand	Anodyne	EPHX2	18	53
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ncc(Cc2ccccc2)s1	ZINC000853820709	GG	On-Demand	Anodyne	CDK5	17	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ncc(Cc2ccccc2)s1	ZINC000853820709	GG	On-Demand	Anodyne	SCD	32	40
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ncc(Cc2ccccc2)s1	ZINC000853820710	GG	On-Demand	Anodyne	CDK5	17	42
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ncc(Cc2ccccc2)s1	ZINC000853820710	GG	On-Demand	Anodyne	SCD	32	40
Cc1cc(F)ccc1C[C@H](C)NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853820714	FH	On-Demand	Anodyne	CCR3	54	36
Cc1cc(F)ccc1C[C@@H](C)NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853820715	FH	On-Demand	Anodyne	CCR3	54	36
C[C@H]1CN(c2ccc(NC(=O)N[C@@H](CO)C3CCC3)cc2F)C[C@@H](C)O1	ZINC000853820722	FF	On-Demand	Anodyne	NPY2R	75	41
C[C@H]1CN(c2ccc(NC(=O)N[C@H](CO)C3CCC3)cc2F)C[C@@H](C)O1	ZINC000853820723	FF	On-Demand	Anodyne	NPY2R	75	41
O=C(N1C[C@H]2CC[C@@H](O)C[C@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853820753	FE	On-Demand	Bother	CACNA1D	42	32
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853820758	DD	On-Demand	Reactive	CCKAR	21	41
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)c1	ZINC000853820758	DD	On-Demand	Reactive	CCKBR	35	41
O=C(N1C[C@H]2CC[C@@H](O)C[C@H]2C1)C(F)(F)c1ccccc1F	ZINC000853820769	DF	On-Demand	Anodyne	RBP4	70	37
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccccc1OC(F)(F)F	ZINC000853820842	GG	On-Demand	Anodyne	P2RY1	57	39
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccccc1OC(F)(F)F	ZINC000853820843	GG	On-Demand	Anodyne	P2RY1	57	39
O=C(N[C@H](CO)C1CCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853820863	ED	On-Demand	Bother	CACNA1D	42	34
O=C(N[C@@H](CO)C1CCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853820864	ED	On-Demand	Bother	CACNA1D	42	34
CC(C)(C)OC(=O)C(C)(C)n1cc(Nc2cc(Cl)nc(N)n2)cn1	ZINC000853820876	FF	On-Demand	Anodyne	AGPAT2	59	36
CC(=O)Nc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820883	FE	On-Demand	Anodyne	CCR3	24	40
CC(=O)Nc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820883	FE	On-Demand	Anodyne	KCNK3	61	35
CC(=O)Nc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820883	FE	On-Demand	Anodyne	KCNK9	62	35
CC(=O)Nc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820884	FE	On-Demand	Anodyne	CCR3	24	40
CC(=O)Nc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820884	FE	On-Demand	Anodyne	KCNK3	61	35
CC(=O)Nc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820884	FE	On-Demand	Anodyne	KCNK9	62	35
N#Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820888	DD	On-Demand	Mild	CCR3	31	50
N#Cc1cccc(NC(=O)NCC[S@](=O)CC(F)(F)F)c1	ZINC000853820888	DD	On-Demand	Mild	MCHR1	19	42
N#Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820889	DD	On-Demand	Mild	CCR3	31	50
N#Cc1cccc(NC(=O)NCC[S@@](=O)CC(F)(F)F)c1	ZINC000853820889	DD	On-Demand	Mild	MCHR1	19	42
O=C(NCCCCCCCN1CCCC1)N1CCC(c2ccco2)CC1	ZINC000853820906	FI	On-Demand	Anodyne	DRD3	41	39
O=C(NCCCCCCCN1CCCC1)N1CCC(c2ccco2)CC1	ZINC000853820906	FI	On-Demand	Anodyne	HTR4	20	40
O=C(NCCCCCCCN1CCCC1)N1CCC(c2ccco2)CC1	ZINC000853820906	FI	On-Demand	Anodyne	HNMT	40	35
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccc(Cl)c1	ZINC000853820919	EF	On-Demand	Anodyne	EPHX2	19	50
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccc(Cl)c1	ZINC000853820920	EF	On-Demand	Anodyne	EPHX2	19	50
O=C(N1CCCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853820932	ED	On-Demand	Anodyne	SIGMAR1	32	40
O=C(N1CCCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853820932	ED	On-Demand	Anodyne	PREP	39	42
O=C(N1CCCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853820932	ED	On-Demand	Anodyne	LIPE	28	43
O=C(N1CCCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853820932	ED	On-Demand	Anodyne	DPP7	46	39
O=C(N1CCCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853820932	ED	On-Demand	Anodyne	SAP2	46	49
O=C(N1CCCCC1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1	ZINC000853820987	EE	On-Demand	Anodyne	DPP7	40	37
O=C(N1CCCCC1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1	ZINC000853820987	EE	On-Demand	Anodyne	SAP2	25	42
O=[N+]([O-])c1ccc(NCCO[C@@H]2CC2(F)F)c2nonc12	ZINC000853820990	DD	On-Demand	Bother	GSTM2	111	41
O=[N+]([O-])c1ccc(NCCO[C@@H]2CC2(F)F)c2nonc12	ZINC000853820990	DD	On-Demand	Bother	GSTP1	68	41
O=[N+]([O-])c1ccc(NCCO[C@@H]2CC2(F)F)c2nonc12	ZINC000853820990	DD	On-Demand	Bother	EPAS1	47	31
O=[N+]([O-])c1ccc(NCCO[C@H]2CC2(F)F)c2nonc12	ZINC000853820991	DD	On-Demand	Bother	GSTM2	111	41
O=[N+]([O-])c1ccc(NCCO[C@H]2CC2(F)F)c2nonc12	ZINC000853820991	DD	On-Demand	Bother	GSTP1	68	41
O=[N+]([O-])c1ccc(NCCO[C@H]2CC2(F)F)c2nonc12	ZINC000853820991	DD	On-Demand	Bother	EPAS1	47	31
Cn1nc(Br)c2c(NCc3cccc(OC4CC4)c3F)ncnc21	ZINC000853820995	GG	On-Demand	Anodyne	SCN5A	40	34
O=C(NNC(=O)[C@@H]1CN2CCC[C@@H]2CO1)Nc1cccnc1	ZINC000853821016	DC	On-Demand	Reactive	MTOR	20	41
FC1(F)C[C@@H]1OCCNc1nc(-c2cccnc2)nc2ccccc12	ZINC000853821023	EH	On-Demand	Anodyne	PKN2	16	40
FC1(F)C[C@H]1OCCNc1nc(-c2cccnc2)nc2ccccc12	ZINC000853821024	EH	On-Demand	Anodyne	PKN2	16	40
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(-n3cccn3)c(F)c2)C1	ZINC000853821033	EG	On-Demand	Anodyne	NPY2R	58	35
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(-n3cccn3)c(F)c2)C1	ZINC000853821033	EG	On-Demand	Anodyne	CCKBR	55	35
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(-n3cccn3)c(F)c2)C1	ZINC000853821033	EG	On-Demand	Anodyne	EPHX2	44	38
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(-n3cccn3)c(F)c2)C1	ZINC000853821034	EG	On-Demand	Anodyne	NPY2R	58	35
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(-n3cccn3)c(F)c2)C1	ZINC000853821034	EG	On-Demand	Anodyne	CCKBR	55	35
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(-n3cccn3)c(F)c2)C1	ZINC000853821034	EG	On-Demand	Anodyne	EPHX2	44	38
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ncc(-c2ccccc2)s1	ZINC000853821035	GG	On-Demand	Anodyne	ADRB1	40	31
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ncc(-c2ccccc2)s1	ZINC000853821036	GG	On-Demand	Anodyne	ADRB1	40	31
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc3oc(=O)ccc3c2)C1	ZINC000853821040	EF	On-Demand	Anodyne	EPHX2	43	38
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc3oc(=O)ccc3c2)C1	ZINC000853821041	EF	On-Demand	Anodyne	EPHX2	43	38
CC(C)(C)N1CC[C@@H](NC(=O)C(F)(F)c2ccccc2F)C1	ZINC000853821047	DF	On-Demand	Anodyne	RBP4	46	32
CC(C)(C)N1CC[C@@H](NC(=O)C(F)(F)c2ccccc2F)C1	ZINC000853821047	DF	On-Demand	Anodyne	SFRP1	47	31
CC(C)(C)N1CC[C@H](NC(=O)C(F)(F)c2ccccc2F)C1	ZINC000853821048	DF	On-Demand	Anodyne	RBP4	46	32
CC(C)(C)N1CC[C@H](NC(=O)C(F)(F)c2ccccc2F)C1	ZINC000853821048	DF	On-Demand	Anodyne	SFRP1	47	31
O=C(NCCCCCCCN1CCCC1)N1CCC(n2cnnc2O)CC1	ZINC000853821069	GE	On-Demand	Anodyne	L3MBTL3	15	44
Cc1cc(N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)nc(N)n1	ZINC000853821070	DF	On-Demand	Anodyne	KCNH2	41	39
CC(C)(C)N1CC[C@H](NC(=O)Nc2cnc(-c3ccccc3)nc2)C1	ZINC000853821077	EG	On-Demand	Anodyne	MTOR	39	40
CC(C)(C)N1CC[C@H](NC(=O)Nc2cnc(-c3ccccc3)nc2)C1	ZINC000853821077	EG	On-Demand	Anodyne	EPHX2	46	39
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cnc(-c3ccccc3)nc2)C1	ZINC000853821078	EG	On-Demand	Anodyne	MTOR	39	40
CC(C)(C)N1CC[C@@H](NC(=O)Nc2cnc(-c3ccccc3)nc2)C1	ZINC000853821078	EG	On-Demand	Anodyne	EPHX2	46	39
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccccc2OC(F)(F)F)C1	ZINC000853821079	EH	On-Demand	Anodyne	P2RY1	77	46
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccccc2OC(F)(F)F)C1	ZINC000853821079	EH	On-Demand	Anodyne	CCR3	15	45
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccccc2OC(F)(F)F)C1	ZINC000853821079	EH	On-Demand	Anodyne	EPHX2	49	43
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccccc2OC(F)(F)F)C1	ZINC000853821080	EH	On-Demand	Anodyne	P2RY1	77	46
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccccc2OC(F)(F)F)C1	ZINC000853821080	EH	On-Demand	Anodyne	CCR3	15	45
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccccc2OC(F)(F)F)C1	ZINC000853821080	EH	On-Demand	Anodyne	EPHX2	49	43
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853821081	EF	On-Demand	Anodyne	EPHX2	23	41
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853821082	EF	On-Demand	Anodyne	EPHX2	23	41
CC(=O)c1ccc(N2C[C@@H](C)C(=O)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000853821084	CE	On-Demand	Bother	TAAR1	18	44
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(N2CCCC2)nc1	ZINC000853821103	FE	On-Demand	Anodyne	DGAT1	37	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(N2CCCC2)nc1	ZINC000853821104	FE	On-Demand	Anodyne	DGAT1	37	42
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(Cl)cn2)C1	ZINC000853821105	CF	On-Demand	Anodyne	F10	48	33
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(Cl)cn2)C1	ZINC000853821106	CF	On-Demand	Anodyne	F10	48	33
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccc2cccnc12	ZINC000853821112	EF	On-Demand	Anodyne	TRPV1	17	45
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccc2cccnc12	ZINC000853821113	EF	On-Demand	Anodyne	TRPV1	17	45
O=C(NCCCCCCCN1CCCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853821116	FG	On-Demand	Anodyne	CPT1A	61	34
O=C(NCCCCCCCN1CCCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853821117	FG	On-Demand	Anodyne	CPT1A	61	34
Cc1nc(NC(=O)N[C@H]2C[C@H](C)n3ncnc32)sc1-c1ccccc1	ZINC000853821137	FH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2C[C@H](C)n3ncnc32)sc1-c1ccccc1	ZINC000853821138	FH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@H]2C[C@@H](C)n3ncnc32)sc1-c1ccccc1	ZINC000853821139	FH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2C[C@@H](C)n3ncnc32)sc1-c1ccccc1	ZINC000853821140	FH	On-Demand	Anodyne	PIK3CG	19	40
O=C(N1CCCC1)N1C[C@@H]2OCCN(Cc3ccccc3)[C@@H]2C1	ZINC000853821165	DD	On-Demand	Anodyne	SAP2	24	40
Nc1ccc(NCc2cccc(OC3CC3)c2F)c([N+](=O)[O-])c1	ZINC000853821187	DG	On-Demand	Bother	PRKCQ	24	43
Nc1ccc([N+](=O)[O-])c(NCc2cccc(OC3CC3)c2F)c1	ZINC000853821189	DG	On-Demand	Bother	PRKCQ	24	43
O=C1[C@@H]2CN(C(=O)n3ccnc3)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853821191	DC	On-Demand	Anodyne	CYP11B1	16	40
O=C1[C@@H]2CN(C(=O)n3ccnc3)C[C@@H]2C(=O)N1Cc1ccccc1	ZINC000853821191	DC	On-Demand	Anodyne	TBXAS1	17	40
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cc1	ZINC000853821220	GB	On-Demand	Reactive	CA2	44	46
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cc1	ZINC000853821220	GB	On-Demand	Reactive	CA1	41	42
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cc1	ZINC000853821220	GB	On-Demand	Reactive	CA4	33	42
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cc1	ZINC000853821220	GB	On-Demand	Reactive	CA12	36	46
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cc1	ZINC000853821220	GB	On-Demand	Reactive	CA9	39	46
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cc1	ZINC000853821220	GB	On-Demand	Reactive	MTCA1	48	46
NS(=O)(=O)c1ccc(NC(=O)NNC(=O)[C@@H]2CN3CCC[C@@H]3CO2)cc1	ZINC000853821220	GB	On-Demand	Reactive	P96878_MYCTU	61	46
COc1ccccc1NC(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000853821227	CF	On-Demand	Anodyne	DRD2	15	53
COc1ccccc1NC(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000853821227	CF	On-Demand	Anodyne	HTR4	17	42
COc1ccccc1NC(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000853821227	CF	On-Demand	Anodyne	CCR3	20	47
COc1ccccc1NC(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000853821228	CF	On-Demand	Anodyne	DRD2	15	53
COc1ccccc1NC(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000853821228	CF	On-Demand	Anodyne	HTR4	17	42
COc1ccccc1NC(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000853821228	CF	On-Demand	Anodyne	CCR3	20	47
CC(C)(C)N1CC[C@H](NC(=O)Nc2ccc(N3CCOCC3)cn2)C1	ZINC000853821237	ED	On-Demand	Anodyne	STAT6	54	33
CC(C)(C)N1CC[C@@H](NC(=O)Nc2ccc(N3CCOCC3)cn2)C1	ZINC000853821238	ED	On-Demand	Anodyne	STAT6	54	33
O=C(NCC[S@](=O)CC(F)(F)F)Nc1cccnc1Cl	ZINC000853821239	EE	On-Demand	Anodyne	G2YM83_BOTF4	57	33
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1cccnc1Cl	ZINC000853821240	EE	On-Demand	Anodyne	G2YM83_BOTF4	57	33
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1nc2c(s1)CCCCC2	ZINC000853821241	FF	On-Demand	Anodyne	SLC27A1	31	42
O=C(NCC[S@](=O)CC(F)(F)F)Nc1nc2c(s1)CCCCC2	ZINC000853821242	FF	On-Demand	Anodyne	SLC27A1	31	42
O=C(NCC[S@](=O)CC(F)(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853821245	EF	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853821246	EF	On-Demand	Anodyne	EPHX2	17	43
O=C(NCC[S@](=O)CC(F)(F)F)Nc1nc2c(s1)CCC2	ZINC000853821255	EE	On-Demand	Anodyne	SLC27A1	31	42
O=C(NCC[S@@](=O)CC(F)(F)F)Nc1nc2c(s1)CCC2	ZINC000853821256	EE	On-Demand	Anodyne	SLC27A1	31	42
O=C(N1CCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853821309	ED	On-Demand	Anodyne	PREP	43	43
O=C(N1CCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853821309	ED	On-Demand	Anodyne	LIPE	16	42
O=C(N1CCCC1)N1C[C@H]2C(=O)N(Cc3ccccc3)C(=O)[C@H]2C1	ZINC000853821309	ED	On-Demand	Anodyne	SAP2	37	47
CN1CCN(c2ccccc2NC(=O)N2CCCC3(CCCC3)CC2)CC1	ZINC000853821345	FI	On-Demand	Anodyne	HTR1B	15	45
CN1CCN(c2ccccc2NC(=O)N2CCCC3(CCCC3)CC2)CC1	ZINC000853821345	FI	On-Demand	Anodyne	KCNQ2	77	41
CN1CCN(c2ccccc2NC(=O)N2CCCC3(CCCC3)CC2)CC1	ZINC000853821345	FI	On-Demand	Anodyne	RBP4	24	40
CON(C)CCNC(=O)NC1CCN(C2CCCC2)CC1	ZINC000853821373	CD	On-Demand	Anodyne	EPHX2	18	45
CC(C)(C)OC(=O)C(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853821402	CE	On-Demand	Mild	IMDH_CRYPV	43	33
CCn1cc(CNc2ccnc3cc(OC)ccc23)nn1	ZINC000853821412	CE	On-Demand	Anodyne	PDGFRB	30	44
CCn1cc(CNc2ccnc3cc(OC)ccc23)nn1	ZINC000853821412	CE	On-Demand	Anodyne	HRP1_PLAFA	103	43
CCn1cc(CNc2ccnc3cc(OC)ccc23)nn1	ZINC000853821412	CE	On-Demand	Anodyne	HNMT	56	34
CC[C@@H](CNC(=O)NCCN(C)OC)Oc1ccccc1Cl	ZINC000853821421	EE	On-Demand	Anodyne	PDS	29	41
C=CCN(C(=O)Nc1cccnc1Cl)[C@@H](C)COC	ZINC000853821428	CF	On-Demand	Mild	G2YM83_BOTF4	65	33
C=CCN(C(=O)Nc1cccnc1Cl)[C@H](C)COC	ZINC000853821429	CF	On-Demand	Mild	G2YM83_BOTF4	65	33
CC(C)(C)OC(=O)NC1(CNc2ccc(S(C)(=O)=O)cc2)CCCC1	ZINC000853821457	FG	On-Demand	Anodyne	GPR119	22	41
O=C(NCCC1CCN(CC(F)(F)F)CC1)NNC(=O)c1cccc(F)n1	ZINC000853821465	GD	On-Demand	Reactive	HPGDS	37	44
CCC(C)(C)[C@@H](C)NC(=O)Nc1cccnc1Cl	ZINC000853821473	CH	On-Demand	Anodyne	G2YM83_BOTF4	73	38
Cn1cnc2c(NCC3(NC(=O)OC(C)(C)C)CCCC3)ncnc21	ZINC000853821501	EF	On-Demand	Anodyne	ADORA1	17	43
CC(C)(C)OC(=O)NC1(CNc2ccc(S(N)(=O)=O)cc2C#N)CCCC1	ZINC000853821509	GE	On-Demand	Mild	CA2	17	40
CC(C)(C)OC(=O)NC1(CNc2ccc(S(N)(=O)=O)cc2C#N)CCCC1	ZINC000853821509	GE	On-Demand	Mild	CA1	18	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCC(C)(C)S(C)(=O)=O	ZINC000853821537	GD	On-Demand	Anodyne	GPR119	31	43
Cc1nc(NC(=O)NC(C)(C)c2cccc(C#N)c2)sc1C	ZINC000853821546	DH	On-Demand	Mild	IMDH_CRYPV	62	38
C=CCN(C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@@H](C)COC	ZINC000853821635	GG	On-Demand	Mild	NPY2R	70	35
C=CCN(C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@@H](C)COC	ZINC000853821637	GG	On-Demand	Mild	NPY2R	70	35
O=C(NCc1cccnc1N1CCCC1)c1nc(Br)cs1	ZINC000853821638	FF	On-Demand	Anodyne	SCN2A	20	48
O=C(NCc1cccnc1N1CCCC1)c1nc(Br)cs1	ZINC000853821638	FF	On-Demand	Anodyne	SCN10A	33	51
C=CCN(C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)[C@H](C)COC	ZINC000853821640	GG	On-Demand	Mild	NPY2R	70	35
C=CCN(C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)[C@H](C)COC	ZINC000853821642	GG	On-Demand	Mild	NPY2R	70	35
CN1CCN(c2ccccc2NC(=O)NC(C)(C)c2cccc(C#N)c2)CC1	ZINC000853821650	GG	On-Demand	Mild	DRD1	19	41
CN1CCN(c2ccccc2NC(=O)NC(C)(C)c2cccc(C#N)c2)CC1	ZINC000853821650	GG	On-Demand	Mild	KCNQ2	73	41
CN1CCN(c2ccccc2NC(=O)NC(C)(C)c2cccc(C#N)c2)CC1	ZINC000853821650	GG	On-Demand	Mild	IMDH_CRYPV	58	35
O=C(NCc1cccnc1N1CCCC1)Nc1ccc(Cl)nc1	ZINC000853821660	EG	On-Demand	Anodyne	TRPV1	23	44
O=C(NCc1cccnc1N1CCCC1)Nc1ccc(Cl)nc1	ZINC000853821660	EG	On-Demand	Anodyne	P2RX7	18	44
O=C(NCc1cccnc1N1CCCC1)Nc1ccc(Cl)nc1	ZINC000853821660	EG	On-Demand	Anodyne	SCN2A	21	51
O=C(NCc1cccnc1N1CCCC1)Nc1ccc(Cl)nc1	ZINC000853821660	EG	On-Demand	Anodyne	SCN10A	35	51
O=C(NCc1cccnc1N1CCCC1)Nc1ccc(Cl)nc1	ZINC000853821660	EG	On-Demand	Anodyne	NAMPT	53	48
COCCn1cc(NC(=O)NNc2cc(F)ccc2C)cn1	ZINC000853821663	DE	On-Demand	Reactive	P2RX7	21	41
Cc1nc(C(=O)NCc2cccnc2N2CCCC2)no1	ZINC000853821675	CD	On-Demand	Anodyne	SCN2A	20	48
Cc1nc(C(=O)NCc2cccnc2N2CCCC2)no1	ZINC000853821675	CD	On-Demand	Anodyne	SCN10A	35	51
O=C(NCc1cccnc1N1CCCC1)Nc1cccnc1Cl	ZINC000853821681	EG	On-Demand	Anodyne	KCNQ2	72	44
O=C(NCc1cccnc1N1CCCC1)Nc1cccnc1Cl	ZINC000853821681	EG	On-Demand	Anodyne	TRPV1	26	48
O=C(NCc1cccnc1N1CCCC1)Nc1cccnc1Cl	ZINC000853821681	EG	On-Demand	Anodyne	P2RX7	19	44
O=C(NCc1cccnc1N1CCCC1)Nc1cccnc1Cl	ZINC000853821681	EG	On-Demand	Anodyne	SCN2A	21	52
O=C(NCc1cccnc1N1CCCC1)Nc1cccnc1Cl	ZINC000853821681	EG	On-Demand	Anodyne	SCN10A	33	52
O=C(NCc1cccnc1N1CCCC1)Nc1cccnc1Cl	ZINC000853821681	EG	On-Demand	Anodyne	G2YM83_BOTF4	71	35
C=CCN(C(=O)Nc1ncc(Cc2cccc(OC)c2)s1)[C@@H](C)COC	ZINC000853821693	GH	On-Demand	Mild	SCD1	38	42
C=CCN(C(=O)Nc1ncc(Cc2cccc(OC)c2)s1)[C@@H](C)COC	ZINC000853821693	GH	On-Demand	Mild	SCD	37	46
C=CCN(C(=O)Nc1ncc(Cc2cccc(OC)c2)s1)[C@H](C)COC	ZINC000853821696	GH	On-Demand	Mild	SCD1	38	42
C=CCN(C(=O)Nc1ncc(Cc2cccc(OC)c2)s1)[C@H](C)COC	ZINC000853821696	GH	On-Demand	Mild	SCD	37	46
COC(=O)c1cccc(NCCc2ccc(C)c(C)c2)n1	ZINC000853821711	CG	On-Demand	Anodyne	PTGDR	28	40
COc1cc(C)c(C)cc1NC(=O)N1CCCCC1	ZINC000853821728	CG	On-Demand	Anodyne	RBP4	28	48
CC(C)(C)OC(=O)NC1(CNc2cnc(C#N)cn2)CCCC1	ZINC000853821750	DF	On-Demand	Mild	CHEK1	17	41
CC(C)(C)OC(=O)NC1(CNc2ccc(C(=O)NC3CC3)cn2)CCCC1	ZINC000853821751	FG	On-Demand	Anodyne	MAPK11	18	40
CC(C)(C)OC(=O)NC1(CNc2ccc(C(=O)NC3CC3)cn2)CCCC1	ZINC000853821751	FG	On-Demand	Anodyne	MAPK14	20	40
O=C(NCc1cccnc1N1CCCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853821796	GF	On-Demand	Bother	SCN2A	16	40
O=C(NCc1cccnc1N1CCCC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853821796	GF	On-Demand	Bother	SCN10A	23	40
CN1CCN(c2ccccc2NC(=O)N2CCc3ccccc3C(C)(C)C2)CC1	ZINC000853821820	GH	On-Demand	Anodyne	KCNQ2	72	39
Cn1ccnc1C(=O)NCc1cccnc1N1CCCC1	ZINC000853821822	CD	On-Demand	Anodyne	SCN2A	21	51
Cn1ccnc1C(=O)NCc1cccnc1N1CCCC1	ZINC000853821822	CD	On-Demand	Anodyne	SCN10A	30	51
CCC(C)(C)[C@@H](C)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853821891	EG	On-Demand	Anodyne	MC4R	39	40
CCC(C)(C)[C@@H](C)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853821891	EG	On-Demand	Anodyne	KCNQ2	88	46
CC(C)(C)OC(=O)NC1(CNc2nccc(N3CCOCC3)n2)CCCC1	ZINC000853821902	GF	On-Demand	Anodyne	EPHB4	62	35
CC(C)c1ccc2c(c1)CN(C(=O)Nc1cccnc1Cl)CC2	ZINC000853821936	EI	On-Demand	Anodyne	MAPK1	51	36
CC(C)c1ccc2c(c1)CN(C(=O)Nc1cccnc1Cl)CC2	ZINC000853821936	EI	On-Demand	Anodyne	G2YM83_BOTF4	62	35
CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](Nc2cc(C#N)cnn2)C1	ZINC000853821937	GH	On-Demand	Mild	GPR119	41	43
C#CCNC(=O)c1ccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1	ZINC000853821949	FF	On-Demand	Mild	CACNA1I	58	35
C#CCNC(=O)c1ccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1	ZINC000853821949	FF	On-Demand	Mild	SIRT3	40	34
C#CCNC(=O)c1ccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1	ZINC000853821949	FF	On-Demand	Mild	SIRT1	40	34
C#CCNC(=O)c1ccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1	ZINC000853821949	FF	On-Demand	Mild	SCD1	15	40
C#CCNC(=O)c1ccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1	ZINC000853821949	FF	On-Demand	Mild	HPGDS	21	42
C#Cc1cccnc1N1CCC(CCC(=O)OC(C)(C)C)CC1	ZINC000853821955	DG	On-Demand	Mild	SIRT3	53	36
C#Cc1cccnc1N1CCC(CCC(=O)OC(C)(C)C)CC1	ZINC000853821955	DG	On-Demand	Mild	SIRT2	47	36
C#Cc1cccnc1N1CCC(CCC(=O)OC(C)(C)C)CC1	ZINC000853821955	DG	On-Demand	Mild	SIRT1	50	35
C#Cc1cccnc1N1CCC(CCC(=O)OC(C)(C)C)CC1	ZINC000853821955	DG	On-Demand	Mild	GPR119	18	40
COC(=O)c1sc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1Cl	ZINC000853821961	GH	On-Demand	Anodyne	PARE	51	32
CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](Nc2cc(C#N)cnn2)C1	ZINC000853821962	GH	On-Demand	Mild	GPR119	41	42
C#Cc1cnc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1	ZINC000853821967	DF	On-Demand	Mild	SIRT3	47	38
C#Cc1cnc(N2CCC(CCC(=O)OC(C)(C)C)CC2)nc1	ZINC000853821967	DF	On-Demand	Mild	GPR119	28	42
CC(C)(C)OC(=O)CCC1CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000853821986	EF	On-Demand	Anodyne	SIRT3	68	42
CC(C)(C)OC(=O)CCC1CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000853821986	EF	On-Demand	Anodyne	SIRT2	58	42
CC(C)(C)OC(=O)CCC1CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000853821986	EF	On-Demand	Anodyne	SIRT1	57	42
CC(C)(C)OC(=O)CCC1CCN(c2ccnc(C(N)=O)c2)CC1	ZINC000853821986	EF	On-Demand	Anodyne	GPR119	24	42
CCn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)Nc1cccnc1Cl	ZINC000853822012	FG	On-Demand	Anodyne	G2YM83_BOTF4	65	35
O=C(NCc1cccnc1N1CCCC1)C(F)(F)c1ccccc1F	ZINC000853822070	EG	On-Demand	Anodyne	TRPV1	38	40
O=C(NCc1cccnc1N1CCCC1)C(F)(F)c1ccccc1F	ZINC000853822070	EG	On-Demand	Anodyne	SCN2A	19	46
O=C(NCc1cccnc1N1CCCC1)C(F)(F)c1ccccc1F	ZINC000853822070	EG	On-Demand	Anodyne	SCN10A	34	46
O=C(NCc1cccnc1N1CCCC1)n1ccnc1	ZINC000853822072	CD	On-Demand	Anodyne	TRPV1	16	40
O=C(NCc1cccnc1N1CCCC1)n1ccnc1	ZINC000853822072	CD	On-Demand	Anodyne	SCN2A	21	52
O=C(NCc1cccnc1N1CCCC1)n1ccnc1	ZINC000853822072	CD	On-Demand	Anodyne	SCN10A	33	52
CN1CCN(c2ccccc2NC(=O)NCc2cccnc2N2CCCC2)CC1	ZINC000853822096	GF	On-Demand	Anodyne	KCNQ2	93	50
CN1CCN(c2ccccc2NC(=O)NCc2cccnc2N2CCCC2)CC1	ZINC000853822096	GF	On-Demand	Anodyne	TRPV1	25	46
CN1CCN(c2ccccc2NC(=O)NCc2cccnc2N2CCCC2)CC1	ZINC000853822096	GF	On-Demand	Anodyne	P2RY1	33	40
CN1CCN(c2ccccc2NC(=O)NCc2cccnc2N2CCCC2)CC1	ZINC000853822096	GF	On-Demand	Anodyne	SCN2A	20	45
CN1CCN(c2ccccc2NC(=O)NCc2cccnc2N2CCCC2)CC1	ZINC000853822096	GF	On-Demand	Anodyne	SCN10A	22	45
CN1CCN(c2ccccc2NC(=O)NCc2cccnc2N2CCCC2)CC1	ZINC000853822096	GF	On-Demand	Anodyne	CSF1R	17	45
CN1CCN(c2ccccc2NC(=O)NNC(=O)c2cc[nH]n2)CC1	ZINC000853822120	EC	On-Demand	Reactive	KCNQ2	73	39
CN1CCN(c2ccccc2NC(=O)NNC(=O)c2cc[nH]n2)CC1	ZINC000853822120	EC	On-Demand	Reactive	CHEK1	15	50
CC(C)(C)OC(=O)NC1(CNc2ncnc3[nH]ccc23)CCCC1	ZINC000853822154	EG	On-Demand	Anodyne	JAK1	17	41
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ncccn1	ZINC000853822166	ED	On-Demand	Anodyne	SIRT3	55	35
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ncccn1	ZINC000853822166	ED	On-Demand	Anodyne	SIRT2	54	34
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ncccn1	ZINC000853822166	ED	On-Demand	Anodyne	SIRT1	53	35
O=C(NCCC1CCN(CC(F)(F)F)CC1)NCc1ncccn1	ZINC000853822166	ED	On-Demand	Anodyne	HPGDS	37	41
C=CCN(C(=O)Nc1ccccc1N1CCN(C)CC1)[C@@H](C)COC	ZINC000853822193	EE	On-Demand	Mild	KCNQ2	76	41
C=CCN(C(=O)Nc1ccccc1N1CCN(C)CC1)[C@H](C)COC	ZINC000853822194	EE	On-Demand	Mild	KCNQ2	76	41
CC(C)(C)OC(=O)NC1(CNc2ncnc3c2ncn3C2CC2)CCCC1	ZINC000853822210	FG	On-Demand	Anodyne	ADORA1	63	43
CC(C)(C)OC(=O)NC1(CNc2ncnc3c2ncn3C2CC2)CCCC1	ZINC000853822210	FG	On-Demand	Anodyne	ADORA3	81	39
CC(C)(C)OC(=O)NC1(CNc2ncnc3c2ncn3C2CC2)CCCC1	ZINC000853822210	FG	On-Demand	Anodyne	OXGR1	47	33
CC(C)(C)OC(=O)NC1(CNc2ncnc3c2ncn3C2CC2)CCCC1	ZINC000853822210	FG	On-Demand	Anodyne	Q4VQ11_PIG	43	37
Cc1cc(C(F)(F)F)c(N2CCC(CCC(=O)OC(C)(C)C)CC2)nn1	ZINC000853822255	FI	On-Demand	Anodyne	SIRT3	65	40
Cc1cc(C(F)(F)F)c(N2CCC(CCC(=O)OC(C)(C)C)CC2)nn1	ZINC000853822255	FI	On-Demand	Anodyne	SIRT2	56	40
Cc1cc(C(F)(F)F)c(N2CCC(CCC(=O)OC(C)(C)C)CC2)nn1	ZINC000853822255	FI	On-Demand	Anodyne	SIRT1	54	40
CC(C)(C)OC(=O)CCC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853822271	GH	On-Demand	Anodyne	SIRT3	70	45
CC(C)(C)OC(=O)CCC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853822271	GH	On-Demand	Anodyne	SIRT2	62	45
CC(C)(C)OC(=O)CCC1CCN(c2ncnc(F)c2Br)CC1	ZINC000853822271	GH	On-Demand	Anodyne	SIRT1	59	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853822284	FF	On-Demand	Anodyne	EPHX2	28	43
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853822286	FF	On-Demand	Anodyne	EPHX2	28	43
CC(=O)c1ccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1	ZINC000853822293	GI	On-Demand	Bother	TAAR1	15	46
CC(=O)c1ccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)c([N+](=O)[O-])c1	ZINC000853822293	GI	On-Demand	Bother	GPR119	15	42
CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](Nc2ccc3nnnn3n2)C1	ZINC000853822302	GF	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)CCC1CCN(c2ncnc3c2cnn3C(C)(C)C)CC1	ZINC000853822321	GH	On-Demand	Anodyne	SIRT3	72	43
CC(C)(C)OC(=O)CCC1CCN(c2ncnc3c2cnn3C(C)(C)C)CC1	ZINC000853822321	GH	On-Demand	Anodyne	SIRT2	62	43
CC(C)(C)OC(=O)CCC1CCN(c2ncnc3c2cnn3C(C)(C)C)CC1	ZINC000853822321	GH	On-Demand	Anodyne	SIRT1	56	43
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822326	FF	On-Demand	Anodyne	SLC18A2	25	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822326	FF	On-Demand	Anodyne	SIGMAR1	18	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822326	FF	On-Demand	Anodyne	PREP	46	36
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822326	FF	On-Demand	Anodyne	EPHX2	26	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822326	FF	On-Demand	Anodyne	BIRC2	44	39
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822328	FF	On-Demand	Anodyne	SLC18A2	25	40
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822328	FF	On-Demand	Anodyne	SIGMAR1	18	40
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822328	FF	On-Demand	Anodyne	PREP	46	36
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822328	FF	On-Demand	Anodyne	EPHX2	26	40
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](N(C)CCc3ccccc3)C2)C1	ZINC000853822328	FF	On-Demand	Anodyne	BIRC2	44	39
CN1CCN(c2ccccc2NC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822336	GE	On-Demand	Anodyne	KCNQ2	75	40
CN1CCN(c2ccccc2NC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822336	GE	On-Demand	Anodyne	CCKAR	35	40
CN1CCN(c2ccccc2NC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822336	GE	On-Demand	Anodyne	PYGL	34	50
CN1CCN(c2ccccc2NC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822336	GE	On-Demand	Anodyne	PYGM	32	50
CN1CCN(c2ccccc2NC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822336	GE	On-Demand	Anodyne	CCKBR	40	43
CN1CCN(c2ccccc2NC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822337	GE	On-Demand	Anodyne	KCNQ2	75	40
CN1CCN(c2ccccc2NC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822337	GE	On-Demand	Anodyne	CCKAR	35	40
CN1CCN(c2ccccc2NC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822337	GE	On-Demand	Anodyne	PYGL	34	50
CN1CCN(c2ccccc2NC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822337	GE	On-Demand	Anodyne	PYGM	32	50
CN1CCN(c2ccccc2NC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)CC1	ZINC000853822337	GE	On-Demand	Anodyne	CCKBR	40	43
O=C(NNC(=O)c1cc[nH]n1)Nc1nc2c(s1)CCC2	ZINC000853822352	CC	On-Demand	Reactive	SLC27A1	31	42
CC(C)(C)OC(=O)C(=O)NCc1cccnc1N1CCCC1	ZINC000853822379	DD	On-Demand	Anodyne	KCNQ2	47	34
CC(C)(C)OC(=O)C(=O)NCc1cccnc1N1CCCC1	ZINC000853822379	DD	On-Demand	Anodyne	SCN2A	20	48
CC(C)(C)OC(=O)C(=O)NCc1cccnc1N1CCCC1	ZINC000853822379	DD	On-Demand	Anodyne	SCN10A	35	48
O=C(NNC(=O)c1cc[nH]n1)Nc1ccc(N2CCOCC2)cn1	ZINC000853822384	EC	On-Demand	Reactive	STAT6	52	33
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822445	ED	On-Demand	Anodyne	DRD4	44	54
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822445	ED	On-Demand	Anodyne	ACHE	36	43
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822445	ED	On-Demand	Anodyne	DRD3	15	54
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822445	ED	On-Demand	Anodyne	SIGMAR1	40	44
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822445	ED	On-Demand	Anodyne	MCHR1	24	48
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822446	ED	On-Demand	Anodyne	DRD4	44	54
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822446	ED	On-Demand	Anodyne	ACHE	36	43
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822446	ED	On-Demand	Anodyne	DRD3	15	54
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822446	ED	On-Demand	Anodyne	SIGMAR1	40	44
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822446	ED	On-Demand	Anodyne	MCHR1	24	48
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822447	ED	On-Demand	Anodyne	DRD4	44	54
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822447	ED	On-Demand	Anodyne	ACHE	36	43
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822447	ED	On-Demand	Anodyne	DRD3	15	54
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822447	ED	On-Demand	Anodyne	SIGMAR1	40	44
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822447	ED	On-Demand	Anodyne	MCHR1	24	48
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822448	ED	On-Demand	Anodyne	DRD4	44	54
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822448	ED	On-Demand	Anodyne	ACHE	36	43
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822448	ED	On-Demand	Anodyne	DRD3	15	54
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822448	ED	On-Demand	Anodyne	SIGMAR1	40	44
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822448	ED	On-Demand	Anodyne	MCHR1	24	48
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853822451	EF	On-Demand	Anodyne	SIGMAR1	21	43
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853822451	EF	On-Demand	Anodyne	SLC18A3	20	40
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853822451	EF	On-Demand	Anodyne	EPHX2	28	42
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853822451	EF	On-Demand	Anodyne	L3MBTL3	42	35
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853822452	EF	On-Demand	Anodyne	SIGMAR1	21	43
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853822452	EF	On-Demand	Anodyne	SLC18A3	20	40
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853822452	EF	On-Demand	Anodyne	EPHX2	28	42
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853822452	EF	On-Demand	Anodyne	L3MBTL3	42	35
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853822453	EF	On-Demand	Anodyne	SIGMAR1	21	43
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853822453	EF	On-Demand	Anodyne	SLC18A3	20	40
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853822453	EF	On-Demand	Anodyne	EPHX2	28	42
O=C(NC1CCN(C2CCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853822453	EF	On-Demand	Anodyne	L3MBTL3	42	35
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853822454	EF	On-Demand	Anodyne	SIGMAR1	21	43
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853822454	EF	On-Demand	Anodyne	SLC18A3	20	40
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853822454	EF	On-Demand	Anodyne	EPHX2	28	42
O=C(NC1CCN(C2CCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853822454	EF	On-Demand	Anodyne	L3MBTL3	42	35
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853822455	GD	On-Demand	Anodyne	DRD4	29	46
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853822456	GD	On-Demand	Anodyne	DRD4	29	46
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853822457	GD	On-Demand	Anodyne	DRD4	29	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853822458	GD	On-Demand	Anodyne	DRD4	29	46
CC(C)(C)OC(=O)N1CC[C@H](c2cccc(F)c2)[C@H](Nc2ccc(C#N)nn2)C1	ZINC000853822474	GH	On-Demand	Mild	GPR119	29	42
C[C@H]1CN(S(C)(=O)=O)CC[C@H]1NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853822487	GD	On-Demand	Anodyne	NAMPT	43	38
C[C@H]1CN(S(C)(=O)=O)CC[C@@H]1NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853822488	GD	On-Demand	Anodyne	NAMPT	43	38
O=C(NNC(=O)c1cc[nH]n1)Nc1nc2c(s1)CCCC2	ZINC000853822535	DD	On-Demand	Reactive	SLC27A1	32	42
Cc1nsc(C(=O)NCc2cccnc2N2CCCC2)n1	ZINC000853822536	DD	On-Demand	Anodyne	TRPV1	17	43
Cc1nsc(C(=O)NCc2cccnc2N2CCCC2)n1	ZINC000853822536	DD	On-Demand	Anodyne	SCN2A	20	48
Cc1nsc(C(=O)NCc2cccnc2N2CCCC2)n1	ZINC000853822536	DD	On-Demand	Anodyne	SCN10A	32	51
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1C	ZINC000853822568	EG	On-Demand	Anodyne	TRPV1	15	46
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1C	ZINC000853822568	EG	On-Demand	Anodyne	SCN2A	17	43
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1C	ZINC000853822568	EG	On-Demand	Anodyne	SCN10A	20	45
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1C	ZINC000853822568	EG	On-Demand	Anodyne	NAMPT	21	43
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3cc[nH]n3)cc2F)C[C@@H](C)O1	ZINC000853822584	GD	On-Demand	Reactive	NPY2R	66	35
C[C@H]1CN(c2ccc(NC(=O)NNC(=O)c3cc[nH]n3)cc2F)C[C@H](C)O1	ZINC000853822585	GD	On-Demand	Reactive	NPY2R	66	35
O=C(NCc1cccnc1N1CCCC1)C(=O)C1CCSCC1	ZINC000853822597	EE	On-Demand	Anodyne	SCN2A	18	45
O=C(NCc1cccnc1N1CCCC1)C(=O)C1CCSCC1	ZINC000853822597	EE	On-Demand	Anodyne	SCN10A	20	45
O=C(NCc1cccnc1N1CCCC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853822598	GF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1cccnc1N1CCCC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853822598	GF	On-Demand	Anodyne	SCN10A	18	41
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1-c1ccccc1	ZINC000853822613	GI	On-Demand	Anodyne	SCN2A	18	42
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1-c1ccccc1	ZINC000853822613	GI	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1-c1ccccc1	ZINC000853822613	GI	On-Demand	Anodyne	PI4KB	40	41
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1-c1ccccc1	ZINC000853822613	GI	On-Demand	Anodyne	SCN10A	28	44
Cc1nc(NC(=O)NCc2cccnc2N2CCCC2)sc1-c1ccccc1	ZINC000853822613	GI	On-Demand	Anodyne	NAMPT	22	45
CC(C)(C)OC(=O)CCC1CCN(c2cccc(F)n2)CC1	ZINC000853822633	DH	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)CCC1CCN(c2ncnc3c2CCC3)CC1	ZINC000853822652	EG	On-Demand	Anodyne	SIRT3	71	42
CC(C)(C)OC(=O)CCC1CCN(c2ncnc3c2CCC3)CC1	ZINC000853822652	EG	On-Demand	Anodyne	SIRT2	61	42
CC(C)(C)OC(=O)CCC1CCN(c2ncnc3c2CCC3)CC1	ZINC000853822652	EG	On-Demand	Anodyne	SIRT1	55	38
CC(C)(C)OC(=O)CCC1CCN(c2nccc(N3CCCC3)n2)CC1	ZINC000853822677	FG	On-Demand	Anodyne	SORD	43	36
CC(C)(C)OC(=O)CCC1CCN(c2nccc(N3CCCC3)n2)CC1	ZINC000853822677	FG	On-Demand	Anodyne	GPR119	24	45
CC(C)(C)OC(=O)N1CC[C@H](c2ccccc2)[C@H](Nc2ccc(C#N)nn2)C1	ZINC000853822720	GH	On-Demand	Mild	GPR119	32	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@@H]([S@](C)=O)C2)CC1	ZINC000853822809	GE	On-Demand	Anodyne	KCNQ2	74	39
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@@H]([S@@](C)=O)C2)CC1	ZINC000853822810	GE	On-Demand	Anodyne	KCNQ2	74	39
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@H]([S@](C)=O)C2)CC1	ZINC000853822811	GE	On-Demand	Anodyne	KCNQ2	74	39
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@H]([S@@](C)=O)C2)CC1	ZINC000853822812	GE	On-Demand	Anodyne	KCNQ2	74	39
Cc1nsc(C(=O)N[C@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853822821	DD	On-Demand	Anodyne	PYGL	43	57
Cc1nsc(C(=O)N[C@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853822821	DD	On-Demand	Anodyne	PYGM	41	57
Cc1nsc(C(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853822822	DD	On-Demand	Anodyne	PYGL	43	57
Cc1nsc(C(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)n1	ZINC000853822822	DD	On-Demand	Anodyne	PYGM	41	57
CC(C)(C)OC(=O)N1CC[C@H](c2cccc(F)c2)[C@H](Nc2cc(C#N)cnn2)C1	ZINC000853822839	GH	On-Demand	Mild	GPR119	37	42
CCn1c(O)nnc1C1CCN(C(=O)Nc2cccnc2Cl)CC1	ZINC000853822848	FE	On-Demand	Anodyne	G2YM83_BOTF4	67	36
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822850	FF	On-Demand	Mild	DRD4	29	50
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822850	FF	On-Demand	Mild	SIGMAR1	31	41
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822851	FF	On-Demand	Mild	DRD4	29	50
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853822851	FF	On-Demand	Mild	SIGMAR1	31	41
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822852	FF	On-Demand	Mild	DRD4	29	50
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822852	FF	On-Demand	Mild	SIGMAR1	31	41
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822853	FF	On-Demand	Mild	DRD4	29	50
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853822853	FF	On-Demand	Mild	SIGMAR1	31	41
CC(C)(C)OC(=O)CCC1CCN(c2ccc([N+](=O)[O-])cc2C#N)CC1	ZINC000853822884	FH	On-Demand	Mild	SLC6A9	15	42
CC(C)(C)OC(=O)CCC1CCN(c2ccc([N+](=O)[O-])cc2C#N)CC1	ZINC000853822884	FH	On-Demand	Mild	SSTR1	21	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CCC[C@H](N3CCOCC3)CC2)C1	ZINC000853822886	FD	On-Demand	Anodyne	L3MBTL3	27	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CCC[C@@H](N3CCOCC3)CC2)C1	ZINC000853822887	FD	On-Demand	Anodyne	L3MBTL3	27	40
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CCC[C@H](N3CCOCC3)CC2)C1	ZINC000853822888	FD	On-Demand	Anodyne	L3MBTL3	27	40
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CCC[C@@H](N3CCOCC3)CC2)C1	ZINC000853822889	FD	On-Demand	Anodyne	L3MBTL3	27	40
CC(C)c1ccc2c(c1)CN(C(=O)Nc1ccccc1N1CCN(C)CC1)CC2	ZINC000853822890	GI	On-Demand	Anodyne	KCNQ2	74	42
CN(C)[C@@H]1CCC[C@@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853822910	EF	On-Demand	Anodyne	EPHX2	49	52
CN(C)[C@@H]1CCC[C@H](NC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853822911	EF	On-Demand	Anodyne	EPHX2	49	52
O=C(NCCC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853822937	GG	On-Demand	Anodyne	HPGDS	35	40
O=C(NCCC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853822938	GG	On-Demand	Anodyne	HPGDS	35	40
O=C(NCCC1CCN(CC(F)(F)F)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853822939	GG	On-Demand	Anodyne	HPGDS	35	40
O=C(NCCC1CCN(CC(F)(F)F)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853822940	GG	On-Demand	Anodyne	HPGDS	35	40
O=C(NCc1cccnc1N1CCCC1)N1CCCCC1	ZINC000853822948	CE	On-Demand	Anodyne	TRPV1	20	46
O=C(NCc1cccnc1N1CCCC1)N1CCCCC1	ZINC000853822948	CE	On-Demand	Anodyne	SCN2A	22	53
O=C(NCc1cccnc1N1CCCC1)N1CCCCC1	ZINC000853822948	CE	On-Demand	Anodyne	LIPA	55	35
O=C(NCc1cccnc1N1CCCC1)N1CCCCC1	ZINC000853822948	CE	On-Demand	Anodyne	EPHX2	21	46
O=C(NCc1cccnc1N1CCCC1)N1CCCCC1	ZINC000853822948	CE	On-Demand	Anodyne	DPP7	47	35
O=C(NCc1cccnc1N1CCCC1)N1CCCCC1	ZINC000853822948	CE	On-Demand	Anodyne	SCN10A	23	53
O=C(NCc1cccnc1N1CCCC1)N1CCCCC1	ZINC000853822948	CE	On-Demand	Anodyne	NAMPT	27	41
O=C(NCc1cccnc1N1CCCC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853822953	GF	On-Demand	Bother	TRPV1	21	44
O=C(NCc1cccnc1N1CCCC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853822953	GF	On-Demand	Bother	SCN10A	22	44
O=C(NCCC1CCN(CC(F)(F)F)CC1)NNc1cc(F)cc(Cl)c1	ZINC000853822958	GH	On-Demand	Reactive	CACNA1I	67	40
Cc1nc(C(=O)N[C@H]2Cc3ccccc3N(C)C2=O)no1	ZINC000853822963	CC	On-Demand	Anodyne	PYGL	41	56
Cc1nc(C(=O)N[C@H]2Cc3ccccc3N(C)C2=O)no1	ZINC000853822963	CC	On-Demand	Anodyne	PYGM	41	56
Cc1nc(C(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)no1	ZINC000853822964	CC	On-Demand	Anodyne	PYGL	41	56
Cc1nc(C(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)no1	ZINC000853822964	CC	On-Demand	Anodyne	PYGM	41	56
O=C(NCc1cccnc1N1CCCC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853822969	FC	On-Demand	Anodyne	SCN2A	17	43
O=C(NCc1cccnc1N1CCCC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853822969	FC	On-Demand	Anodyne	LIPA	41	35
O=C(NCc1cccnc1N1CCCC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853822969	FC	On-Demand	Anodyne	SCN10A	27	49
C[S@](=O)[C@H]1CCC[C@@H](NC(=O)Nc2cccnc2Cl)C1	ZINC000853823008	DF	On-Demand	Anodyne	G2YM83_BOTF4	70	38
C[S@](=O)[C@@H]1CCC[C@H](NC(=O)Nc2cccnc2Cl)C1	ZINC000853823009	DF	On-Demand	Anodyne	G2YM83_BOTF4	70	38
C[S@](=O)[C@H]1CCC[C@H](NC(=O)Nc2cccnc2Cl)C1	ZINC000853823010	DF	On-Demand	Anodyne	G2YM83_BOTF4	70	38
C[S@](=O)[C@@H]1CCC[C@@H](NC(=O)Nc2cccnc2Cl)C1	ZINC000853823011	DF	On-Demand	Anodyne	G2YM83_BOTF4	70	38
Cc1nc(NC(=O)N[C@@H]2CCC[C@@H]([S@@](C)=O)C2)sc1-c1ccccc1	ZINC000853823019	GH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2CCC[C@H]([S@@](C)=O)C2)sc1-c1ccccc1	ZINC000853823020	GH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2CCC[C@H]([S@](C)=O)C2)sc1-c1ccccc1	ZINC000853823021	GH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2CCC[C@@H]([S@](C)=O)C2)sc1-c1ccccc1	ZINC000853823022	GH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)sc1C	ZINC000853823027	EE	On-Demand	Anodyne	PYGL	36	50
Cc1nc(NC(=O)N[C@@H]2Cc3ccccc3N(C)C2=O)sc1C	ZINC000853823027	EE	On-Demand	Anodyne	PYGM	32	50
Cc1nc(NC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)sc1C	ZINC000853823028	EE	On-Demand	Anodyne	PYGL	36	50
Cc1nc(NC(=O)N[C@H]2Cc3ccccc3N(C)C2=O)sc1C	ZINC000853823028	EE	On-Demand	Anodyne	PYGM	32	50
C[S@](=O)[C@@H]1CCC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823110	FI	On-Demand	Anodyne	EPHX2	46	45
C[S@](=O)[C@@H]1CCC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823110	FI	On-Demand	Anodyne	DGAT1	18	44
C[S@](=O)[C@H]1CCC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823119	FI	On-Demand	Anodyne	EPHX2	46	45
C[S@](=O)[C@H]1CCC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823119	FI	On-Demand	Anodyne	DGAT1	18	44
C[S@](=O)[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823120	FI	On-Demand	Anodyne	EPHX2	46	45
C[S@](=O)[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823120	FI	On-Demand	Anodyne	DGAT1	18	44
C[S@](=O)[C@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823122	FI	On-Demand	Anodyne	EPHX2	46	45
C[S@](=O)[C@H]1CCC[C@@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)C1	ZINC000853823122	FI	On-Demand	Anodyne	DGAT1	18	44
CC(C)(C)OC(=O)NC1(CNc2ccc(S(C)(=O)=O)cc2F)CCCC1	ZINC000853823155	GG	On-Demand	Anodyne	GPR119	28	42
C[S@](=O)[C@H]1CCC[C@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853823173	DF	On-Demand	Anodyne	EPHX2	35	44
C[S@](=O)[C@@H]1CCC[C@@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853823174	DF	On-Demand	Anodyne	EPHX2	35	44
C[S@](=O)[C@H]1CCC[C@@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853823176	DF	On-Demand	Anodyne	EPHX2	35	44
C[S@](=O)[C@@H]1CCC[C@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853823178	DF	On-Demand	Anodyne	EPHX2	35	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853823183	GG	On-Demand	Anodyne	DRD2	18	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853823183	GG	On-Demand	Anodyne	DRD4	49	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853823183	GG	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853823183	GG	On-Demand	Anodyne	DRD3	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853823183	GG	On-Demand	Anodyne	SIGMAR1	51	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853823183	GG	On-Demand	Anodyne	MCHR1	15	46
O=C(NCc1cccnc1N1CCCC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853823184	FG	On-Demand	Anodyne	TRPV1	20	45
O=C(NCc1cccnc1N1CCCC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853823184	FG	On-Demand	Anodyne	SCN2A	17	42
O=C(NCc1cccnc1N1CCCC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853823184	FG	On-Demand	Anodyne	SCN10A	19	42
O=C(NCc1cccnc1N1CCCC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853823184	FG	On-Demand	Anodyne	NAMPT	47	40
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853823185	GG	On-Demand	Anodyne	DRD2	18	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853823185	GG	On-Demand	Anodyne	DRD4	49	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853823185	GG	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853823185	GG	On-Demand	Anodyne	DRD3	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853823185	GG	On-Demand	Anodyne	SIGMAR1	51	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853823185	GG	On-Demand	Anodyne	MCHR1	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853823186	GG	On-Demand	Anodyne	DRD2	18	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853823186	GG	On-Demand	Anodyne	DRD4	49	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853823186	GG	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853823186	GG	On-Demand	Anodyne	DRD3	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853823186	GG	On-Demand	Anodyne	SIGMAR1	51	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853823186	GG	On-Demand	Anodyne	MCHR1	15	46
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853823187	GG	On-Demand	Anodyne	DRD2	18	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853823187	GG	On-Demand	Anodyne	DRD4	49	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853823187	GG	On-Demand	Anodyne	ACHE	33	42
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853823187	GG	On-Demand	Anodyne	DRD3	15	51
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853823187	GG	On-Demand	Anodyne	SIGMAR1	51	44
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853823187	GG	On-Demand	Anodyne	MCHR1	15	46
Cc1nc(C(=O)N2CCc3ccc(C(C)C)cc3C2)no1	ZINC000853823188	CF	On-Demand	Anodyne	QRFPR	15	40
CC(C)(C)OC(=O)CCC1CCN(c2cncc(Cl)n2)CC1	ZINC000853823208	EG	On-Demand	Anodyne	GPR119	19	42
CC(C)(C)OC(=O)CCC1CCN(c2cc(F)ncn2)CC1	ZINC000853823220	DF	On-Demand	Anodyne	SIRT3	60	40
CC(C)(C)OC(=O)CCC1CCN(c2cc(F)ncn2)CC1	ZINC000853823220	DF	On-Demand	Anodyne	SIRT2	50	40
CC(C)(C)OC(=O)CCC1CCN(c2cc(F)ncn2)CC1	ZINC000853823220	DF	On-Demand	Anodyne	SIRT1	48	40
CC(C)(C)OC(=O)CCC1CCN(c2cc(F)ncn2)CC1	ZINC000853823220	DF	On-Demand	Anodyne	GPR119	26	45
CC(C)(C)OC(=O)N1CC[C@H](c2ccc(F)cc2)[C@H](Nc2ccc(C#N)nn2)C1	ZINC000853823279	GH	On-Demand	Mild	GPR119	32	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853823289	GF	On-Demand	Mild	DRD4	28	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000853823290	GF	On-Demand	Mild	DRD4	28	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853823291	GF	On-Demand	Mild	DRD4	28	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000853823292	GF	On-Demand	Mild	DRD4	28	46
C[C@H]1CN(c2ccc(NC(=O)Nc3c[nH]nc3C3CC3)cc2F)C[C@H](C)O1	ZINC000853823324	FH	On-Demand	Anodyne	NPY2R	57	38
C[C@H]1CN(c2ccc(NC(=O)Nc3c[nH]nc3C3CC3)cc2F)C[C@@H](C)O1	ZINC000853823325	FH	On-Demand	Anodyne	NPY2R	57	38
CC(C)(C)OC(=O)CCC1CCN(c2nnc(Cl)cc2C(N)=O)CC1	ZINC000853823342	FF	On-Demand	Anodyne	SIRT3	74	46
CC(C)(C)OC(=O)CCC1CCN(c2nnc(Cl)cc2C(N)=O)CC1	ZINC000853823342	FF	On-Demand	Anodyne	SIRT2	64	46
CC(C)(C)OC(=O)CCC1CCN(c2nnc(Cl)cc2C(N)=O)CC1	ZINC000853823342	FF	On-Demand	Anodyne	SIRT1	59	46
COC(=O)c1cccc(N2CCC(CCC(=O)OC(C)(C)C)CC2)n1	ZINC000853823369	EG	On-Demand	Anodyne	GPR119	16	40
CN(C(=O)Nc1ccc2c(c1)C(=O)NC2=O)c1ccc(C(C)(C)C)cc1	ZINC000853823388	FH	On-Demand	Anodyne	CASP2	17	41
CN(C(=O)Nc1ccc2c(c1)C(=O)NC2=O)c1ccc(C(C)(C)C)cc1	ZINC000853823388	FH	On-Demand	Anodyne	CASP6	15	41
C[C@@H](CNC(=O)NC1CCC(C)(O)CC1)c1ccccn1	ZINC000853823416	CE	On-Demand	Anodyne	EPHX2	15	43
CN(C(=O)NC1CCC(C)(O)CC1)[C@H](CO)Cc1ccccc1	ZINC000853823448	DD	On-Demand	Anodyne	TIMP3	52	36
CN(C(=O)NC1CCC(C)(O)CC1)[C@H](CO)Cc1ccccc1	ZINC000853823448	DD	On-Demand	Anodyne	NPY5R	15	41
CN(C(=O)NC1CCC(C)(O)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853823449	DD	On-Demand	Anodyne	TIMP3	52	36
CN(C(=O)NC1CCC(C)(O)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853823449	DD	On-Demand	Anodyne	NPY5R	15	41
COc1cccc(OC)c1CNC(=O)C(C)(F)F	ZINC000853823450	CD	On-Demand	Anodyne	KCNK3	42	37
COCC1(NC(=O)NC2CCC(C)(O)CC2)CCCC1	ZINC000853823478	CD	On-Demand	Anodyne	EPHX2	23	40
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(C2CCCC2)CC1	ZINC000853823508	FH	On-Demand	Reactive	EPHX2	17	41
CN(C)[C@@H]1CCC[C@H](NC(=O)NC2(CN3CCN(c4ccccc4)CC3)CC2)C1	ZINC000853823517	GF	On-Demand	Anodyne	DRD3	18	45
CN(C)[C@@H]1CCC[C@@H](NC(=O)NC2(CN3CCN(c4ccccc4)CC3)CC2)C1	ZINC000853823518	GF	On-Demand	Anodyne	DRD3	18	45
CC(C)(C)OC(=O)CCC1CCN(c2cc(Br)cnc2C#N)CC1	ZINC000853823520	GI	On-Demand	Mild	GPR119	22	40
COC(=O)c1cccc(NNC(=O)NC2CCN(C3CCCC3)CC2)c1C	ZINC000853823531	FF	On-Demand	Reactive	EPHX2	17	40
CC(C)(C)OC(=O)CCC1CCN(c2cc(Cl)nc(N)n2)CC1	ZINC000853823549	EG	On-Demand	Anodyne	HRH4	40	40
CC(C)(C)OC(=O)CCC1CCN(c2cnc(F)cn2)CC1	ZINC000853823562	DF	On-Demand	Anodyne	GPR119	28	42
CC(C)c1ccc2c(c1)CN(C(=O)c1nccn1C)CC2	ZINC000853823573	CF	On-Demand	Anodyne	QRFPR	15	41
O=C(NCc1ccc2occc2c1)N1CCCCC1	ZINC000853823589	CG	On-Demand	Anodyne	DPP7	49	41
O=C(NCC(F)(F)c1cccc(F)c1)N1CCCCC1	ZINC000853823603	CG	On-Demand	Anodyne	CACNA1G	33	44
CCn1c(O)nnc1C1CCN(C(=O)NC2CCC(C)(O)CC2)CC1	ZINC000853823654	FD	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2cccc(F)c2)CC1	ZINC000853823683	GG	On-Demand	Anodyne	KCNQ2	81	50
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2cccc(F)c2)CC1	ZINC000853823683	GG	On-Demand	Anodyne	NPY2R	42	37
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2cccc(F)c2)CC1	ZINC000853823683	GG	On-Demand	Anodyne	P2RY1	52	34
CON(C)CCNC(=O)NC[C@H](Cc1ccccc1)c1ccccc1	ZINC000853823684	EF	On-Demand	Anodyne	MME	44	36
CON(C)CCNC(=O)NC[C@H](Cc1ccccc1)c1ccccc1	ZINC000853823684	EF	On-Demand	Anodyne	SOAT1	16	40
CON(C)CCNC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000853823685	EF	On-Demand	Anodyne	MME	44	36
CON(C)CCNC(=O)NC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000853823685	EF	On-Demand	Anodyne	SOAT1	16	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)N(C)[C@@H](CO)Cc2ccccc2)C1	ZINC000853823695	EE	On-Demand	Anodyne	ACE	42	36
CN(C)[C@@H]1CCC[C@@H](NC(=O)N(C)[C@@H](CO)Cc2ccccc2)C1	ZINC000853823695	EE	On-Demand	Anodyne	MME	38	44
CN(C)[C@@H]1CCC[C@H](NC(=O)N(C)[C@@H](CO)Cc2ccccc2)C1	ZINC000853823696	EE	On-Demand	Anodyne	ACE	42	36
CN(C)[C@@H]1CCC[C@H](NC(=O)N(C)[C@@H](CO)Cc2ccccc2)C1	ZINC000853823696	EE	On-Demand	Anodyne	MME	38	44
COc1cccc(OC)c1CNC(=O)Nc1nc(C)c(C)s1	ZINC000853823699	DG	On-Demand	Anodyne	CSNK1D	22	41
COc1cccc(OC)c1CNC(=O)Nc1nc(C)c(C)s1	ZINC000853823699	DG	On-Demand	Anodyne	ROCK2	17	49
C=CCCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823708	CE	On-Demand	Mild	DRD3	49	36
C=CCCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823708	CE	On-Demand	Mild	KCNQ2	81	42
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCC[C@H](N(C)C)C2)cc1	ZINC000853823741	GD	On-Demand	Anodyne	ADRB2	28	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCC[C@H](N(C)C)C2)cc1	ZINC000853823741	GD	On-Demand	Anodyne	ADRB1	61	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCC[C@H](N(C)C)C2)cc1	ZINC000853823741	GD	On-Demand	Anodyne	ADRB3	36	40
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCC[C@H](N(C)C)C2)cc1	ZINC000853823742	GD	On-Demand	Anodyne	ADRB2	28	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCC[C@H](N(C)C)C2)cc1	ZINC000853823742	GD	On-Demand	Anodyne	ADRB1	61	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCC[C@H](N(C)C)C2)cc1	ZINC000853823742	GD	On-Demand	Anodyne	ADRB3	36	40
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCC[C@@H](N(C)C)C2)cc1	ZINC000853823743	GD	On-Demand	Anodyne	ADRB2	28	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCC[C@@H](N(C)C)C2)cc1	ZINC000853823743	GD	On-Demand	Anodyne	ADRB1	61	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCC[C@@H](N(C)C)C2)cc1	ZINC000853823743	GD	On-Demand	Anodyne	ADRB3	36	40
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCC[C@@H](N(C)C)C2)cc1	ZINC000853823744	GD	On-Demand	Anodyne	ADRB2	28	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCC[C@@H](N(C)C)C2)cc1	ZINC000853823744	GD	On-Demand	Anodyne	ADRB1	61	53
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCC[C@@H](N(C)C)C2)cc1	ZINC000853823744	GD	On-Demand	Anodyne	ADRB3	36	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H]1C=CCC1	ZINC000853823766	EE	On-Demand	Anodyne	SIGMAR1	20	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H]1C=CCC1	ZINC000853823767	EE	On-Demand	Anodyne	SIGMAR1	20	40
COCCN(CCF)C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000853823798	FD	On-Demand	Anodyne	SIGMAR1	23	40
CC[C@@H](C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823831	DF	On-Demand	Anodyne	ADRA1D	18	40
CC[C@@H](C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823831	DF	On-Demand	Anodyne	ADRA1A	15	40
CC[C@@H](C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823831	DF	On-Demand	Anodyne	DRD3	47	34
CC[C@@H](C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823831	DF	On-Demand	Anodyne	KCNQ2	92	49
CC[C@@H](C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823831	DF	On-Demand	Anodyne	NPY2R	46	36
C=CCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853823849	DG	On-Demand	Mild	HRH2	23	41
C=CCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853823849	DG	On-Demand	Mild	ROCK1	29	42
C=CCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853823849	DG	On-Demand	Mild	MTNR1A	32	41
C=CCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853823849	DG	On-Demand	Mild	MTNR1B	32	41
C=CCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853823849	DG	On-Demand	Mild	ROCK2	39	42
C=CCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853823849	DG	On-Demand	Mild	SCD1	41	46
C=CCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853823849	DG	On-Demand	Mild	SCD	40	50
C=CCCSCCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853823887	EF	On-Demand	Mild	KCNQ2	74	38
O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853823943	GF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853823944	GF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853823945	GF	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NCc1ccccc1CN1CCC(O)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853823946	GF	On-Demand	Anodyne	SIGMAR1	19	40
CON(C)CCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000853823957	FC	On-Demand	Anodyne	SIGMAR1	22	40
CON(C)CCNC(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000853823957	FC	On-Demand	Anodyne	MCHR1	18	42
C=CCCSCCNC(=O)Nc1cccnc1Cl	ZINC000853823972	CG	On-Demand	Mild	G2YM83_BOTF4	64	32
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NC1CCC(C)(O)CC1	ZINC000853824005	GJ	On-Demand	Anodyne	MME	62	39
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NC1CCC(C)(O)CC1	ZINC000853824005	GJ	On-Demand	Anodyne	TIMP3	70	38
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NC1CCC(C)(O)CC1	ZINC000853824005	GJ	On-Demand	Anodyne	ACE2	46	34
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NC1CCC(C)(O)CC1	ZINC000853824005	GJ	On-Demand	Anodyne	PTGES	17	41
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	HTR1A	111	48
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	DRD2	87	51
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	DRD1	29	41
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	DRD4	53	45
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	ADRA1D	78	46
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	HTR1D	23	48
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	HTR1B	30	48
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	HTR2A	40	43
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	HTR2C	25	42
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	ADRA1A	72	44
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	ADRA1B	61	42
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	DRD3	99	44
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	HTR7	72	45
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	KCNQ2	80	43
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	P2RY1	45	34
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	SOAT1	20	44
COc1cccc(OC)c1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824018	GF	On-Demand	Anodyne	HCN1	34	41
C=CCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853824024	DG	On-Demand	Mild	NPY2R	66	38
C=CCCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853824025	DG	On-Demand	Mild	NPY2R	66	38
C=CCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853824026	DG	On-Demand	Mild	NPY2R	66	38
C=CCCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853824048	CE	On-Demand	Mild	CACNA1D	47	37
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CCC(C)(O)CC2)cc1	ZINC000853824071	GD	On-Demand	Anodyne	ADRB2	34	52
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CCC(C)(O)CC2)cc1	ZINC000853824071	GD	On-Demand	Anodyne	ADRB1	71	52
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CCC(C)(O)CC2)cc1	ZINC000853824071	GD	On-Demand	Anodyne	ADRB3	45	41
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CCC(C)(O)CC2)cc1	ZINC000853824072	GD	On-Demand	Anodyne	ADRB2	34	52
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CCC(C)(O)CC2)cc1	ZINC000853824072	GD	On-Demand	Anodyne	ADRB1	71	52
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CCC(C)(O)CC2)cc1	ZINC000853824072	GD	On-Demand	Anodyne	ADRB3	45	41
O=C(NCc1ncccn1)NCc1ccccc1CN1CCC(O)CC1	ZINC000853824096	FD	On-Demand	Anodyne	DRD4	15	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCC(C)(O)CC2)C1	ZINC000853824118	CC	On-Demand	Anodyne	EPHX2	16	51
COc1cccc(OC)c1CNC(=O)N1CCCCC1	ZINC000853824138	CE	On-Demand	Anodyne	HTR1A	28	41
COc1cccc(OC)c1CNC(=O)N1CCCCC1	ZINC000853824138	CE	On-Demand	Anodyne	DRD2	33	42
COc1cccc(OC)c1CNC(=O)N1CCCCC1	ZINC000853824138	CE	On-Demand	Anodyne	EPHX2	17	43
COc1cccc(OC)c1CNC(=O)N1CCCCC1	ZINC000853824138	CE	On-Demand	Anodyne	DPP7	51	39
COc1cccc(OC)c1CNC(=O)N1CCCCC1	ZINC000853824138	CE	On-Demand	Anodyne	HCN1	49	40
CN(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853824159	FD	On-Demand	Anodyne	CCR3	27	42
CN(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853824159	FD	On-Demand	Anodyne	MCHR1	32	48
CN(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853824160	FD	On-Demand	Anodyne	CCR3	27	42
CN(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853824160	FD	On-Demand	Anodyne	MCHR1	32	48
CN(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853824161	FD	On-Demand	Anodyne	CCR3	27	42
CN(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)C1	ZINC000853824161	FD	On-Demand	Anodyne	MCHR1	32	48
CN(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853824162	FD	On-Demand	Anodyne	CCR3	27	42
CN(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)C1	ZINC000853824162	FD	On-Demand	Anodyne	MCHR1	32	48
CN1CCN(c2ccccc2NC(=O)NCc2ccc3occc3c2)CC1	ZINC000853824175	FH	On-Demand	Anodyne	HTR1A	17	40
CN1CCN(c2ccccc2NC(=O)NCc2ccc3occc3c2)CC1	ZINC000853824175	FH	On-Demand	Anodyne	KCNQ2	74	38
CN1CCN(c2ccccc2NC(=O)NCc2ccc3occc3c2)CC1	ZINC000853824175	FH	On-Demand	Anodyne	CSF1R	15	48
CC[C@@H](C)CCNC(=O)Nc1cccnc1Cl	ZINC000853824219	CG	On-Demand	Anodyne	G2YM83_BOTF4	71	37
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824265	JE	On-Demand	Anodyne	FKBP1A	41	47
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824265	JE	On-Demand	Anodyne	MMP13	45	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824265	JE	On-Demand	Anodyne	CAPNS1	21	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824265	JE	On-Demand	Anodyne	MMP3	47	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824265	JE	On-Demand	Anodyne	CAPN1	16	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824265	JE	On-Demand	Anodyne	MMP7	54	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824265	JE	On-Demand	Anodyne	MMP1	48	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824266	JE	On-Demand	Anodyne	FKBP1A	41	47
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824266	JE	On-Demand	Anodyne	MMP13	45	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824266	JE	On-Demand	Anodyne	CAPNS1	21	44
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824266	JE	On-Demand	Anodyne	MMP3	47	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824266	JE	On-Demand	Anodyne	CAPN1	16	41
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824266	JE	On-Demand	Anodyne	MMP7	54	45
CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)OCC(=O)NC(C2CC2)C2CC2)cc1	ZINC000853824266	JE	On-Demand	Anodyne	MMP1	48	45
Cc1nsc(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)n1	ZINC000853824271	ED	On-Demand	Anodyne	SIGMAR1	16	44
Cc1nsc(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)n1	ZINC000853824271	ED	On-Demand	Anodyne	MCHR1	21	40
Cc1nsc(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)n1	ZINC000853824272	ED	On-Demand	Anodyne	SIGMAR1	16	44
Cc1nsc(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)n1	ZINC000853824272	ED	On-Demand	Anodyne	MCHR1	21	40
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853824275	FE	On-Demand	Anodyne	BIRC2	24	40
C[C@@H](Cc1ccncc1)NC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853824276	FE	On-Demand	Anodyne	BIRC2	24	40
Cc1nc(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)no1	ZINC000853824299	DC	On-Demand	Anodyne	SIGMAR1	17	45
Cc1nc(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)no1	ZINC000853824299	DC	On-Demand	Anodyne	MCHR1	24	43
Cc1nc(C(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)no1	ZINC000853824299	DC	On-Demand	Anodyne	PANC	40	35
Cc1nc(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)no1	ZINC000853824300	DC	On-Demand	Anodyne	SIGMAR1	17	45
Cc1nc(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)no1	ZINC000853824300	DC	On-Demand	Anodyne	MCHR1	24	43
Cc1nc(C(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)no1	ZINC000853824300	DC	On-Demand	Anodyne	PANC	40	35
CN1CCN(c2ccccc2NC(=O)NC/C=C\CO)CC1	ZINC000853824307	DD	On-Demand	Anodyne	DRD3	47	38
CN1CCN(c2ccccc2NC(=O)NC/C=C\CO)CC1	ZINC000853824307	DD	On-Demand	Anodyne	KCNQ2	85	44
CN1CCN(c2ccccc2NC(=O)NC/C=C/CO)CC1	ZINC000853824308	DD	On-Demand	Anodyne	DRD3	47	38
CN1CCN(c2ccccc2NC(=O)NC/C=C/CO)CC1	ZINC000853824308	DD	On-Demand	Anodyne	KCNQ2	85	44
C[C@@H](Cc1ccncc1)NC(=O)NCC1(NC(=O)OC(C)(C)C)CCCC1	ZINC000853824325	GG	On-Demand	Anodyne	FPR1	41	32
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1ccc2oc(=O)ccc2c1	ZINC000853824380	GF	On-Demand	Anodyne	DRD4	20	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1ccc2oc(=O)ccc2c1	ZINC000853824380	GF	On-Demand	Anodyne	CCR3	56	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1ccc2oc(=O)ccc2c1	ZINC000853824380	GF	On-Demand	Anodyne	MCHR1	39	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1ccc2oc(=O)ccc2c1	ZINC000853824381	GF	On-Demand	Anodyne	DRD4	20	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1ccc2oc(=O)ccc2c1	ZINC000853824381	GF	On-Demand	Anodyne	CCR3	56	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1ccc2oc(=O)ccc2c1	ZINC000853824381	GF	On-Demand	Anodyne	MCHR1	39	41
C#CCCN(CCOC)C(=O)N[C@@H](CC)c1cccc([N+](=O)[O-])c1	ZINC000853824393	EF	On-Demand	Mild	CACNA1C	51	41
C#CCCN(CCOC)C(=O)N[C@@H](CC)c1cccc([N+](=O)[O-])c1	ZINC000853824393	EF	On-Demand	Mild	CACNA1D	82	41
C#CCCN(CCOC)C(=O)N[C@H](CC)c1cccc([N+](=O)[O-])c1	ZINC000853824394	EF	On-Demand	Mild	CACNA1C	51	41
C#CCCN(CCOC)C(=O)N[C@H](CC)c1cccc([N+](=O)[O-])c1	ZINC000853824394	EF	On-Demand	Mild	CACNA1D	82	41
O=C(NC[C@]1(OCCO)CCOC1)Nc1cccnc1Cl	ZINC000853824401	DD	On-Demand	Anodyne	G2YM83_BOTF4	67	34
O=C(NC[C@@]1(OCCO)CCOC1)Nc1cccnc1Cl	ZINC000853824402	DD	On-Demand	Anodyne	G2YM83_BOTF4	67	34
O=C(NCCc1ccnc2ccccc12)N1CCCCC1	ZINC000853824403	CF	On-Demand	Anodyne	PREP	18	41
O=C(NCCc1ccnc2ccccc12)N1CCCCC1	ZINC000853824403	CF	On-Demand	Anodyne	MTNR1A	29	43
O=C(NCCc1ccnc2ccccc12)N1CCCCC1	ZINC000853824403	CF	On-Demand	Anodyne	MTNR1B	23	43
O=C(NCCc1ccnc2ccccc12)N1CCCCC1	ZINC000853824403	CF	On-Demand	Anodyne	HNMT	95	46
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824424	GF	On-Demand	Anodyne	ACHE	19	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824424	GF	On-Demand	Anodyne	SIGMAR1	31	45
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824424	GF	On-Demand	Anodyne	SLC18A3	21	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824424	GF	On-Demand	Anodyne	MLNR	43	34
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824425	GF	On-Demand	Anodyne	ACHE	19	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824425	GF	On-Demand	Anodyne	SIGMAR1	31	45
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824425	GF	On-Demand	Anodyne	SLC18A3	21	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)C(F)(F)c1ccccc1F	ZINC000853824425	GF	On-Demand	Anodyne	MLNR	43	34
C[C@H](CCNC(=O)Nc1cccnc1Cl)N(C)C	ZINC000853824432	CE	On-Demand	Anodyne	G2YM83_BOTF4	70	37
C[C@@H](CCNC(=O)Nc1cccnc1Cl)N(C)C	ZINC000853824433	CE	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	OPRK1	20	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	HRH3	21	47
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	SIGMAR1	27	49
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	CCR3	35	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	MLNR	42	36
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	EPHX2	17	47
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	DPP7	48	36
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	MCHR1	25	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	L3MBTL3	18	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCC1	ZINC000853824434	DD	On-Demand	Anodyne	NAMPT	29	43
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	OPRK1	20	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	HRH3	21	47
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	SIGMAR1	27	49
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	CCR3	35	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	MLNR	42	36
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	EPHX2	17	47
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	DPP7	48	36
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	MCHR1	25	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	L3MBTL3	18	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCC1	ZINC000853824435	DD	On-Demand	Anodyne	NAMPT	29	43
CC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)c1cccc([N+](=O)[O-])c1	ZINC000853824472	FE	On-Demand	Bother	CACNA1C	55	39
CC[C@@H](NC(=O)N(C)CCN(C)C(=O)OC)c1cccc([N+](=O)[O-])c1	ZINC000853824472	FE	On-Demand	Bother	CACNA1D	83	36
Cc1nc(NC(=O)NCc2ccc(CN3CC[C@H](O)C3)cc2)sc1C	ZINC000853824475	FF	On-Demand	Anodyne	CCR3	55	37
Cc1nc(NC(=O)NCc2ccc(CN3CC[C@@H](O)C3)cc2)sc1C	ZINC000853824476	FF	On-Demand	Anodyne	CCR3	55	37
C[C@@H](Cc1ccncc1)NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853824483	FF	On-Demand	Anodyne	GPR119	37	41
Cc1ccncc1CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853824527	GH	On-Demand	Anodyne	NPY2R	55	38
Cc1ccncc1CCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853824528	GH	On-Demand	Anodyne	NPY2R	55	38
Cc1ccncc1CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853824529	GH	On-Demand	Anodyne	NPY2R	55	38
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853824534	DC	On-Demand	Anodyne	SIGMAR1	21	43
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853824534	DC	On-Demand	Anodyne	SSTR5	46	36
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853824534	DC	On-Demand	Anodyne	MCHR1	30	41
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853824534	DC	On-Demand	Anodyne	NAMPT	39	40
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853824535	DC	On-Demand	Anodyne	SIGMAR1	21	43
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853824535	DC	On-Demand	Anodyne	SSTR5	46	36
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853824535	DC	On-Demand	Anodyne	MCHR1	30	41
Cn1ccnc1C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853824535	DC	On-Demand	Anodyne	NAMPT	39	40
CC(C)(C)OC(=O)C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853824585	ED	On-Demand	Anodyne	SIGMAR1	24	42
CC(C)(C)OC(=O)C(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853824585	ED	On-Demand	Anodyne	CACNA1I	50	36
CC(C)(C)OC(=O)C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853824586	ED	On-Demand	Anodyne	SIGMAR1	24	42
CC(C)(C)OC(=O)C(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853824586	ED	On-Demand	Anodyne	CACNA1I	50	36
CC[C@@H](NC(=O)NCCN(C)OC)c1cccc([N+](=O)[O-])c1	ZINC000853824587	DD	On-Demand	Bother	CACNA1C	55	38
CC[C@@H](NC(=O)NCCN(C)OC)c1cccc([N+](=O)[O-])c1	ZINC000853824587	DD	On-Demand	Bother	CACNA1D	79	36
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824591	FF	On-Demand	Anodyne	DRD4	21	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824591	FF	On-Demand	Anodyne	SIGMAR1	18	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824591	FF	On-Demand	Anodyne	CCR3	41	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824591	FF	On-Demand	Anodyne	MCHR1	23	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824591	FF	On-Demand	Anodyne	G2YM83_BOTF4	65	33
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824592	FF	On-Demand	Anodyne	DRD4	21	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824592	FF	On-Demand	Anodyne	SIGMAR1	18	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824592	FF	On-Demand	Anodyne	CCR3	41	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824592	FF	On-Demand	Anodyne	MCHR1	23	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1cccnc1Cl	ZINC000853824592	FF	On-Demand	Anodyne	G2YM83_BOTF4	65	33
CN1C[C@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1=O	ZINC000853824616	ED	On-Demand	Reactive	CSNK1D	35	41
CN1C[C@@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1=O	ZINC000853824617	ED	On-Demand	Reactive	CSNK1D	35	41
CC(C)(C)OC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000853824622	DE	On-Demand	Anodyne	NQO2	24	45
CC(C)(C)OC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000853824622	DE	On-Demand	Anodyne	MTNR1A	41	47
CC(C)(C)OC(=O)C(=O)NCCc1ccnc2ccccc12	ZINC000853824622	DE	On-Demand	Anodyne	MTNR1B	29	47
Cc1ccncc1CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824636	FF	On-Demand	Anodyne	HTR1A	19	40
Cc1ccncc1CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824636	FF	On-Demand	Anodyne	KCNQ2	73	39
Cc1ccncc1CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853824636	FF	On-Demand	Anodyne	UTS2R	15	40
CO[C@@](C)(CNC(=O)Nc1ccc(Cl)nc1)COCc1ccccc1	ZINC000853824665	FG	On-Demand	Anodyne	NAMPT	15	43
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)c1cccc([N+](=O)[O-])c1	ZINC000853824667	FF	On-Demand	Bother	CACNA1C	55	37
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)c1cccc([N+](=O)[O-])c1	ZINC000853824667	FF	On-Demand	Bother	CACNA1D	84	34
CC[C@@H](NC(=O)N1CCC(NC(=O)OC)CC1)c1cccc([N+](=O)[O-])c1	ZINC000853824667	FF	On-Demand	Bother	FAAH	15	45
CC[C@@H](NC(=O)N(CCF)CCOC)c1cccc([N+](=O)[O-])c1	ZINC000853824688	EF	On-Demand	Bother	CACNA1C	53	37
CC[C@@H](NC(=O)N(CCF)CCOC)c1cccc([N+](=O)[O-])c1	ZINC000853824688	EF	On-Demand	Bother	CACNA1D	84	37
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	HTR1A	34	42
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	DRD2	22	42
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	HTR1D	41	31
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	HTR1B	46	38
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	DRD3	28	42
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	KCNQ2	73	39
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	UTS2R	17	44
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	MTNR1A	23	40
CN1CCN(c2ccccc2NC(=O)NCCc2ccnc3ccccc23)CC1	ZINC000853824710	GG	On-Demand	Anodyne	HNMT	48	37
CN1CCN(c2ccccc2NC(=O)NC[C@@]2(OCCO)CCOC2)CC1	ZINC000853824713	GC	On-Demand	Anodyne	KCNQ2	73	38
CN1CCN(c2ccccc2NC(=O)NC[C@]2(OCCO)CCOC2)CC1	ZINC000853824714	GC	On-Demand	Anodyne	KCNQ2	73	38
C[C@H]1CN(c2ccc(NC(=O)NC/C=C/CO)cc2F)C[C@@H](C)O1	ZINC000853824749	EE	On-Demand	Anodyne	NPY2R	66	38
C[C@H]1CN(c2ccc(NC(=O)NC/C=C\CO)cc2F)C[C@@H](C)O1	ZINC000853824752	EE	On-Demand	Anodyne	NPY2R	66	38
C[C@@H]1CN(CCNC(=O)Nc2cccnc2Cl)[C@H](C)CO1	ZINC000853824754	DD	On-Demand	Anodyne	G2YM83_BOTF4	68	36
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1ccc(Cl)nc1	ZINC000853824763	FF	On-Demand	Anodyne	CCR3	59	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1ccc(Cl)nc1	ZINC000853824763	FF	On-Demand	Anodyne	MCHR1	26	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)Nc1ccc(Cl)nc1	ZINC000853824763	FF	On-Demand	Anodyne	NAMPT	47	47
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1ccc(Cl)nc1	ZINC000853824764	FF	On-Demand	Anodyne	CCR3	59	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1ccc(Cl)nc1	ZINC000853824764	FF	On-Demand	Anodyne	MCHR1	26	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)Nc1ccc(Cl)nc1	ZINC000853824764	FF	On-Demand	Anodyne	NAMPT	47	47
NC(=O)c1cc(N2CC[C@@H](C3CCCCC3)C2)ccn1	ZINC000853824766	CF	On-Demand	Anodyne	HRH4	16	42
NC(=O)c1cc(N2CC[C@@H](C3CCCCC3)C2)ccn1	ZINC000853824766	CF	On-Demand	Anodyne	CHRNA3	43	35
NC(=O)c1cc(N2CC[C@H](C3CCCCC3)C2)ccn1	ZINC000853824767	CF	On-Demand	Anodyne	HRH4	16	42
NC(=O)c1cc(N2CC[C@H](C3CCCCC3)C2)ccn1	ZINC000853824767	CF	On-Demand	Anodyne	CHRNA3	43	35
C[C@H]1C[C@@H](C)C[C@H](CNC(=O)Nc2cccc(N3CCOC3=O)c2)C1	ZINC000853824794	EH	On-Demand	Anodyne	EPHX2	26	41
C[C@@H]1CC(CNC(=O)Nc2cccc(N3CCOC3=O)c2)C[C@@H](C)C1	ZINC000853824795	EH	On-Demand	Anodyne	EPHX2	26	41
C[C@H]1CC(CNC(=O)Nc2cccc(N3CCOC3=O)c2)C[C@H](C)C1	ZINC000853824796	EH	On-Demand	Anodyne	EPHX2	26	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)C(=O)C1CCSCC1	ZINC000853824801	FD	On-Demand	Anodyne	SIGMAR1	18	44
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)C(=O)C1CCSCC1	ZINC000853824802	FD	On-Demand	Anodyne	SIGMAR1	18	44
C[C@@H](Cc1ccncc1)NC(=O)N[C@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853824822	FF	On-Demand	Anodyne	GPR119	16	41
C[C@@H](Cc1ccncc1)NC(=O)N[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853824824	FF	On-Demand	Anodyne	GPR119	16	41
COC(=O)c1cccc(N2CCN(c3ccc(Br)cc3)CC2)n1	ZINC000853824868	GF	On-Demand	Anodyne	HSD11B1	15	44
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCOCC1	ZINC000853824877	DC	On-Demand	Anodyne	SIGMAR1	22	43
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCOCC1	ZINC000853824877	DC	On-Demand	Anodyne	CCR3	27	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCOCC1	ZINC000853824877	DC	On-Demand	Anodyne	MCHR1	25	43
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCOCC1	ZINC000853824877	DC	On-Demand	Anodyne	NAMPT	29	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCOCC1	ZINC000853824878	DC	On-Demand	Anodyne	SIGMAR1	22	43
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCOCC1	ZINC000853824878	DC	On-Demand	Anodyne	CCR3	27	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCOCC1	ZINC000853824878	DC	On-Demand	Anodyne	MCHR1	25	43
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCOCC1	ZINC000853824878	DC	On-Demand	Anodyne	NAMPT	29	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)n1ccnc1	ZINC000853824883	DD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)n1ccnc1	ZINC000853824883	DD	On-Demand	Anodyne	NOS2	66	36
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)n1ccnc1	ZINC000853824883	DD	On-Demand	Anodyne	MCHR1	16	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)n1ccnc1	ZINC000853824883	DD	On-Demand	Anodyne	NAMPT	46	44
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)n1ccnc1	ZINC000853824884	DD	On-Demand	Anodyne	SIGMAR1	19	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)n1ccnc1	ZINC000853824884	DD	On-Demand	Anodyne	NOS2	66	36
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)n1ccnc1	ZINC000853824884	DD	On-Demand	Anodyne	MCHR1	16	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)n1ccnc1	ZINC000853824884	DD	On-Demand	Anodyne	NAMPT	46	44
C[C@@H](Cc1ccncc1)NC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)OC(C)(C)C)C2	ZINC000853824916	GG	On-Demand	Anodyne	REN	44	39
C[C@@H](Cc1ccncc1)NC(=O)N1C[C@H]2CC[C@H]1[C@@H](NC(=O)OC(C)(C)C)C2	ZINC000853824916	GG	On-Demand	Anodyne	FPR1	44	35
C[C@@H](Cc1ccncc1)NC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)OC(C)(C)C)C2	ZINC000853824917	GG	On-Demand	Anodyne	REN	44	39
C[C@@H](Cc1ccncc1)NC(=O)N1C[C@H]2CC[C@H]1[C@H](NC(=O)OC(C)(C)C)C2	ZINC000853824917	GG	On-Demand	Anodyne	FPR1	44	35
COC(=O)c1cccc(N2CC[C@H](C3CCCCC3)C2)n1	ZINC000853824928	CG	On-Demand	Anodyne	HSD11B1	16	45
COC(=O)c1cccc(N2CC[C@@H](C3CCCCC3)C2)n1	ZINC000853824929	CG	On-Demand	Anodyne	HSD11B1	16	45
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCOC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000853824953	GC	On-Demand	Bother	TAAR1	19	46
CN(C)C(=O)OCCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000853824956	EC	On-Demand	Anodyne	TGM2	32	43
CN(C)C(=O)OCCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000853824956	EC	On-Demand	Anodyne	GCKR	53	32
C[C@@H](CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)N(C)C	ZINC000853824972	EE	On-Demand	Bother	CACNA1C	40	39
C[C@@H](CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)N(C)C	ZINC000853824972	EE	On-Demand	Bother	CACNA1D	63	39
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@@H]1C=CCC1	ZINC000853824977	CD	On-Demand	Anodyne	STAT6	53	32
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1C=CCC1	ZINC000853824978	CD	On-Demand	Anodyne	STAT6	53	32
O=C(Nc1ccc(Br)cc1)N[C@H]1C=CCC1	ZINC000853824985	CG	On-Demand	Anodyne	EPHX2	38	47
O=C(Nc1ccc(Br)cc1)N[C@H]1C=CCC1	ZINC000853824985	CG	On-Demand	Anodyne	MTCA1	23	44
O=C(Nc1ccc(Br)cc1)N[C@H]1C=CCC1	ZINC000853824985	CG	On-Demand	Anodyne	P96878_MYCTU	17	44
O=C(Nc1ccc(Br)cc1)N[C@@H]1C=CCC1	ZINC000853824986	CG	On-Demand	Anodyne	EPHX2	38	47
O=C(Nc1ccc(Br)cc1)N[C@@H]1C=CCC1	ZINC000853824986	CG	On-Demand	Anodyne	MTCA1	23	44
O=C(Nc1ccc(Br)cc1)N[C@@H]1C=CCC1	ZINC000853824986	CG	On-Demand	Anodyne	P96878_MYCTU	17	44
CN(C)C(=O)OCCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000853824987	FD	On-Demand	Anodyne	LRRK2	32	40
CN(C)C(=O)OCCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000853825063	FF	On-Demand	Anodyne	ROS1	51	39
CN(C)C(=O)OCCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000853825069	CC	On-Demand	Bother	TAAR1	18	46
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	OPRK1	17	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	HRH3	25	46
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	SIGMAR1	26	48
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	CCR3	35	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	EPHX2	16	46
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	DPP7	56	38
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	MCHR1	23	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	L3MBTL3	15	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)N1CCCCC1	ZINC000853825076	DD	On-Demand	Anodyne	NAMPT	31	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	OPRK1	17	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	HRH3	25	46
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	SIGMAR1	26	48
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	CCR3	35	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	EPHX2	16	46
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	DPP7	56	38
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	MCHR1	23	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	L3MBTL3	15	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)N1CCCCC1	ZINC000853825078	DD	On-Demand	Anodyne	NAMPT	31	42
O=C(NC/C=C/CO)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853825089	DD	On-Demand	Bother	CACNA1D	47	34
O=C(NC/C=C\CO)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853825090	DD	On-Demand	Bother	CACNA1D	47	34
Nc1nc(Cl)cc(N2CCN(c3ccc(Br)cc3)CC2)n1	ZINC000853825093	FF	On-Demand	Anodyne	HRH4	45	44
Cc1cccc(NC(=O)N[C@H]2C=CCC2)n1	ZINC000853825107	BE	On-Demand	Anodyne	GRM5	19	50
Cc1cccc(NC(=O)N[C@H]2C=CCC2)n1	ZINC000853825107	BE	On-Demand	Anodyne	SORT1	17	42
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)n1	ZINC000853825109	BE	On-Demand	Anodyne	GRM5	19	50
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)n1	ZINC000853825109	BE	On-Demand	Anodyne	SORT1	17	42
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2)c1ccncc1	ZINC000853825124	FF	On-Demand	Anodyne	GPR119	30	40
Cc1ccncc1CCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853825141	FF	On-Demand	Bother	CACNA1D	54	34
CO[C@@](C)(CNC(=O)Nc1cccnc1Cl)COCc1ccccc1	ZINC000853825143	FG	On-Demand	Anodyne	PPIA	38	44
CO[C@@](C)(CNC(=O)Nc1cccnc1Cl)COCc1ccccc1	ZINC000853825143	FG	On-Demand	Anodyne	G2YM83_BOTF4	49	30
C[C@H]1C[C@@H](C)C[C@H](CNC(=O)c2nccn2C)C1	ZINC000853825167	BE	On-Demand	Anodyne	CACNA1I	49	33
C[C@H]1CC(CNC(=O)c2nccn2C)C[C@H](C)C1	ZINC000853825168	BE	On-Demand	Anodyne	CACNA1I	49	33
C[C@@H]1CC(CNC(=O)c2nccn2C)C[C@@H](C)C1	ZINC000853825169	BE	On-Demand	Anodyne	CACNA1I	49	33
O=C(NC[C@@H](OC1CCCC1)C(F)(F)F)Nc1cccnc1Cl	ZINC000853825181	FH	On-Demand	Anodyne	G2YM83_BOTF4	65	33
O=C(NC[C@H](OC1CCCC1)C(F)(F)F)Nc1cccnc1Cl	ZINC000853825182	FH	On-Demand	Anodyne	G2YM83_BOTF4	65	33
Brc1ccc(N2CCN(c3nccc(N4CCCC4)n3)CC2)cc1	ZINC000853825192	GG	On-Demand	Anodyne	SORD	76	42
CC[C@@H](CNC(=O)NCCN(C)OC)Oc1cccc(C)c1	ZINC000853825200	DD	On-Demand	Anodyne	PDS	65	43
C#CCNC(=O)c1ccc(N2CCN(c3ccc(Br)cc3)CC2)nc1	ZINC000853825211	GF	On-Demand	Mild	PRNP	47	34
C#CCNC(=O)c1ccc(N2CCN(c3ccc(Br)cc3)CC2)nc1	ZINC000853825211	GF	On-Demand	Mild	HPGDS	15	40
C[C@@H]1CN(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)[C@H](C)CO1	ZINC000853825217	GD	On-Demand	Anodyne	KCNQ2	72	37
O=C(Nc1cccc(Br)c1)N[C@H]1C=CCC1	ZINC000853825230	CG	On-Demand	Anodyne	CCKBR	23	40
O=C(Nc1cccc(Br)c1)N[C@H]1C=CCC1	ZINC000853825230	CG	On-Demand	Anodyne	EPHX2	22	47
O=C(Nc1cccc(Br)c1)N[C@@H]1C=CCC1	ZINC000853825231	CG	On-Demand	Anodyne	CCKBR	23	40
O=C(Nc1cccc(Br)c1)N[C@@H]1C=CCC1	ZINC000853825231	CG	On-Demand	Anodyne	EPHX2	22	47
CN(C)C(=O)OCCNc1nc(-c2ccccn2)nc2c1CCC2	ZINC000853825261	EE	On-Demand	Anodyne	METAP1	26	40
CN(C)C(=O)OCCNc1cccc([N+](=O)[O-])c1S(N)(=O)=O	ZINC000853825296	EC	On-Demand	Bother	COLA	89	33
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853825307	EC	On-Demand	Bother	CA2	48	42
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853825307	EC	On-Demand	Bother	CA1	44	38
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853825307	EC	On-Demand	Bother	COLA	43	30
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853825307	EC	On-Demand	Bother	CA4	50	38
C[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825329	DH	On-Demand	Anodyne	CA1	33	40
C[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825329	DH	On-Demand	Anodyne	PRNP	33	40
C[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825329	DH	On-Demand	Anodyne	ROCK2	21	45
C[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825329	DH	On-Demand	Anodyne	SLC1A2	22	42
C[C@@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825329	DH	On-Demand	Anodyne	NCE103	15	40
C[C@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825330	DH	On-Demand	Anodyne	CA1	33	40
C[C@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825330	DH	On-Demand	Anodyne	PRNP	33	40
C[C@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825330	DH	On-Demand	Anodyne	ROCK2	21	45
C[C@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825330	DH	On-Demand	Anodyne	SLC1A2	22	42
C[C@H](CCNC(=O)Nc1ccc(-c2ccccc2)cc1)N(C)C	ZINC000853825330	DH	On-Demand	Anodyne	NCE103	15	40
CN(C)C(=O)OCCNc1cc2ccccc2c(Cl)n1	ZINC000853825331	CF	On-Demand	Anodyne	NCEH1	45	40
Cc1nc(NCCOC(=O)N(C)C)cc(-c2cccnc2)n1	ZINC000853825340	DD	On-Demand	Anodyne	PTGDR	16	45
Cc1nc(NCCOC(=O)N(C)C)cc(-c2cccnc2)n1	ZINC000853825340	DD	On-Demand	Anodyne	ROS1	59	40
Cc1nc(NCCOC(=O)N(C)C)cc(-c2cccnc2)n1	ZINC000853825340	DD	On-Demand	Anodyne	VCP	17	41
CN(C)C(=O)OCCNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853825347	CD	On-Demand	Bother	GSTM2	126	46
CN(C)C(=O)OCCNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853825347	CD	On-Demand	Bother	GSTP1	79	44
CN(C)C(=O)OCCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-]	ZINC000853825349	FD	On-Demand	Bother	COLA	54	30
CN(C)C(=O)OCCNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2	ZINC000853825350	DD	On-Demand	Bother	PKM	26	40
O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1C=CCC1	ZINC000853825370	CG	On-Demand	Anodyne	MAOB	16	43
O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1C=CCC1	ZINC000853825370	CG	On-Demand	Anodyne	EPHX2	36	45
O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1C=CCC1	ZINC000853825370	CG	On-Demand	Anodyne	ENV	42	37
O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1C=CCC1	ZINC000853825370	CG	On-Demand	Anodyne	MCHR1	23	40
O=C(Nc1ccc(F)c(Cl)c1)N[C@H]1C=CCC1	ZINC000853825371	CG	On-Demand	Anodyne	MAOB	16	43
O=C(Nc1ccc(F)c(Cl)c1)N[C@H]1C=CCC1	ZINC000853825371	CG	On-Demand	Anodyne	EPHX2	36	45
O=C(Nc1ccc(F)c(Cl)c1)N[C@H]1C=CCC1	ZINC000853825371	CG	On-Demand	Anodyne	ENV	42	37
O=C(Nc1ccc(F)c(Cl)c1)N[C@H]1C=CCC1	ZINC000853825371	CG	On-Demand	Anodyne	MCHR1	23	40
C[C@@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825373	ED	On-Demand	Anodyne	ADRA1D	25	40
C[C@@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825373	ED	On-Demand	Anodyne	ADRA1A	20	40
C[C@@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825373	ED	On-Demand	Anodyne	DRD3	46	36
C[C@@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825373	ED	On-Demand	Anodyne	KCNQ2	86	46
C[C@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825374	ED	On-Demand	Anodyne	ADRA1D	25	40
C[C@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825374	ED	On-Demand	Anodyne	ADRA1A	20	40
C[C@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825374	ED	On-Demand	Anodyne	DRD3	46	36
C[C@H](CCNC(=O)Nc1ccccc1N1CCN(C)CC1)N(C)C	ZINC000853825374	ED	On-Demand	Anodyne	KCNQ2	86	46
CN(C)C(=O)OCCN=c1c(C#N)c[nH]c2c(F)ccc(Cl)c12	ZINC000853825392	EE	On-Demand	Mild	HSP90AB1	46	35
CC(=O)Nc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825394	CE	On-Demand	Anodyne	EPHX2	31	47
CC(=O)Nc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825394	CE	On-Demand	Anodyne	KCNK3	81	35
CC(=O)Nc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825394	CE	On-Demand	Anodyne	KCNK9	48	35
CC(=O)Nc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825395	CE	On-Demand	Anodyne	EPHX2	31	47
CC(=O)Nc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825395	CE	On-Demand	Anodyne	KCNK3	81	35
CC(=O)Nc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825395	CE	On-Demand	Anodyne	KCNK9	48	35
CN(C)C(=O)OCCNc1ncnc2ccc(F)cc12	ZINC000853825415	CD	On-Demand	Anodyne	EGFR	69	41
CN(C)C(=O)OCCNc1ncnc2ccc(F)cc12	ZINC000853825415	CD	On-Demand	Anodyne	ERBB2	43	41
CN(C)C(=O)OCCNc1ncnc2ccc(F)cc12	ZINC000853825415	CD	On-Demand	Anodyne	ERBB4	43	34
CN(C)C(=O)OCCNc1ncnc2ccc(F)cc12	ZINC000853825415	CD	On-Demand	Anodyne	CLK4	62	40
CN(C)C(=O)OCCNc1ncnc2ccc(F)cc12	ZINC000853825415	CD	On-Demand	Anodyne	CD38	24	43
O=C(Nc1ccc(Cl)cc1Cl)N[C@@H]1C=CCC1	ZINC000853825421	CH	On-Demand	Anodyne	PYGL	16	48
O=C(Nc1ccc(Cl)cc1Cl)N[C@@H]1C=CCC1	ZINC000853825421	CH	On-Demand	Anodyne	EPHX2	21	42
O=C(Nc1ccc(Cl)cc1Cl)N[C@H]1C=CCC1	ZINC000853825422	CH	On-Demand	Anodyne	PYGL	16	48
O=C(Nc1ccc(Cl)cc1Cl)N[C@H]1C=CCC1	ZINC000853825422	CH	On-Demand	Anodyne	EPHX2	21	42
CN(C)C(=O)OCCNc1ccnc2cc(F)ccc12	ZINC000853825451	CE	On-Demand	Anodyne	HRP1_PLAFA	113	38
CN(C)C(=O)OCCNc1ccnc2cc(F)ccc12	ZINC000853825451	CE	On-Demand	Anodyne	HNMT	56	36
CN(C)C(=O)OCCNc1nc(N)c2ccccc2n1	ZINC000853825457	CD	On-Demand	Anodyne	TACR3	49	37
Cc1nc(NC(=O)NCC[C@@H](C)N(C)C)sc1-c1ccccc1	ZINC000853825507	EH	On-Demand	Anodyne	PIK3CG	21	48
Cc1nc(NC(=O)NCC[C@@H](C)N(C)C)sc1-c1ccccc1	ZINC000853825507	EH	On-Demand	Anodyne	PI4KB	40	45
Cc1nc(NC(=O)NCC[C@H](C)N(C)C)sc1-c1ccccc1	ZINC000853825508	EH	On-Demand	Anodyne	PIK3CG	21	48
Cc1nc(NC(=O)NCC[C@H](C)N(C)C)sc1-c1ccccc1	ZINC000853825508	EH	On-Demand	Anodyne	PI4KB	40	45
CN1CCN(c2ccccc2NC(=O)N[C@H]2C=CCC2)CC1	ZINC000853825512	DE	On-Demand	Anodyne	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C=CCC2)CC1	ZINC000853825514	DE	On-Demand	Anodyne	KCNQ2	76	41
C[C@@H](CCNC(=O)C(=O)OC(C)(C)C)N(C)C	ZINC000853825526	BC	On-Demand	Anodyne	CHRNA4	21	43
Cc1nc(NC(=O)NCCN(C)CCCN(C)C)sc1-c1ccccc1	ZINC000853825529	GG	On-Demand	Anodyne	PIK3CG	19	47
Cc1nc(NC(=O)NCCN(C)CCCN(C)C)sc1-c1ccccc1	ZINC000853825529	GG	On-Demand	Anodyne	PI4KB	38	44
CN(C)C(=O)OCCNc1cc(N2CCOCC2)ncn1	ZINC000853825540	CC	On-Demand	Anodyne	EPHB4	53	34
CN(C)C(=O)OCCNc1nc(-c2ccc(F)cc2)cs1	ZINC000853825552	DG	On-Demand	Anodyne	ROCK1	20	43
CN(C)C(=O)OCCNc1nc(-c2ccc(F)cc2)cs1	ZINC000853825552	DG	On-Demand	Anodyne	ROCK2	15	43
O=C(Nc1nccs1)N[C@@H]1C=CCC1	ZINC000853825553	BD	On-Demand	Anodyne	MAP1	108	42
O=C(Nc1nccs1)N[C@H]1C=CCC1	ZINC000853825554	BD	On-Demand	Anodyne	MAP1	108	42
CN(C)C(=O)OCCNc1ncnc2ccc(Br)cc12	ZINC000853825561	EF	On-Demand	Anodyne	EGFR	111	43
CN(C)C(=O)OCCNc1ncnc2ccc(Br)cc12	ZINC000853825561	EF	On-Demand	Anodyne	ERBB2	32	42
CN(C)C(=O)OCCNc1ncnc2ccc(Br)cc12	ZINC000853825561	EF	On-Demand	Anodyne	CLK4	62	37
CN(C)C(=O)OCCNc1ncnc2ccc(Br)cc12	ZINC000853825561	EF	On-Demand	Anodyne	CD38	22	43
CN(C)C(=O)OCCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000853825562	EE	On-Demand	Anodyne	MAPK8	15	40
CN(C)C(=O)OCCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000853825562	EE	On-Demand	Anodyne	RPS27	23	40
CN(C)C(=O)OCCNc1ccnc(C(=O)NCc2ccccc2)c1	ZINC000853825562	EE	On-Demand	Anodyne	PDS	45	36
CN(C)C(=O)OCCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000853825601	FD	On-Demand	Anodyne	TGM2	27	42
CN(C)C(=O)OCCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000853825601	FD	On-Demand	Anodyne	GCKR	50	32
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA2	111	64
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA1	99	64
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA7	62	43
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA5B	42	43
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA4	78	54
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA5A	48	43
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA14	58	45
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA12	90	64
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CA9	89	64
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CAH_METTE	18	40
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	UREA_CANEN	26	40
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	CYNT	41	45
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	NCE103	43	46
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	MTCA1	65	64
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825640	CD	On-Demand	Anodyne	P96878_MYCTU	81	64
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA2	111	64
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA1	99	64
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA7	62	43
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA5B	42	43
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA4	78	54
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA5A	48	43
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA14	58	45
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA12	90	64
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CA9	89	64
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CAH_METTE	18	40
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	UREA_CANEN	26	40
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	CYNT	41	45
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	NCE103	43	46
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	MTCA1	65	64
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825641	CD	On-Demand	Anodyne	P96878_MYCTU	81	64
COc1ccccc1NC(=O)N[C@H]1C=CCC1	ZINC000853825647	BF	On-Demand	Anodyne	PDGFRA	15	41
COc1ccccc1NC(=O)N[C@@H]1C=CCC1	ZINC000853825648	BF	On-Demand	Anodyne	PDGFRA	15	41
O=C(Nc1ccc(Cl)cc1)N[C@H]1C=CCC1	ZINC000853825649	BG	On-Demand	Anodyne	EPHX2	45	48
O=C(Nc1ccc(Cl)cc1)N[C@@H]1C=CCC1	ZINC000853825650	BG	On-Demand	Anodyne	EPHX2	45	48
CN(C)C(=O)OCCNc1ccnc(N2CCOCC2)n1	ZINC000853825651	CC	On-Demand	Anodyne	EPHB4	83	34
CN(C)C(=O)OCCNc1ccnc(N2CCOCC2)n1	ZINC000853825651	CC	On-Demand	Anodyne	STAT6	46	32
CN1CCN(c2nc3ccccc3nc2NCCOC(=O)N(C)C)CC1	ZINC000853825668	FD	On-Demand	Anodyne	HTR3A	31	47
CN1CCN(c2nc3ccccc3nc2NCCOC(=O)N(C)C)CC1	ZINC000853825668	FD	On-Demand	Anodyne	HRH4	32	47
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C#N	ZINC000853825691	DC	On-Demand	Mild	CA2	49	38
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C#N	ZINC000853825691	DC	On-Demand	Mild	CA1	42	38
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C#N	ZINC000853825691	DC	On-Demand	Mild	CA4	48	38
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825694	CD	On-Demand	Anodyne	CA2	16	47
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825694	CD	On-Demand	Anodyne	CA1	19	40
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825694	CD	On-Demand	Anodyne	EPHX2	38	43
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825694	CD	On-Demand	Anodyne	CA12	22	47
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825694	CD	On-Demand	Anodyne	CA9	22	47
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825694	CD	On-Demand	Anodyne	MTCA1	45	47
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2C=CCC2)cc1	ZINC000853825694	CD	On-Demand	Anodyne	P96878_MYCTU	56	47
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825695	CD	On-Demand	Anodyne	CA2	16	47
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825695	CD	On-Demand	Anodyne	CA1	19	40
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825695	CD	On-Demand	Anodyne	EPHX2	38	43
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825695	CD	On-Demand	Anodyne	CA12	22	47
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825695	CD	On-Demand	Anodyne	CA9	22	47
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825695	CD	On-Demand	Anodyne	MTCA1	45	47
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C=CCC2)cc1	ZINC000853825695	CD	On-Demand	Anodyne	P96878_MYCTU	56	47
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	CA2	44	59
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	CA1	38	46
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	CA4	34	53
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	CA5A	43	31
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	CA12	39	59
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	CA9	40	59
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	TTK	21	40
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	MTCA1	47	46
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853825696	CD	On-Demand	Anodyne	P96878_MYCTU	58	46
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	CA2	44	59
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	CA1	38	46
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	CA4	34	53
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	CA5A	43	31
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	CA12	39	59
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	CA9	40	59
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	TTK	21	40
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	MTCA1	47	46
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853825697	CD	On-Demand	Anodyne	P96878_MYCTU	58	46
COC(=O)c1cc(NC(=O)N[C@@H]2C=CCC2)cc(C(=O)OC)c1	ZINC000853825706	DE	On-Demand	Anodyne	EPHX2	16	50
COC(=O)c1cc(NC(=O)N[C@H]2C=CCC2)cc(C(=O)OC)c1	ZINC000853825707	DE	On-Demand	Anodyne	EPHX2	16	50
O=C(Nc1nc2c(s1)CCCCC2)N[C@H]1C=CCC1	ZINC000853825718	CG	On-Demand	Anodyne	SLC27A1	31	40
O=C(Nc1nc2c(s1)CCCCC2)N[C@@H]1C=CCC1	ZINC000853825719	CG	On-Demand	Anodyne	SLC27A1	31	40
C[C@@H](CCNC(=O)C(C)(F)F)N(C)C	ZINC000853825725	BD	On-Demand	Anodyne	CHRNA4	22	43
CN(C)C(=O)OCCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000853825731	ED	On-Demand	Bother	COLA	43	31
C[C@H]1CN(c2ccc(NC(=O)NCC[C@@H](C)N(C)C)cc2F)C[C@@H](C)O1	ZINC000853825771	FF	On-Demand	Anodyne	NPY2R	78	39
C[C@@H](CCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)N(C)C	ZINC000853825773	FF	On-Demand	Anodyne	NPY2R	78	39
C[C@H]1CN(c2ccc(NC(=O)NCC[C@H](C)N(C)C)cc2F)C[C@@H](C)O1	ZINC000853825774	FF	On-Demand	Anodyne	NPY2R	78	39
CN(C)C(=O)OCCNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000853825785	EC	On-Demand	Bother	CA2	21	40
CN(C)C(=O)OCCNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000853825785	EC	On-Demand	Bother	CA1	17	40
CN(C)C(=O)OCCNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000853825785	EC	On-Demand	Bother	CA12	16	40
CN(C)C(=O)OCCNc1cc([N+](=O)[O-])cc(S(N)(=O)=O)c1	ZINC000853825785	EC	On-Demand	Bother	CA9	20	40
C[C@@H](CCNC(=O)C(=O)C1CCSCC1)N(C)C	ZINC000853825794	CD	On-Demand	Anodyne	CHRNA4	19	40
CN(C)C(=O)OCCNc1ccc(C(=O)NC2CC2)cn1	ZINC000853825810	CD	On-Demand	Anodyne	MAPK11	20	40
CN(C)C(=O)OCCNc1ccc(C(=O)NC2CC2)cn1	ZINC000853825810	CD	On-Demand	Anodyne	MAPK14	35	40
CN(C)C(=O)OCCNc1ccc(C(=O)NC2CC2)cn1	ZINC000853825810	CD	On-Demand	Anodyne	SSTR5	37	42
CN(C)C(=O)OCCNc1ccc(C(=O)NC2CC2)cn1	ZINC000853825810	CD	On-Demand	Anodyne	MAPK13	53	33
CN(C)C(=O)OCCNc1ncnc2cc(Cl)ccc12	ZINC000853825813	CE	On-Demand	Anodyne	EGFR	59	39
CN(C)C(=O)OCCNc1ncnc2cc(Cl)ccc12	ZINC000853825813	CE	On-Demand	Anodyne	HRP1_PLAFA	62	34
CN(C)C(=O)OCCNc1ncnc2cc(Cl)ccc12	ZINC000853825813	CE	On-Demand	Anodyne	ERBB4	43	34
CN(C)C(=O)OCCNc1cnn(-c2ccc(F)cc2F)c(=O)c1Cl	ZINC000853825820	FE	On-Demand	Anodyne	MAPK14	16	42
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1C=CCC1	ZINC000853825821	CH	On-Demand	Anodyne	TRPV1	21	47
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1C=CCC1	ZINC000853825821	CH	On-Demand	Anodyne	EPHX2	67	56
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1C=CCC1	ZINC000853825821	CH	On-Demand	Anodyne	TRPM8	47	37
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1C=CCC1	ZINC000853825821	CH	On-Demand	Anodyne	MTCA1	15	47
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1C=CCC1	ZINC000853825822	CH	On-Demand	Anodyne	TRPV1	21	47
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1C=CCC1	ZINC000853825822	CH	On-Demand	Anodyne	EPHX2	67	56
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1C=CCC1	ZINC000853825822	CH	On-Demand	Anodyne	TRPM8	47	37
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1C=CCC1	ZINC000853825822	CH	On-Demand	Anodyne	MTCA1	15	47
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3C=CCC3)cc2F)C[C@@H](C)O1	ZINC000853825837	EG	On-Demand	Anodyne	NPY2R	56	35
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3C=CCC3)cc2F)C[C@@H](C)O1	ZINC000853825840	EG	On-Demand	Anodyne	NPY2R	56	35
CN(C)C(=O)OCCNc1ccnc2cc(Br)ccc12	ZINC000853825859	EG	On-Demand	Anodyne	HRP1_PLAFA	114	38
CN(C)C(=O)OCCNc1ccnc2cc(Br)ccc12	ZINC000853825859	EG	On-Demand	Anodyne	HNMT	56	36
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@@H]1C=CCC1	ZINC000853825860	DF	On-Demand	Anodyne	CCKBR	65	39
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@H]1C=CCC1	ZINC000853825861	DF	On-Demand	Anodyne	CCKBR	65	39
COc1ncccc1NC(=O)N[C@@H]1C=CCC1	ZINC000853825871	BD	On-Demand	Anodyne	P2RY1	45	40
COc1ncccc1NC(=O)N[C@H]1C=CCC1	ZINC000853825872	BD	On-Demand	Anodyne	P2RY1	45	40
CN(C)C(=O)OCCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000853825874	FE	On-Demand	Anodyne	AVPR2	95	42
CN(C)C(=O)OCCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000853825874	FE	On-Demand	Anodyne	AVPR1A	58	41
O=C(Nc1ncc(Cc2ccc(F)cc2)s1)N[C@@H]1C=CCC1	ZINC000853825881	DH	On-Demand	Anodyne	CDK5	48	37
O=C(Nc1ncc(Cc2ccc(F)cc2)s1)N[C@H]1C=CCC1	ZINC000853825882	DH	On-Demand	Anodyne	CDK5	48	37
CN(C)C(=O)OCCNc1ncnc2ccc(I)cc12	ZINC000853825893	GE	On-Demand	Anodyne	EGFR	40	41
CN(C)C(=O)OCCNc1ncnc2ccc(I)cc12	ZINC000853825893	GE	On-Demand	Anodyne	CLK4	61	37
CN(C)C(=O)OCCNc1ncnc2ccc(I)cc12	ZINC000853825893	GE	On-Demand	Anodyne	CD38	33	45
CN(C)C(=O)OCCNc1ncccc1OCc1ccccc1	ZINC000853825896	DF	On-Demand	Anodyne	ADRA1D	17	42
CN(C)C(=O)OCCNc1ncccc1OCc1ccccc1	ZINC000853825896	DF	On-Demand	Anodyne	ADRA1A	15	42
CN(C)C(=O)OCCNc1ncccc1OCc1ccccc1	ZINC000853825896	DF	On-Demand	Anodyne	PPIA	54	53
CN(C)C(=O)OCCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853825897	FC	On-Demand	Bother	COLA	61	32
CN(C)C(=O)OCCNc1ccc2cc(C#N)ccc2n1	ZINC000853825915	CE	On-Demand	Mild	NCEH1	20	45
COCc1cc([N+](=O)[O-])ccc1NCCOC(=O)N(C)C	ZINC000853825919	CD	On-Demand	Bother	CACNA1D	66	36
CN(C)C(=O)OCCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853825921	EE	On-Demand	Anodyne	ADRA2A	15	46
CN(C)C(=O)OCCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853825921	EE	On-Demand	Anodyne	ACACB	15	41
CN(C)C(=O)OCCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853825921	EE	On-Demand	Anodyne	TACR3	50	38
CN(C)C(=O)OCCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853825921	EE	On-Demand	Anodyne	METG	93	33
CN(C)C(=O)OCCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853825921	EE	On-Demand	Anodyne	TNKS	57	32
CCO[C@H]1C[C@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCCCC2	ZINC000853825924	GG	On-Demand	Anodyne	TIMP3	48	35
CCO[C@H]1C[C@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCCCC2	ZINC000853825924	GG	On-Demand	Anodyne	HCN1	55	34
CCO[C@H]1C[C@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCCCC2	ZINC000853825924	GG	On-Demand	Anodyne	HCN4	53	34
CCO[C@H]1C[C@@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCCCC2	ZINC000853825925	GG	On-Demand	Anodyne	TIMP3	48	35
CCO[C@H]1C[C@@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCCCC2	ZINC000853825925	GG	On-Demand	Anodyne	HCN1	55	34
CCO[C@H]1C[C@@H](NC(=O)NC[C@@H](O)c2ccccc2OC)C12CCCCC2	ZINC000853825925	GG	On-Demand	Anodyne	HCN4	53	34
CN(C)C(=O)OCCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000853825939	ED	On-Demand	Anodyne	P2RY12	89	36
CN(C)C(=O)OCCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853825945	FD	On-Demand	Bother	BCL2L1	30	42
CN(C)C(=O)OCCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853825945	FD	On-Demand	Bother	BCL2	22	41
CN(C)C(=O)OCCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000853825960	GD	On-Demand	Bother	TBXA2R	23	40
CN(C)C(=O)OCCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000853825968	ED	On-Demand	Bother	TAAR1	19	44
CN(C)C(=O)OCCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000853825978	FE	On-Demand	Anodyne	NPBWR1	34	41
CN(C)C(=O)OCCNc1nc(-c2ccccc2)cs1	ZINC000853825989	CF	On-Demand	Anodyne	ROCK1	22	47
CN(C)C(=O)OCCNc1nc(-c2ccccc2)cs1	ZINC000853825989	CF	On-Demand	Anodyne	ROCK2	17	47
CN(C)C(=O)OCCNc1nc(-c2ccccc2)cs1	ZINC000853825989	CF	On-Demand	Anodyne	NPY5R	16	41
CN(C)C(=O)OCCNc1nc(-c2ccccc2)cs1	ZINC000853825989	CF	On-Demand	Anodyne	VCP	44	42
CC(=O)c1ccc(NCCOC(=O)N(C)C)c([N+](=O)[O-])c1	ZINC000853825992	CD	On-Demand	Bother	TAAR1	18	46
Cc1ccc(NC(=O)c2ccc(NCCOC(=O)N(C)C)c([N+](=O)[O-])c2)cc1	ZINC000853825993	GG	On-Demand	Bother	TAAR1	22	52
O=C(Nc1ccc2c(c1)OCO2)N[C@@H]1C=CCC1	ZINC000853826011	BE	On-Demand	Anodyne	EPHX2	15	54
O=C(Nc1ccc2c(c1)OCO2)N[C@H]1C=CCC1	ZINC000853826012	BE	On-Demand	Anodyne	EPHX2	15	54
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@@H]1C=CCC1	ZINC000853826045	DH	On-Demand	Anodyne	CDK5	47	36
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@@H]1C=CCC1	ZINC000853826045	DH	On-Demand	Anodyne	SCD1	37	40
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@@H]1C=CCC1	ZINC000853826045	DH	On-Demand	Anodyne	SCD	34	42
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@H]1C=CCC1	ZINC000853826046	DH	On-Demand	Anodyne	CDK5	47	36
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@H]1C=CCC1	ZINC000853826046	DH	On-Demand	Anodyne	SCD1	37	40
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@H]1C=CCC1	ZINC000853826046	DH	On-Demand	Anodyne	SCD	34	42
Cc1nc(NC(=O)N[C@@H]2C=CCC2)sc1-c1ccccc1	ZINC000853826052	CH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N[C@@H]2C=CCC2)sc1-c1ccccc1	ZINC000853826052	CH	On-Demand	Anodyne	PI4KB	40	37
Cc1nc(NC(=O)N[C@H]2C=CCC2)sc1-c1ccccc1	ZINC000853826053	CH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N[C@H]2C=CCC2)sc1-c1ccccc1	ZINC000853826053	CH	On-Demand	Anodyne	PI4KB	40	37
CN(C)C(=O)OCCNc1nccc2ccc(F)cc12	ZINC000853826055	CE	On-Demand	Anodyne	NCEH1	50	32
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	CCKAR	20	43
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	CCR3	26	46
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	MTNR1A	35	49
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	MTNR1B	37	49
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	CCKBR	26	43
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	EPHX2	43	53
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	PDGFRA	20	43
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	TAAR1	43	47
COc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826064	BF	On-Demand	Anodyne	KCNK3	41	44
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	CCKAR	20	43
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	CCR3	26	46
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	MTNR1A	35	49
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	MTNR1B	37	49
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	CCKBR	26	43
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	EPHX2	43	53
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	PDGFRA	20	43
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	TAAR1	43	47
COc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826065	BF	On-Demand	Anodyne	KCNK3	41	44
O=C(Nc1ccc(Cl)nc1)N[C@@H]1C=CCC1	ZINC000853826073	BF	On-Demand	Anodyne	EPHX2	21	43
O=C(Nc1ccc(Cl)nc1)N[C@H]1C=CCC1	ZINC000853826074	BF	On-Demand	Anodyne	EPHX2	21	43
CN(C)C(=O)OCCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000853826075	FE	On-Demand	Anodyne	ADRA1D	16	44
CN(C)C(=O)OCCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000853826075	FE	On-Demand	Anodyne	AVPR2	43	38
CN(C)C(=O)OCCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000853826075	FE	On-Demand	Anodyne	GPBAR1	26	44
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@@H]1C=CCC1	ZINC000853826077	DD	On-Demand	Anodyne	NPY1R	32	46
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@H]1C=CCC1	ZINC000853826078	DD	On-Demand	Anodyne	NPY1R	32	46
COc1ccc2c(NCCOC(=O)N(C)C)ccnc2c1	ZINC000853826081	CE	On-Demand	Anodyne	HRP1_PLAFA	122	48
COc1ccc2c(NCCOC(=O)N(C)C)ccnc2c1	ZINC000853826081	CE	On-Demand	Anodyne	KDR	53	38
COc1ccc2c(NCCOC(=O)N(C)C)ccnc2c1	ZINC000853826081	CE	On-Demand	Anodyne	MTNR1A	28	44
COc1ccc2c(NCCOC(=O)N(C)C)ccnc2c1	ZINC000853826081	CE	On-Demand	Anodyne	MTNR1B	21	44
COc1ccc2c(NCCOC(=O)N(C)C)ccnc2c1	ZINC000853826081	CE	On-Demand	Anodyne	HNMT	65	38
COc1ccc2c(NCCOC(=O)N(C)C)ccnc2c1	ZINC000853826081	CE	On-Demand	Anodyne	PDGFRA	46	40
COc1ccc2c(NCCOC(=O)N(C)C)ccnc2c1	ZINC000853826081	CE	On-Demand	Anodyne	BOTA	19	41
O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1C=CCC1	ZINC000853826090	BE	On-Demand	Bother	NMBR	55	33
O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1C=CCC1	ZINC000853826091	BE	On-Demand	Bother	NMBR	55	33
CN(C)C(=O)OCCNc1nccc(N2CCCC2)n1	ZINC000853826101	CD	On-Demand	Anodyne	SORD	58	37
CN(C)C(=O)OCCNc1nccc(N2CCCC2)n1	ZINC000853826101	CD	On-Demand	Anodyne	MRGPRX1	45	39
O=C(Nc1cccc(Cl)c1)N[C@H]1C=CCC1	ZINC000853826106	BG	On-Demand	Anodyne	PPIA	17	43
O=C(Nc1cccc(Cl)c1)N[C@H]1C=CCC1	ZINC000853826106	BG	On-Demand	Anodyne	CCKAR	16	40
O=C(Nc1cccc(Cl)c1)N[C@H]1C=CCC1	ZINC000853826106	BG	On-Demand	Anodyne	CCKBR	24	40
O=C(Nc1cccc(Cl)c1)N[C@H]1C=CCC1	ZINC000853826106	BG	On-Demand	Anodyne	EPHX2	30	64
O=C(Nc1cccc(Cl)c1)N[C@H]1C=CCC1	ZINC000853826106	BG	On-Demand	Anodyne	KCNK3	26	41
O=C(Nc1cccc(Cl)c1)N[C@@H]1C=CCC1	ZINC000853826107	BG	On-Demand	Anodyne	PPIA	17	43
O=C(Nc1cccc(Cl)c1)N[C@@H]1C=CCC1	ZINC000853826107	BG	On-Demand	Anodyne	CCKAR	16	40
O=C(Nc1cccc(Cl)c1)N[C@@H]1C=CCC1	ZINC000853826107	BG	On-Demand	Anodyne	CCKBR	24	40
O=C(Nc1cccc(Cl)c1)N[C@@H]1C=CCC1	ZINC000853826107	BG	On-Demand	Anodyne	EPHX2	30	64
O=C(Nc1cccc(Cl)c1)N[C@@H]1C=CCC1	ZINC000853826107	BG	On-Demand	Anodyne	KCNK3	26	41
CN(C)C(=O)OCCNc1ncnc2cc(F)c(Br)cc12	ZINC000853826113	FF	On-Demand	Anodyne	EGFR	60	37
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@@H]1C=CCC1	ZINC000853826117	CG	On-Demand	Anodyne	P2RY1	66	44
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@@H]1C=CCC1	ZINC000853826117	CG	On-Demand	Anodyne	EPHX2	96	64
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@@H]1C=CCC1	ZINC000853826117	CG	On-Demand	Anodyne	GIPR	30	40
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@H]1C=CCC1	ZINC000853826118	CG	On-Demand	Anodyne	P2RY1	66	44
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@H]1C=CCC1	ZINC000853826118	CG	On-Demand	Anodyne	EPHX2	96	64
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@H]1C=CCC1	ZINC000853826118	CG	On-Demand	Anodyne	GIPR	30	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853826125	FD	On-Demand	Anodyne	CA2	53	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853826125	FD	On-Demand	Anodyne	CA1	45	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853826125	FD	On-Demand	Anodyne	CA4	56	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853826125	FD	On-Demand	Anodyne	CA12	24	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853826125	FD	On-Demand	Anodyne	CA9	25	40
CN(C)C(=O)OCCNc1nccc(N2CCOCC2)n1	ZINC000853826143	CC	On-Demand	Anodyne	EPHB4	92	42
CN(C)C(=O)OCCNc1nccc(N2CCOCC2)n1	ZINC000853826143	CC	On-Demand	Anodyne	STAT6	53	34
CN(C)C(=O)OCCNc1nccc(N2CCOCC2)n1	ZINC000853826143	CC	On-Demand	Anodyne	MRGPRX1	45	39
CN(C)C(=O)OCCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000853826153	DE	On-Demand	Mild	MAP3K8	83	38
O=C(Nc1ccccc1Cl)N[C@@H]1C=CCC1	ZINC000853826154	BG	On-Demand	Anodyne	EPHB3	54	33
O=C(Nc1ccccc1Cl)N[C@H]1C=CCC1	ZINC000853826155	BG	On-Demand	Anodyne	EPHB3	54	33
CN(C)C(=O)OCCNc1ncnc2ccc([N+](=O)[O-])cc12	ZINC000853826156	DD	On-Demand	Bother	CLK4	56	36
COC(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826170	CE	On-Demand	Anodyne	CCKAR	17	41
COC(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826170	CE	On-Demand	Anodyne	CCR3	25	42
COC(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826170	CE	On-Demand	Anodyne	CCKBR	31	44
COC(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826170	CE	On-Demand	Anodyne	EPHX2	33	54
COC(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826170	CE	On-Demand	Anodyne	KCNK3	90	35
COC(=O)c1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826170	CE	On-Demand	Anodyne	KCNK9	52	34
COC(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826171	CE	On-Demand	Anodyne	CCKAR	17	41
COC(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826171	CE	On-Demand	Anodyne	CCR3	25	42
COC(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826171	CE	On-Demand	Anodyne	CCKBR	31	44
COC(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826171	CE	On-Demand	Anodyne	EPHX2	33	54
COC(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826171	CE	On-Demand	Anodyne	KCNK3	90	35
COC(=O)c1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826171	CE	On-Demand	Anodyne	KCNK9	52	34
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853826174	FB	On-Demand	Anodyne	CA2	65	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853826174	FB	On-Demand	Anodyne	CA1	58	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853826174	FB	On-Demand	Anodyne	CA7	43	35
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853826174	FB	On-Demand	Anodyne	CA5B	47	35
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853826174	FB	On-Demand	Anodyne	CA4	66	40
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853826174	FB	On-Demand	Anodyne	CA5A	49	35
CN(C)C(=O)OCCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853826174	FB	On-Demand	Anodyne	CA9	33	40
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@@H]1C=CCC1	ZINC000853826176	CH	On-Demand	Anodyne	CDK5	54	45
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@@H]1C=CCC1	ZINC000853826176	CH	On-Demand	Anodyne	MGEA5	34	41
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@H]1C=CCC1	ZINC000853826177	CH	On-Demand	Anodyne	CDK5	54	45
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@H]1C=CCC1	ZINC000853826177	CH	On-Demand	Anodyne	MGEA5	34	41
O=C(Nc1ccc(F)cc1)N[C@H]1C=CCC1	ZINC000853826182	BF	On-Demand	Anodyne	SSTR3	15	43
O=C(Nc1ccc(F)cc1)N[C@H]1C=CCC1	ZINC000853826182	BF	On-Demand	Anodyne	EPHX2	48	49
O=C(Nc1ccc(F)cc1)N[C@H]1C=CCC1	ZINC000853826182	BF	On-Demand	Anodyne	MTCA1	18	43
O=C(Nc1ccc(F)cc1)N[C@@H]1C=CCC1	ZINC000853826183	BF	On-Demand	Anodyne	SSTR3	15	43
O=C(Nc1ccc(F)cc1)N[C@@H]1C=CCC1	ZINC000853826183	BF	On-Demand	Anodyne	EPHX2	48	49
O=C(Nc1ccc(F)cc1)N[C@@H]1C=CCC1	ZINC000853826183	BF	On-Demand	Anodyne	MTCA1	18	43
O=C(Nc1ccc(N2CCCC2)nc1)N[C@@H]1C=CCC1	ZINC000853826184	CF	On-Demand	Anodyne	DGAT1	45	42
O=C(Nc1ccc(N2CCCC2)nc1)N[C@H]1C=CCC1	ZINC000853826185	CF	On-Demand	Anodyne	DGAT1	45	42
CN(C)C(=O)OCCNc1cc(C#N)c2ccccc2n1	ZINC000853826190	CE	On-Demand	Mild	METG	83	42
CN(C)C(=O)OCCNc1nc2ccccc2nc1N1CCOCC1	ZINC000853826197	ED	On-Demand	Anodyne	PIK3CA	43	41
CN(C)C(=O)OCCNc1nc2ccccc2nc1N1CCOCC1	ZINC000853826197	ED	On-Demand	Anodyne	MTOR	51	36
CN(C)C(=O)OCCNc1nc2ccccc2nc1N1CCOCC1	ZINC000853826197	ED	On-Demand	Anodyne	STAT6	44	34
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826226	BF	On-Demand	Anodyne	CCKAR	41	46
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826226	BF	On-Demand	Anodyne	KDR	20	41
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826226	BF	On-Demand	Anodyne	CCKBR	64	45
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826226	BF	On-Demand	Anodyne	EPHX2	34	53
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826226	BF	On-Demand	Anodyne	KCNK3	72	43
Cc1cccc(NC(=O)N[C@@H]2C=CCC2)c1	ZINC000853826226	BF	On-Demand	Anodyne	KCNK9	51	43
Cc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826227	BF	On-Demand	Anodyne	CCKAR	41	46
Cc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826227	BF	On-Demand	Anodyne	KDR	20	41
Cc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826227	BF	On-Demand	Anodyne	CCKBR	64	45
Cc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826227	BF	On-Demand	Anodyne	EPHX2	34	53
Cc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826227	BF	On-Demand	Anodyne	KCNK3	72	43
Cc1cccc(NC(=O)N[C@H]2C=CCC2)c1	ZINC000853826227	BF	On-Demand	Anodyne	KCNK9	51	43
O=C(Nc1ccc(Cl)cn1)N[C@@H]1C=CCC1	ZINC000853826245	BF	On-Demand	Anodyne	F10	42	38
O=C(Nc1ccc(Cl)cn1)N[C@H]1C=CCC1	ZINC000853826246	BF	On-Demand	Anodyne	F10	42	38
O=C(Nc1ccccc1C(F)(F)F)N[C@@H]1C=CCC1	ZINC000853826253	CH	On-Demand	Anodyne	KCNJ11	41	34
O=C(Nc1ccccc1C(F)(F)F)N[C@@H]1C=CCC1	ZINC000853826253	CH	On-Demand	Anodyne	TRPV1	16	45
O=C(Nc1ccccc1C(F)(F)F)N[C@@H]1C=CCC1	ZINC000853826253	CH	On-Demand	Anodyne	EPHX2	35	50
O=C(Nc1ccccc1C(F)(F)F)N[C@@H]1C=CCC1	ZINC000853826253	CH	On-Demand	Anodyne	RBP4	85	38
O=C(Nc1ccccc1C(F)(F)F)N[C@H]1C=CCC1	ZINC000853826254	CH	On-Demand	Anodyne	KCNJ11	41	34
O=C(Nc1ccccc1C(F)(F)F)N[C@H]1C=CCC1	ZINC000853826254	CH	On-Demand	Anodyne	TRPV1	16	45
O=C(Nc1ccccc1C(F)(F)F)N[C@H]1C=CCC1	ZINC000853826254	CH	On-Demand	Anodyne	EPHX2	35	50
O=C(Nc1ccccc1C(F)(F)F)N[C@H]1C=CCC1	ZINC000853826254	CH	On-Demand	Anodyne	RBP4	85	38
CN(C)C(=O)OCCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000853826272	GD	On-Demand	Anodyne	CA2	17	40
CN(C)C(=O)OCCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000853826272	GD	On-Demand	Anodyne	CA4	20	40
O=C(Nc1nc2c(s1)CCCC2)N[C@@H]1C=CCC1	ZINC000853826285	CF	On-Demand	Anodyne	SLC27A1	32	40
O=C(Nc1nc2c(s1)CCCC2)N[C@H]1C=CCC1	ZINC000853826286	CF	On-Demand	Anodyne	SLC27A1	32	40
CN(C)C(=O)OCCNc1nccc(N2CCCC(C)(C)C2)n1	ZINC000853826290	DE	On-Demand	Anodyne	MRGPRX1	41	38
O=S(=O)(c1ccc(N[C@@H]2COC3(CCC3)C2)nc1)N1CCCCC1	ZINC000853826326	FE	On-Demand	Anodyne	TGM2	23	44
O=S(=O)(c1ccc(N[C@H]2COC3(CCC3)C2)nc1)N1CCCCC1	ZINC000853826327	FE	On-Demand	Anodyne	TGM2	23	44
CN(C)C(=O)OCCNc1ncnc2cc(I)sc12	ZINC000853826368	GE	On-Demand	Anodyne	SIRT3	42	32
CN(C)C(=O)OCCNc1ccc2ccc(Br)cc2n1	ZINC000853826375	EG	On-Demand	Anodyne	NCEH1	52	43
CN(C)C(=O)OCCNc1nccc2cc(Br)ccc12	ZINC000853826377	EG	On-Demand	Anodyne	NCEH1	60	47
COc1ccc(-c2ccnc(NCCOC(=O)N(C)C)n2)cc1	ZINC000853826386	DE	On-Demand	Anodyne	CLK4	27	52
COc1ccc(-c2ccnc(NCCOC(=O)N(C)C)n2)cc1	ZINC000853826386	DE	On-Demand	Anodyne	DYRK1B	15	54
COc1ccc(-c2ccnc(NCCOC(=O)N(C)C)n2)cc1	ZINC000853826386	DE	On-Demand	Anodyne	SMG1	63	35
CN(C)C(=O)OCCNc1nccc2cc(F)ccc12	ZINC000853826388	CE	On-Demand	Anodyne	NCEH1	41	32
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	ADORA1	179	67
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	SLC29A1	138	59
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	ADORA2A	74	58
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	ADORA2B	22	57
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	DNMT1	24	41
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	ADK	72	55
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	AHCY	57	44
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	P2RX4	46	45
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	P2RX1	60	43
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	P2RY4	17	43
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	P2RY1	39	45
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	AMD1	44	48
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	GAPDH	39	44
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	ITPR1	34	40
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	P2RY2	20	45
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	ADORA3	151	58
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	OXGR1	136	44
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	RNASE1	44	35
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	DNMT3B	89	48
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	PANC	39	43
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	Q4VQ11_PIG	79	57
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	GPR17	61	44
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	HSPA5	52	37
CN(C)C(=O)OCCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853826408	GA	On-Demand	Anodyne	DOT1L	118	49
CN(C)C(=O)OCCNc1ccnc2cc([N+](=O)[O-])ccc12	ZINC000853826423	DE	On-Demand	Bother	HRP1_PLAFA	107	45
CN(C)C(=O)OCCNc1ccnc2cc([N+](=O)[O-])ccc12	ZINC000853826423	DE	On-Demand	Bother	HNMT	53	34
Cn1ccnc1C(=O)N1CCC(C2CCC2)CC1	ZINC000853826433	BE	On-Demand	Anodyne	L3MBTL3	55	35
CN(C)C(=O)OCCNc1noc2ccc(S(N)(=O)=O)cc12	ZINC000853826437	EC	On-Demand	Anodyne	CA5A	41	30
CN(C)C(=O)OCCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000853826440	CD	On-Demand	Bother	COLA	86	33
Cc1ccc2ccnc(NCCOC(=O)N(C)C)c2c1	ZINC000853826441	CF	On-Demand	Anodyne	NCEH1	51	32
CN(C)C(=O)OCCNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000853826442	CC	On-Demand	Bother	COLA	52	32
O=C(c1nc(Br)cs1)N1CCC(C2CCC2)CC1	ZINC000853826457	EH	On-Demand	Anodyne	L3MBTL3	52	35
CN(C)C(=O)OCCNc1ccnc2c(Cl)cccc12	ZINC000853826479	CF	On-Demand	Anodyne	HRP1_PLAFA	43	32
CN(C)C(=O)OCCNc1ccnc2c(Cl)cccc12	ZINC000853826479	CF	On-Demand	Anodyne	HNMT	52	34
CN(C)C(=O)OCCNc1ncnc2ccc(S(C)(=O)=O)cc12	ZINC000853826480	ED	On-Demand	Anodyne	CLK4	51	35
CN(C)C(=O)OCCNc1ncnc2ccc(S(C)(=O)=O)cc12	ZINC000853826480	ED	On-Demand	Anodyne	CD38	18	41
CN(C)C(=O)OCCNc1nc(-c2ccccc2F)cs1	ZINC000853826503	DG	On-Demand	Anodyne	MPL	41	33
CN(C)C(=O)OCCNc1ncnc2c1ncn2-c1ccccc1	ZINC000853826523	ED	On-Demand	Anodyne	ADORA3	48	37
CN(C)C(=O)OCCNc1nccc2cc([N+](=O)[O-])ccc12	ZINC000853826551	DE	On-Demand	Bother	NCEH1	41	35
CC(C)c1ccc2ncnc(NCCOC(=O)N(C)C)c2c1	ZINC000853826563	DF	On-Demand	Anodyne	EGFR	40	35
CC(C)c1ccc2ncnc(NCCOC(=O)N(C)C)c2c1	ZINC000853826563	DF	On-Demand	Anodyne	CLK4	53	36
CN(C)C(=O)OCCNc1ncnc2c1ncn2C1CC1	ZINC000853826579	CD	On-Demand	Anodyne	ADORA1	71	49
CN(C)C(=O)OCCNc1ncnc2c1ncn2C1CC1	ZINC000853826579	CD	On-Demand	Anodyne	ADCY5	26	42
CN(C)C(=O)OCCNc1ncnc2c1ncn2C1CC1	ZINC000853826579	CD	On-Demand	Anodyne	ADORA3	87	38
CN(C)C(=O)OCCNc1ncnc2c1ncn2C1CC1	ZINC000853826579	CD	On-Demand	Anodyne	OXGR1	98	35
CN(C)C(=O)OCCNc1ncnc2c1ncn2C1CC1	ZINC000853826579	CD	On-Demand	Anodyne	DNMT3B	43	36
CN(C)C(=O)OCCNc1ncnc2c1ncn2C1CC1	ZINC000853826579	CD	On-Demand	Anodyne	DOT1L	41	34
COc1ccc2[nH]cc(C#N)c(=NCCOC(=O)N(C)C)c2c1	ZINC000853826590	DD	On-Demand	Mild	HTR1D	15	41
CCn1c(=O)c(NCCOC(=O)N(C)C)nc2ccccc21	ZINC000853826593	DD	On-Demand	Anodyne	PYGM	21	43
CN(C)C(=O)OCCNc1c(C#N)cnc2c(Cl)cccc12	ZINC000853826606	DF	On-Demand	Mild	SRC	40	34
CN(C)C(=O)OCCNc1c(C#N)cnc2c(Cl)cccc12	ZINC000853826606	DF	On-Demand	Mild	MAP3K8	93	38
CN(C)C(=O)OCCNc1ncnc2cc(Br)sc12	ZINC000853826609	EF	On-Demand	Anodyne	SIRT3	42	32
CN(C)C(=O)OCCNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853826614	EC	On-Demand	Anodyne	NCE103	44	33
CN(C)C(=O)OCCNc1nccc2ccc(Br)cc12	ZINC000853826632	EG	On-Demand	Anodyne	NCEH1	58	43
O=C(Nc1ccc(Cl)nc1)N1CCC(C2CCC2)CC1	ZINC000853826676	CH	On-Demand	Anodyne	EPHX2	33	41
COc1ccc(-c2nnc(NCCOC(=O)N(C)C)s2)cc1	ZINC000853826679	DE	On-Demand	Anodyne	PROKR1	47	31
CN(C)C(=O)OCCNc1cnc(-c2ccccc2)cn1	ZINC000853826681	CE	On-Demand	Anodyne	TPH1	33	47
O=[N+]([O-])c1ccc(N[C@H]2COC3(CCC3)C2)c2nonc12	ZINC000853826687	CE	On-Demand	Bother	GSTM2	107	42
O=[N+]([O-])c1ccc(N[C@H]2COC3(CCC3)C2)c2nonc12	ZINC000853826687	CE	On-Demand	Bother	GSTP1	66	42
O=[N+]([O-])c1ccc(N[C@@H]2COC3(CCC3)C2)c2nonc12	ZINC000853826688	CE	On-Demand	Bother	GSTM2	107	42
O=[N+]([O-])c1ccc(N[C@@H]2COC3(CCC3)C2)c2nonc12	ZINC000853826688	CE	On-Demand	Bother	GSTP1	66	42
CN(C)C(=O)OCCNc1nc(N(C)C)c2ccccc2n1	ZINC000853826713	DD	On-Demand	Anodyne	ADRA2A	18	51
CN(C)C(=O)OCCNc1cc(N2CCc3ccccc32)ncn1	ZINC000853826735	EE	On-Demand	Anodyne	EIF2AK3	45	33
O=S(=O)(c1ccc(N[C@H]2COC3(CCC3)C2)nc1)N1CCCC1	ZINC000853826741	ED	On-Demand	Anodyne	TGM2	30	45
O=S(=O)(c1ccc(N[C@@H]2COC3(CCC3)C2)nc1)N1CCCC1	ZINC000853826742	ED	On-Demand	Anodyne	TGM2	30	45
CN(C)C(=O)OCCNc1nccn(C(F)F)c1=O	ZINC000853826743	CC	On-Demand	Anodyne	CASP3	52	38
CN(C)C(=O)OCCNc1ncnc2[nH]c3ccccc3c12	ZINC000853826754	CE	On-Demand	Anodyne	UTS2R	24	49
CN1CCN(c2ccccc2NC(=O)N2CCC(C3CCC3)CC2)CC1	ZINC000853826765	FG	On-Demand	Anodyne	HTR1A	18	49
CN1CCN(c2ccccc2NC(=O)N2CCC(C3CCC3)CC2)CC1	ZINC000853826765	FG	On-Demand	Anodyne	HTR1D	17	49
CN1CCN(c2ccccc2NC(=O)N2CCC(C3CCC3)CC2)CC1	ZINC000853826765	FG	On-Demand	Anodyne	HTR1B	21	49
CN1CCN(c2ccccc2NC(=O)N2CCC(C3CCC3)CC2)CC1	ZINC000853826765	FG	On-Demand	Anodyne	HTR7	16	47
CN1CCN(c2ccccc2NC(=O)N2CCC(C3CCC3)CC2)CC1	ZINC000853826765	FG	On-Demand	Anodyne	KCNQ2	80	45
O=C(COC(=O)c1ccc(-c2nc3ccccc3s2)o1)NC1CCN(C2CC2)CC1	ZINC000853826817	IG	On-Demand	Anodyne	LTA4H	39	51
C=CC[C@H]1CCCN(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853826825	GI	On-Demand	Mild	NPY2R	71	36
C=CC[C@@H]1CCCN(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853826826	GI	On-Demand	Mild	NPY2R	71	36
C=CC[C@@H]1CCCN(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853826827	GI	On-Demand	Mild	NPY2R	71	36
C=CC[C@@H]1CCCN(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1	ZINC000853826828	GI	On-Demand	Mild	NPY2R	71	36
CN1CCN(c2nc3ccccc3nc2N[C@@H]2COC3(CCC3)C2)CC1	ZINC000853826852	FF	On-Demand	Anodyne	HTR3A	23	44
CN1CCN(c2nc3ccccc3nc2N[C@H]2COC3(CCC3)C2)CC1	ZINC000853826853	FF	On-Demand	Anodyne	HTR3A	23	44
COc1ccc([C@H](NC(=O)COC(=O)c2ccc(-c3nc4ccccc4s3)o2)C2CC2)cc1	ZINC000853826887	JJ	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc([C@H](NC(=O)COC(=O)c2ccc(-c3nc4ccccc4s3)o2)C2CC2)cc1	ZINC000853826887	JJ	On-Demand	Anodyne	ETHR	17	40
COc1ccc([C@@H](NC(=O)COC(=O)c2ccc(-c3nc4ccccc4s3)o2)C2CC2)cc1	ZINC000853826888	JJ	On-Demand	Anodyne	LUCI_PHOPE	21	41
COc1ccc([C@@H](NC(=O)COC(=O)c2ccc(-c3nc4ccccc4s3)o2)C2CC2)cc1	ZINC000853826888	JJ	On-Demand	Anodyne	ETHR	17	40
O=C(c1cccnc1N[C@@H]1COC2(CCC2)C1)N1CCc2ccccc21	ZINC000853826912	EG	On-Demand	Anodyne	AVPR2	45	37
O=C(c1cccnc1N[C@H]1COC2(CCC2)C1)N1CCc2ccccc21	ZINC000853826913	EG	On-Demand	Anodyne	AVPR2	45	37
C=CC[C@H]1CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853826979	EG	On-Demand	Mild	HTR7	16	41
C=CC[C@H]1CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853826979	EG	On-Demand	Mild	KCNQ2	76	40
C=CC[C@@H]1CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853826980	EG	On-Demand	Mild	HTR7	16	41
C=CC[C@@H]1CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853826980	EG	On-Demand	Mild	KCNQ2	76	40
Cc1nc(C(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)no1	ZINC000853827000	EF	On-Demand	Anodyne	CNR1	49	48
Cc1nc(C(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)no1	ZINC000853827000	EF	On-Demand	Anodyne	MC4R	47	37
Cc1nc(C(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)no1	ZINC000853827000	EF	On-Demand	Anodyne	NPY2R	40	39
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000853827015	GF	On-Demand	Anodyne	ACE	36	42
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853827016	GF	On-Demand	Anodyne	ACE	36	42
O=C(N[C@@H]1CCN(CCCc2ccccc2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853827017	GF	On-Demand	Anodyne	ACE	36	42
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000853827018	GF	On-Demand	Anodyne	ACE	36	42
O=[N+]([O-])c1ccc2ncnc(N[C@@H]3COC4(CCC4)C3)c2c1	ZINC000853827022	DF	On-Demand	Bother	CD38	40	38
O=[N+]([O-])c1ccc2ncnc(N[C@H]3COC4(CCC4)C3)c2c1	ZINC000853827023	DF	On-Demand	Bother	CD38	40	38
Ic1ccc2ncnc(N[C@H]3COC4(CCC4)C3)c2c1	ZINC000853827039	GG	On-Demand	Anodyne	CD38	53	41
Ic1ccc2ncnc(N[C@@H]3COC4(CCC4)C3)c2c1	ZINC000853827040	GG	On-Demand	Anodyne	CD38	53	41
O=C(c1ccc(N[C@@H]2COC3(CCC3)C2)nc1)N1CCc2ccccc21	ZINC000853827081	EG	On-Demand	Anodyne	AVPR2	89	42
O=C(c1ccc(N[C@@H]2COC3(CCC3)C2)nc1)N1CCc2ccccc21	ZINC000853827081	EG	On-Demand	Anodyne	AVPR1A	49	42
O=C(c1ccc(N[C@H]2COC3(CCC3)C2)nc1)N1CCc2ccccc21	ZINC000853827082	EG	On-Demand	Anodyne	AVPR2	89	42
O=C(c1ccc(N[C@H]2COC3(CCC3)C2)nc1)N1CCc2ccccc21	ZINC000853827082	EG	On-Demand	Anodyne	AVPR1A	49	42
Fc1ccc2ncnc(N[C@H]3COC4(CCC4)C3)c2c1	ZINC000853827083	CF	On-Demand	Anodyne	CD38	54	41
Fc1ccc2ncnc(N[C@@H]3COC4(CCC4)C3)c2c1	ZINC000853827084	CF	On-Demand	Anodyne	CD38	54	41
Fc1ccc(-c2csc(N[C@H]3COC4(CCC4)C3)n2)cc1	ZINC000853827127	DI	On-Demand	Anodyne	MAOB	21	47
Fc1ccc(-c2csc(N[C@@H]3COC4(CCC4)C3)n2)cc1	ZINC000853827128	DI	On-Demand	Anodyne	MAOB	21	47
C=CC[C@@H]1CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853827158	CH	On-Demand	Mild	G2YM83_BOTF4	65	34
C=CC[C@H]1CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853827159	CH	On-Demand	Mild	G2YM83_BOTF4	65	34
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@@H]2COC3(CCC3)C2)nc1	ZINC000853827192	FI	On-Demand	Anodyne	GRM5	17	42
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@@H]2COC3(CCC3)C2)nc1	ZINC000853827192	FI	On-Demand	Anodyne	KCNK3	50	40
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@H]2COC3(CCC3)C2)nc1	ZINC000853827193	FI	On-Demand	Anodyne	GRM5	17	42
O=C(Nc1cccc(Cl)c1)c1ccc(N[C@H]2COC3(CCC3)C2)nc1	ZINC000853827193	FI	On-Demand	Anodyne	KCNK3	50	40
N#Cc1ccc(N[C@H]2COC3(CCC3)C2)cc1C(F)(F)F	ZINC000853827194	CH	On-Demand	Mild	AR	50	41
N#Cc1ccc(N[C@@H]2COC3(CCC3)C2)cc1C(F)(F)F	ZINC000853827195	CH	On-Demand	Mild	AR	50	41
Cc1nsc(C(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853827233	FG	On-Demand	Anodyne	CNR1	50	42
Cc1nsc(C(=O)N2CCN(c3ccc(Cl)cc3Cl)CC2)n1	ZINC000853827233	FG	On-Demand	Anodyne	MC4R	51	37
O=C(N1CCN(c2ccc(Cl)cc2Cl)CC1)n1ccnc1	ZINC000853827239	EF	On-Demand	Anodyne	CNR1	54	33
Brc1ccc2ncnc(N[C@H]3COC4(CCC4)C3)c2c1	ZINC000853827240	EH	On-Demand	Anodyne	EGFR	49	37
Brc1ccc2ncnc(N[C@H]3COC4(CCC4)C3)c2c1	ZINC000853827240	EH	On-Demand	Anodyne	CD38	54	41
Brc1ccc2ncnc(N[C@@H]3COC4(CCC4)C3)c2c1	ZINC000853827241	EH	On-Demand	Anodyne	EGFR	49	37
Brc1ccc2ncnc(N[C@@H]3COC4(CCC4)C3)c2c1	ZINC000853827241	EH	On-Demand	Anodyne	CD38	54	41
Cn1ccnc1C(=O)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853827258	EF	On-Demand	Anodyne	CNR1	41	42
Cn1ccnc1C(=O)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853827258	EF	On-Demand	Anodyne	MC4R	46	36
Cn1ccnc1C(=O)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853827258	EF	On-Demand	Anodyne	NPY2R	43	42
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@H]2COC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000853827348	GE	On-Demand	Bother	TAAR1	18	40
COC(=O)[C@@H](C)NC(=O)c1ccc(N[C@@H]2COC3(CCC3)C2)c([N+](=O)[O-])c1	ZINC000853827350	GE	On-Demand	Bother	TAAR1	18	40
Cn1ccnc1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853827375	EF	On-Demand	Anodyne	KCNA5	15	40
Cn1ccnc1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853827375	EF	On-Demand	Anodyne	CCKAR	21	42
Cn1ccnc1C(=O)N1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853827375	EF	On-Demand	Anodyne	BCL2A1	43	35
Cc1nc(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)no1	ZINC000853827390	EF	On-Demand	Anodyne	KCNA5	19	42
Cc1nc(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)no1	ZINC000853827390	EF	On-Demand	Anodyne	CCR1	20	41
Cc1nc(C(=O)N2CCN(c3ccc(Cl)c(Cl)c3)CC2)no1	ZINC000853827390	EF	On-Demand	Anodyne	BCL2A1	43	34
O=C(N1CCN(c2ccc(Cl)c(Cl)c2)CC1)n1ccnc1	ZINC000853827420	EF	On-Demand	Anodyne	BCL2A1	43	35
O=C(C(=O)N1CCN(c2ccc(Cl)cc2Cl)CC1)C1CCSCC1	ZINC000853827462	GG	On-Demand	Anodyne	CNR1	51	31
O=C(C(=O)N1CCN(c2ccc(Cl)cc2Cl)CC1)C1CCSCC1	ZINC000853827462	GG	On-Demand	Anodyne	MC4R	64	39
CON(C)CCNC(=O)N[C@@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000853827608	FD	On-Demand	Anodyne	CCR2	51	36
CON(C)CCNC(=O)N[C@H]1CC(=O)N(c2cccc(C(F)(F)F)c2)C1	ZINC000853827609	FD	On-Demand	Anodyne	CCR2	51	36
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccc(-c3nc4ccccc4s3)o2)cc1OC	ZINC000853827676	JK	On-Demand	Anodyne	CPT1A	92	40
N#CCC1CN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853827812	DD	On-Demand	Mild	CACNA1C	43	38
N#CCC1CN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853827812	DD	On-Demand	Mild	CACNA1D	68	38
O=C(NNc1ccnc(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853827827	EF	On-Demand	Reactive	KCNQ2	71	38
O=C(NNc1ccnc(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853827827	EF	On-Demand	Reactive	TRPV1	17	43
CC(C)c1ccc2ncnc(N[C@@H]3COC4(CCC4)C3)c2c1	ZINC000853827869	CH	On-Demand	Anodyne	CD38	46	39
CC(C)c1ccc2ncnc(N[C@H]3COC4(CCC4)C3)c2c1	ZINC000853827870	CH	On-Demand	Anodyne	CD38	46	39
CS(=O)(=O)c1ccc2ncnc(N[C@H]3COC4(CCC4)C3)c2c1	ZINC000853827900	EE	On-Demand	Anodyne	CD38	50	41
CS(=O)(=O)c1ccc2ncnc(N[C@@H]3COC4(CCC4)C3)c2c1	ZINC000853827901	EE	On-Demand	Anodyne	CD38	50	41
Cc1nsc(C(=O)N[C@@H](C(=O)OC(C)(C)C)c2ccccc2)n1	ZINC000853827907	EF	On-Demand	Anodyne	TACR3	22	43
O=C(N[C@H]1CCCc2[nH]ccc21)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853827970	GG	On-Demand	Anodyne	HTR1A	17	44
O=C(N[C@H]1CCCc2[nH]ccc21)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853827970	GG	On-Demand	Anodyne	HTR7	18	44
O=C(N[C@@H]1CCCc2[nH]ccc21)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853827971	GG	On-Demand	Anodyne	HTR1A	17	44
O=C(N[C@@H]1CCCc2[nH]ccc21)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853827971	GG	On-Demand	Anodyne	HTR7	18	44
CCC1(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853827984	CF	On-Demand	Reactive	NMBR	54	31
O=C1CC[C@@H]2CN(c3ccc4c(c3)S(=O)(=O)N=C4Cl)CC[C@H]2N1	ZINC000853827985	FD	On-Demand	Anodyne	CHRNA3	40	37
O=C1CC[C@H]2CN(c3ccc4c(c3)S(=O)(=O)N=C4Cl)CC[C@@H]2N1	ZINC000853827986	FD	On-Demand	Anodyne	CHRNA3	40	37
O=C1CC[C@H]2CN(c3ccc4c(c3)S(=O)(=O)N=C4Cl)CC[C@H]2N1	ZINC000853827987	FD	On-Demand	Anodyne	CHRNA3	40	37
O=C1CC[C@@H]2CN(c3ccc4c(c3)S(=O)(=O)N=C4Cl)CC[C@@H]2N1	ZINC000853827988	FD	On-Demand	Anodyne	CHRNA3	40	37
CO[C@]1(CO)CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853827997	CD	On-Demand	Anodyne	EPHX2	15	42
CO[C@]1(CO)CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853827997	CD	On-Demand	Anodyne	G2YM83_BOTF4	68	35
CN1CCN(c2ccccc2NC(=O)N2CC(CC#N)C2)CC1	ZINC000853828140	DD	On-Demand	Mild	HTR1B	15	41
CN1CCN(c2ccccc2NC(=O)N2CC(CC#N)C2)CC1	ZINC000853828140	DD	On-Demand	Mild	KCNQ2	74	39
CN1CCN(c2ccccc2NC(=O)N2CC(CC#N)C2)CC1	ZINC000853828140	DD	On-Demand	Mild	CSF1R	15	43
CCn1c(=O)c(N[C@H]2COC3(CCC3)C2)nc2ccccc21	ZINC000853828188	CF	On-Demand	Anodyne	PYGM	17	40
CCn1c(=O)c(N[C@@H]2COC3(CCC3)C2)nc2ccccc21	ZINC000853828189	CF	On-Demand	Anodyne	PYGM	17	40
C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)c3cscn3)cc2F)C[C@@H](C)O1	ZINC000853828224	GH	On-Demand	Anodyne	NPY2R	69	35
C[C@H]1CN(c2ccc(NC(=O)N[C@@H](C)c3cscn3)cc2F)C[C@@H](C)O1	ZINC000853828227	GH	On-Demand	Anodyne	NPY2R	69	35
O=C(Nc1ccc(Cl)nc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853828238	CD	On-Demand	Anodyne	EPHX2	36	40
O=C(Nc1ccc(Cl)nc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853828239	CD	On-Demand	Anodyne	EPHX2	36	40
COc1ccc(OC)c([C@H](C)NC(=O)[C@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)o2)c1	ZINC000853828242	JJ	On-Demand	Anodyne	LUCI_PHOPE	29	41
COc1ccc(OC)c([C@H](C)NC(=O)[C@@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)o2)c1	ZINC000853828244	JJ	On-Demand	Anodyne	LUCI_PHOPE	29	41
O=C(N[C@@H]1CCCc2[nH]ccc21)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853828275	EE	On-Demand	Anodyne	L3MBTL3	62	39
O=C(N[C@@H]1CCCc2[nH]ccc21)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853828276	EE	On-Demand	Anodyne	L3MBTL3	62	39
O=C(N[C@H]1CCCc2[nH]ccc21)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853828277	EE	On-Demand	Anodyne	L3MBTL3	62	39
O=C(N[C@H]1CCCc2[nH]ccc21)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853828278	EE	On-Demand	Anodyne	L3MBTL3	62	39
NC(=O)c1cc(N2CC[C@H]3NC(=O)CC[C@H]3C2)ccn1	ZINC000853828346	CC	On-Demand	Anodyne	CHRNA3	45	38
NC(=O)c1cc(N2CC[C@@H]3NC(=O)CC[C@@H]3C2)ccn1	ZINC000853828348	CC	On-Demand	Anodyne	CHRNA3	45	38
NC(=O)c1cc(N2CC[C@H]3NC(=O)CC[C@@H]3C2)ccn1	ZINC000853828349	CC	On-Demand	Anodyne	CHRNA3	45	38
NC(=O)c1cc(N2CC[C@@H]3NC(=O)CC[C@H]3C2)ccn1	ZINC000853828350	CC	On-Demand	Anodyne	CHRNA3	45	38
O=C1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@@H]2N1	ZINC000853828351	DD	On-Demand	Bother	GSTM2	93	39
O=C1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@@H]2N1	ZINC000853828351	DD	On-Demand	Bother	GSTP1	52	38
O=C1CC[C@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@H]2N1	ZINC000853828352	DD	On-Demand	Bother	GSTM2	93	39
O=C1CC[C@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@H]2N1	ZINC000853828352	DD	On-Demand	Bother	GSTP1	52	38
O=C1CC[C@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@@H]2N1	ZINC000853828354	DD	On-Demand	Bother	GSTM2	93	39
O=C1CC[C@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@@H]2N1	ZINC000853828354	DD	On-Demand	Bother	GSTP1	52	38
O=C1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@H]2N1	ZINC000853828356	DD	On-Demand	Bother	GSTM2	93	39
O=C1CC[C@@H]2CN(c3ccc([N+](=O)[O-])c4nonc34)CC[C@H]2N1	ZINC000853828356	DD	On-Demand	Bother	GSTP1	52	38
CO[C@]1(CO)CCCN(C(=O)Nc2nc(C)c(-c3ccccc3)s2)C1	ZINC000853828357	FG	On-Demand	Anodyne	PIK3CG	17	46
CN(C[C@@H]1COCCO1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853828374	CC	On-Demand	Bother	GSTM2	106	42
CN(C[C@@H]1COCCO1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853828374	CC	On-Demand	Bother	GSTP1	65	42
COC(=O)c1nc(CNC(=O)Nc2cccc(CN(C)C)c2)ccc1Cl	ZINC000853828426	GF	On-Demand	Anodyne	ROCK2	27	44
CO[C@]1(CO)CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853828427	FD	On-Demand	Anodyne	HTR1B	18	42
CO[C@]1(CO)CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853828427	FD	On-Demand	Anodyne	KCNQ2	75	41
c1nc(N[C@@H]2COC3(CCC3)C2)c2ncn(C3CC3)c2n1	ZINC000853828485	CE	On-Demand	Anodyne	ADORA1	56	47
c1nc(N[C@@H]2COC3(CCC3)C2)c2ncn(C3CC3)c2n1	ZINC000853828485	CE	On-Demand	Anodyne	ADORA3	21	47
c1nc(N[C@@H]2COC3(CCC3)C2)c2ncn(C3CC3)c2n1	ZINC000853828485	CE	On-Demand	Anodyne	Q4VQ11_PIG	68	47
c1nc(N[C@H]2COC3(CCC3)C2)c2ncn(C3CC3)c2n1	ZINC000853828486	CE	On-Demand	Anodyne	ADORA1	56	47
c1nc(N[C@H]2COC3(CCC3)C2)c2ncn(C3CC3)c2n1	ZINC000853828486	CE	On-Demand	Anodyne	ADORA3	21	47
c1nc(N[C@H]2COC3(CCC3)C2)c2ncn(C3CC3)c2n1	ZINC000853828486	CE	On-Demand	Anodyne	Q4VQ11_PIG	68	47
CCCCCNC(=O)[C@@H](C)OC(=O)c1ccc(-c2nc3ccccc3s2)o1	ZINC000853828519	GI	On-Demand	Anodyne	ST14	42	37
CCCCCNC(=O)[C@@H](C)OC(=O)c1ccc(-c2nc3ccccc3s2)o1	ZINC000853828519	GI	On-Demand	Anodyne	TMPRSS6	64	37
CCCCCNC(=O)[C@H](C)OC(=O)c1ccc(-c2nc3ccccc3s2)o1	ZINC000853828520	GI	On-Demand	Anodyne	ST14	42	37
CCCCCNC(=O)[C@H](C)OC(=O)c1ccc(-c2nc3ccccc3s2)o1	ZINC000853828520	GI	On-Demand	Anodyne	TMPRSS6	64	37
O=C1CC[C@@H]2CN(c3cc(Br)cnc3Br)CC[C@H]2N1	ZINC000853828526	GF	On-Demand	Anodyne	CHRNA3	40	40
O=C1CC[C@@H]2CN(c3cc(Br)cnc3Br)CC[C@H]2N1	ZINC000853828526	GF	On-Demand	Anodyne	CHRNA4	19	40
O=C1CC[C@@H]2CN(c3cc(Br)cnc3Br)CC[C@@H]2N1	ZINC000853828527	GF	On-Demand	Anodyne	CHRNA3	40	40
O=C1CC[C@@H]2CN(c3cc(Br)cnc3Br)CC[C@@H]2N1	ZINC000853828527	GF	On-Demand	Anodyne	CHRNA4	19	40
O=C1CC[C@H]2CN(c3cc(Br)cnc3Br)CC[C@H]2N1	ZINC000853828528	GF	On-Demand	Anodyne	CHRNA3	40	40
O=C1CC[C@H]2CN(c3cc(Br)cnc3Br)CC[C@H]2N1	ZINC000853828528	GF	On-Demand	Anodyne	CHRNA4	19	40
O=C1CC[C@H]2CN(c3cc(Br)cnc3Br)CC[C@@H]2N1	ZINC000853828529	GF	On-Demand	Anodyne	CHRNA3	40	40
O=C1CC[C@H]2CN(c3cc(Br)cnc3Br)CC[C@@H]2N1	ZINC000853828529	GF	On-Demand	Anodyne	CHRNA4	19	40
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@H]2CCCc3[nH]ccc32)cc1	ZINC000853828535	GE	On-Demand	Anodyne	ADRB2	23	48
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@H]2CCCc3[nH]ccc32)cc1	ZINC000853828535	GE	On-Demand	Anodyne	ADRB1	52	48
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000853828536	GE	On-Demand	Anodyne	ADRB2	23	48
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000853828536	GE	On-Demand	Anodyne	ADRB1	52	48
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000853828537	GE	On-Demand	Anodyne	ADRB2	23	48
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H]2CCCc3[nH]ccc32)cc1	ZINC000853828537	GE	On-Demand	Anodyne	ADRB1	52	48
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCCc3[nH]ccc32)cc1	ZINC000853828538	GE	On-Demand	Anodyne	ADRB2	23	48
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H]2CCCc3[nH]ccc32)cc1	ZINC000853828538	GE	On-Demand	Anodyne	ADRB1	52	48
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)o2)c(OC)c1	ZINC000853828573	JJ	On-Demand	Anodyne	LUCI_PHOPE	30	42
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)o2)c(OC)c1	ZINC000853828573	JJ	On-Demand	Anodyne	ETHR	18	42
COc1ccc2c(NC[C@@H]3CC(=O)N(C)[C@H]3c3ccncc3)ccnc2c1	ZINC000853828616	FG	On-Demand	Anodyne	HRP1_PLAFA	121	44
COc1ccc2c(NC[C@@H]3CC(=O)N(C)[C@H]3c3ccncc3)ccnc2c1	ZINC000853828616	FG	On-Demand	Anodyne	HNMT	58	34
COC(=O)c1nc(CNC(=O)Nc2nc3c(s2)CCCCC3)ccc1Cl	ZINC000853828642	GH	On-Demand	Anodyne	SLC27A1	30	40
CO[C@]1(CO)CCCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853828659	FD	On-Demand	Bother	CACNA1C	54	35
CO[C@]1(CO)CCCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853828659	FD	On-Demand	Bother	CACNA1D	83	35
COC(=O)c1nc(CNC(=O)Nc2cccnc2N2CCCC2)ccc1Cl	ZINC000853828695	GF	On-Demand	Anodyne	TRPV1	17	41
CO[C@]1(CO)CCCN(C(=O)Nc2ccc(Cl)nc2)C1	ZINC000853828720	CD	On-Demand	Anodyne	EPHX2	33	47
CO[C@]1(CO)CCCN(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1	ZINC000853828732	GE	On-Demand	Anodyne	NPY2R	68	35
CO[C@]1(CO)CCCN(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853828736	GE	On-Demand	Anodyne	NPY2R	68	35
CO[C@]1(CO)CCCN(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853828739	GE	On-Demand	Anodyne	NPY2R	68	35
Cc1nc(NC(=O)N2CC[C@@H](O)C(F)(F)C2)sc1-c1ccccc1	ZINC000853828819	FG	On-Demand	Anodyne	PIK3CG	19	44
Cc1nc(NC(=O)N2CC[C@H](O)C(F)(F)C2)sc1-c1ccccc1	ZINC000853828820	FG	On-Demand	Anodyne	PIK3CG	19	44
C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1(CO)CC1	ZINC000853828865	ED	On-Demand	Anodyne	KCNQ2	86	48
C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1(CO)CC1	ZINC000853828865	ED	On-Demand	Anodyne	NPY2R	43	34
Cc1nc(NC(=O)N2CC(CC#N)C2)sc1-c1ccccc1	ZINC000853828934	DG	On-Demand	Mild	PIK3CG	21	43
CN1CCN(c2ccccc2NC(=O)NNc2ccnc(Cl)c2)CC1	ZINC000853828941	FF	On-Demand	Reactive	DRD1	48	37
CN1CCN(c2ccccc2NC(=O)NNc2ccnc(Cl)c2)CC1	ZINC000853828941	FF	On-Demand	Reactive	HTR1D	16	40
CN1CCN(c2ccccc2NC(=O)NNc2ccnc(Cl)c2)CC1	ZINC000853828941	FF	On-Demand	Reactive	KCNQ2	78	43
O=C(NNc1ccnc(Cl)c1)Nc1ccc(N2CCCC2)nc1	ZINC000853829044	EF	On-Demand	Reactive	DGAT1	35	41
CO[C@]1(CO)CCCN(C(=O)Nc2ccc(N(C)C3CCCCC3)c(F)c2)C1	ZINC000853829055	GH	On-Demand	Anodyne	CACNA1H	26	40
CO[C@]1(CO)CCCN(C(=O)Nc2ccc(N(C)C3CCCCC3)c(F)c2)C1	ZINC000853829055	GH	On-Demand	Anodyne	EPHX2	24	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000853829102	EE	On-Demand	Mild	MMP8	18	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(OC)c1	ZINC000853829105	DF	On-Demand	Mild	DRD4	41	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(OC)c1	ZINC000853829105	DF	On-Demand	Mild	MTNR1A	20	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(OC)c1	ZINC000853829105	DF	On-Demand	Mild	MTNR1B	27	45
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(OC)c1	ZINC000853829105	DF	On-Demand	Mild	TAAR1	39	41
O=C(Nc1ccc(C(F)(F)F)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829144	EF	On-Demand	Anodyne	TRPV1	15	49
O=C(Nc1ccc(C(F)(F)F)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829144	EF	On-Demand	Anodyne	EPHX2	50	45
O=C(Nc1ccc(C(F)(F)F)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829144	EF	On-Demand	Anodyne	TRPM8	70	45
O=C(Nc1ccc(C(F)(F)F)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829145	EF	On-Demand	Anodyne	TRPV1	15	49
O=C(Nc1ccc(C(F)(F)F)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829145	EF	On-Demand	Anodyne	EPHX2	50	45
O=C(Nc1ccc(C(F)(F)F)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829145	EF	On-Demand	Anodyne	TRPM8	70	45
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829147	FC	On-Demand	Anodyne	CA2	49	43
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829147	FC	On-Demand	Anodyne	CA1	42	43
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829147	FC	On-Demand	Anodyne	CA4	36	40
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829147	FC	On-Demand	Anodyne	CA12	40	41
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829147	FC	On-Demand	Anodyne	CA9	40	43
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829147	FC	On-Demand	Anodyne	MTCA1	45	41
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829147	FC	On-Demand	Anodyne	P96878_MYCTU	57	41
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829148	FC	On-Demand	Anodyne	CA2	49	43
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829148	FC	On-Demand	Anodyne	CA1	42	43
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829148	FC	On-Demand	Anodyne	CA4	36	40
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829148	FC	On-Demand	Anodyne	CA12	40	41
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829148	FC	On-Demand	Anodyne	CA9	40	43
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829148	FC	On-Demand	Anodyne	MTCA1	45	41
NS(=O)(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829148	FC	On-Demand	Anodyne	P96878_MYCTU	57	41
O=C(Nc1cccc2cccnc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829151	EE	On-Demand	Anodyne	WNT3	19	46
O=C(Nc1cccc2cccnc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829151	EE	On-Demand	Anodyne	TNKS	15	45
O=C(Nc1cccc2cccnc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829152	EE	On-Demand	Anodyne	WNT3	19	46
O=C(Nc1cccc2cccnc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829152	EE	On-Demand	Anodyne	TNKS	15	45
Cc1nc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)sc1-c1ccccc1	ZINC000853829153	FG	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)sc1-c1ccccc1	ZINC000853829154	FG	On-Demand	Anodyne	PIK3CG	20	41
O=C(Nc1ccc(F)c(Cl)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829155	EF	On-Demand	Anodyne	EPHX2	20	41
O=C(Nc1ccc(F)c(Cl)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829156	EF	On-Demand	Anodyne	EPHX2	20	41
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829167	FF	On-Demand	Anodyne	P2RY1	39	43
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829167	FF	On-Demand	Anodyne	EPHX2	77	48
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829167	FF	On-Demand	Anodyne	TRPM8	27	46
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829168	FF	On-Demand	Anodyne	P2RY1	39	43
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829168	FF	On-Demand	Anodyne	EPHX2	77	48
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829168	FF	On-Demand	Anodyne	TRPM8	27	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1nc2ccccc2s1	ZINC000853829171	EG	On-Demand	Mild	CASR	16	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1nc2ccccc2s1	ZINC000853829171	EG	On-Demand	Mild	LCK	21	43
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1nc2ccccc2s1	ZINC000853829171	EG	On-Demand	Mild	CSNK1D	41	44
O=C(Nc1cccc(Br)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829199	FF	On-Demand	Anodyne	LIMK2	17	42
O=C(Nc1cccc(Br)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829200	FF	On-Demand	Anodyne	LIMK2	17	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	ADORA1	167	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	SLC29A1	133	55
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	ADORA2A	54	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	ADORA2B	16	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	ADK	51	54
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	AHCY	51	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	P2RX4	34	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	P2RX1	45	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	P2RY1	34	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	P2RY2	15	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	ADORA3	129	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	OXGR1	118	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	RNASE1	43	34
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	DNMT3B	69	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	Q4VQ11_PIG	100	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	GPR17	48	51
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829202	GB	On-Demand	Anodyne	DOT1L	84	42
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	ADORA1	167	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	SLC29A1	133	55
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	ADORA2A	54	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	ADORA2B	16	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	ADK	51	54
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	AHCY	51	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	P2RX4	34	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	P2RX1	45	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	P2RY1	34	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	P2RY2	15	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	ADORA3	129	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	OXGR1	118	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	RNASE1	43	34
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	DNMT3B	69	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	Q4VQ11_PIG	100	73
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	GPR17	48	51
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853829203	GB	On-Demand	Anodyne	DOT1L	84	42
c1ccc(-n2cnc3c(N[C@H]4COC5(CCC5)C4)ncnc32)cc1	ZINC000853829256	DF	On-Demand	Anodyne	ADORA1	31	41
c1ccc(-n2cnc3c(N[C@@H]4COC5(CCC5)C4)ncnc32)cc1	ZINC000853829259	DF	On-Demand	Anodyne	ADORA1	31	41
O=[N+]([O-])c1ccc(-c2csc(N[C@H]3COC4(CCC4)C3)n2)cc1	ZINC000853829341	EH	On-Demand	Bother	MAOB	15	52
O=[N+]([O-])c1ccc(-c2csc(N[C@@H]3COC4(CCC4)C3)n2)cc1	ZINC000853829344	EH	On-Demand	Bother	MAOB	15	52
C[C@H]1CN(c2ccc(NC(=O)N3CC(CC#N)C3)cc2F)C[C@@H](C)O1	ZINC000853829360	EF	On-Demand	Mild	NPY2R	58	34
C[C@H]1CN(c2ccc(NC(=O)N3CC(CC#N)C3)cc2F)C[C@H](C)O1	ZINC000853829367	EF	On-Demand	Mild	NPY2R	58	34
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000853829504	ED	On-Demand	Anodyne	DRD4	23	41
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000853829504	ED	On-Demand	Anodyne	SIGMAR1	24	40
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000853829505	ED	On-Demand	Anodyne	DRD4	23	41
CON(C)CCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000853829505	ED	On-Demand	Anodyne	SIGMAR1	24	40
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000853829506	ED	On-Demand	Anodyne	DRD4	23	41
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000853829506	ED	On-Demand	Anodyne	SIGMAR1	24	40
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000853829507	ED	On-Demand	Anodyne	DRD4	23	41
CON(C)CCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000853829507	ED	On-Demand	Anodyne	SIGMAR1	24	40
Cc1nc(NC(=O)N[C@H](C)C2(CO)CC2)sc1-c1ccccc1	ZINC000853829513	EG	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)N[C@H](C)C2(CO)CC2)sc1-c1ccccc1	ZINC000853829513	EG	On-Demand	Anodyne	PI4KB	41	40
Cc1nc(NC(=O)N[C@@H](C)C2(CO)CC2)sc1-c1ccccc1	ZINC000853829514	EG	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)N[C@@H](C)C2(CO)CC2)sc1-c1ccccc1	ZINC000853829514	EG	On-Demand	Anodyne	PI4KB	41	40
O=C(N[C@@H]1CN(c2ccc(F)cn2)CC[C@@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853829519	GG	On-Demand	Anodyne	CCR5	54	35
O=C(Nc1ccc(-c2ncon2)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829523	ED	On-Demand	Anodyne	MTOR	81	35
O=C(Nc1ccc(-c2ncon2)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829524	ED	On-Demand	Anodyne	MTOR	81	35
O=C(N[C@H]1CN(c2cc(F)ncn2)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853829531	GF	On-Demand	Anodyne	CCR5	45	33
Cc1nnc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)o1	ZINC000853829549	FF	On-Demand	Anodyne	CCR5	68	33
CC(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829559	DD	On-Demand	Anodyne	MTOR	50	33
CC(=O)c1ccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000853829559	DD	On-Demand	Anodyne	EPHX2	16	40
CC(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829560	DD	On-Demand	Anodyne	MTOR	50	33
CC(=O)c1ccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000853829560	DD	On-Demand	Anodyne	EPHX2	16	40
COc1cc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)ncn1	ZINC000853829578	GF	On-Demand	Anodyne	CCR5	72	34
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(C)c1	ZINC000853829582	DF	On-Demand	Mild	KCNK3	61	39
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(C)c1	ZINC000853829582	DF	On-Demand	Mild	KCNK9	50	39
CCN1CC[C@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829591	GH	On-Demand	Anodyne	ROCK2	34	41
CCN1CC[C@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829591	GH	On-Demand	Anodyne	SCD1	38	41
CCN1CC[C@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829591	GH	On-Demand	Anodyne	SCD	37	50
CCN1CC[C@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829591	GH	On-Demand	Anodyne	MGEA5	34	40
CCN1CC[C@@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829592	GH	On-Demand	Anodyne	ROCK2	34	41
CCN1CC[C@@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829592	GH	On-Demand	Anodyne	SCD1	38	41
CCN1CC[C@@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829592	GH	On-Demand	Anodyne	SCD	37	50
CCN1CC[C@@H](N(CC)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853829592	GH	On-Demand	Anodyne	MGEA5	34	40
O=C(Nc1cccc(Cl)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829593	DE	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1cccc(Cl)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829593	DE	On-Demand	Anodyne	SMO	19	41
O=C(Nc1cccc(Cl)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829594	DE	On-Demand	Anodyne	EPHX2	15	44
O=C(Nc1cccc(Cl)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829594	DE	On-Demand	Anodyne	SMO	19	41
CO[C@]1(CO)CCCN(C(=O)Nc2ccc3oc(=O)ccc3c2)C1	ZINC000853829606	ED	On-Demand	Anodyne	EPHX2	20	40
O=C(N[C@@H]1CCCc2[nH]ccc21)N(CCN1CCOCC1)CC1CC1	ZINC000853829700	EE	On-Demand	Anodyne	CASR	41	35
O=C(N[C@H]1CCCc2[nH]ccc21)N(CCN1CCOCC1)CC1CC1	ZINC000853829703	EE	On-Demand	Anodyne	CASR	41	35
N#Cc1cc(C(=O)N2CC[C@@H](N3CCOC3=O)C2)c[nH]1	ZINC000853829714	CC	On-Demand	Mild	L3MBTL3	42	37
N#Cc1cc(C(=O)N2CC[C@H](N3CCOC3=O)C2)c[nH]1	ZINC000853829729	CC	On-Demand	Mild	L3MBTL3	42	37
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829733	ED	On-Demand	Anodyne	DGAT1	40	41
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829735	ED	On-Demand	Anodyne	DGAT1	40	41
O=C(NNc1ccnc(Cl)c1)Nc1nc2c(s1)CCCCC2	ZINC000853829738	EH	On-Demand	Reactive	SLC27A1	31	41
O=C(NNc1ccnc(Cl)c1)C(=O)C1CCSCC1	ZINC000853829778	CD	On-Demand	Reactive	TYK2	45	35
COc1ccccc1NC(=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829791	DD	On-Demand	Anodyne	SMO	35	46
COc1ccccc1NC(=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829795	DD	On-Demand	Anodyne	SMO	35	46
O=C(Nc1ccccc1Cl)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829800	DE	On-Demand	Anodyne	EPHB3	50	34
O=C(Nc1ccccc1Cl)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829800	DE	On-Demand	Anodyne	SMO	43	45
O=C(Nc1ccccc1Cl)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829802	DE	On-Demand	Anodyne	EPHB3	50	34
O=C(Nc1ccccc1Cl)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829802	DE	On-Demand	Anodyne	SMO	43	45
C[C@@H](NC(=O)NCCc1ccccc1)C1(CO)CC1	ZINC000853829812	CD	On-Demand	Anodyne	ACE	25	40
C[C@@H](NC(=O)NCCc1ccccc1)C1(CO)CC1	ZINC000853829812	CD	On-Demand	Anodyne	MME	53	40
C[C@@H](NC(=O)NCCc1ccccc1)C1(CO)CC1	ZINC000853829812	CD	On-Demand	Anodyne	ANPEP	40	46
C[C@@H](NC(=O)NCCc1ccccc1)C1(CO)CC1	ZINC000853829812	CD	On-Demand	Anodyne	MMP2	19	40
C[C@@H](NC(=O)NCCc1ccccc1)C1(CO)CC1	ZINC000853829812	CD	On-Demand	Anodyne	AMP1_PLAFQ	32	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853829832	GE	On-Demand	Mild	DRD2	16	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853829832	GE	On-Demand	Mild	KCNQ2	73	38
O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853829837	DD	On-Demand	Bother	LUXR	16	40
O=C(N1CC[C@H](O)C(F)(F)C1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853829849	FD	On-Demand	Bother	SLC27A4	42	31
O=C(N1CC[C@@H](O)C(F)(F)C1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853829852	FD	On-Demand	Bother	SLC27A4	42	31
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@H](O)C(F)(F)C3)cc2F)C[C@@H](C)O1	ZINC000853829855	GF	On-Demand	Anodyne	NPY2R	61	35
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@H](O)C(F)(F)C3)cc2F)C[C@@H](C)O1	ZINC000853829859	GF	On-Demand	Anodyne	NPY2R	61	35
O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853829861	DD	On-Demand	Bother	LUXR	16	40
O=C(NC[C@H](O)c1cccc2ccccc12)Nc1nc(C2CC2)cs1	ZINC000853829875	FI	On-Demand	Anodyne	ROCK1	19	42
O=C(NC[C@@H](O)c1cccc2ccccc12)Nc1nc(C2CC2)cs1	ZINC000853829878	FI	On-Demand	Anodyne	ROCK1	19	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000853829902	EE	On-Demand	Mild	KCNK3	59	33
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000853829902	EE	On-Demand	Mild	KCNK9	42	32
Cc1ccc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)nn1	ZINC000853829911	GF	On-Demand	Anodyne	CCR5	61	37
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CHRM2	25	50
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CHRM1	24	50
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	DRD2	32	61
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	DRD4	62	61
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	ACHE	49	45
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	DRD3	19	61
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	KCNH2	17	45
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CHRM3	36	50
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	LTA4H	23	42
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	SIGMAR1	86	60
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	SSTR5	54	38
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CCR1	25	44
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CCR3	37	46
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CCR5	23	41
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	SLC6A5	24	45
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	EPHX2	37	57
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	BACE1	20	44
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	MCHR1	56	51
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CACNA1G	34	49
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	CCR8	21	44
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	BIRC2	35	42
C[C@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829919	EE	On-Demand	Anodyne	NPFFR1	44	38
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CHRM2	25	50
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CHRM1	24	50
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	DRD2	32	61
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	DRD4	62	61
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	ACHE	49	45
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	DRD3	19	61
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	KCNH2	17	45
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CHRM3	36	50
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	LTA4H	23	42
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	SIGMAR1	86	60
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	SSTR5	54	38
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CCR1	25	44
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CCR3	37	46
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CCR5	23	41
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	SLC6A5	24	45
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	EPHX2	37	57
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	BACE1	20	44
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	MCHR1	56	51
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CACNA1G	34	49
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	CCR8	21	44
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	BIRC2	35	42
C[C@@H](NC(=O)NC1CCN(Cc2ccccc2)CC1)C1(CO)CC1	ZINC000853829921	EE	On-Demand	Anodyne	NPFFR1	44	38
CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1N[C@H]1COC2(CCC2)C1	ZINC000853829923	FE	On-Demand	Bother	TBXA2R	18	41
CCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1N[C@@H]1COC2(CCC2)C1	ZINC000853829927	FE	On-Demand	Bother	TBXA2R	18	41
O=C(NC[C@H](O)c1cccc2ccccc12)Nc1ccc(N2CCCC2)nc1	ZINC000853829933	GH	On-Demand	Anodyne	DGAT1	42	42
O=C(NC[C@@H](O)c1cccc2ccccc12)Nc1ccc(N2CCCC2)nc1	ZINC000853829937	GH	On-Demand	Anodyne	DGAT1	42	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853829948	FG	On-Demand	Mild	P2RY1	41	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853829948	FG	On-Demand	Mild	EPHX2	47	37
CCN1CC[C@H](N(CC)C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853829962	FE	On-Demand	Anodyne	KCNQ2	74	39
CCN1CC[C@H](N(CC)C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853829962	FE	On-Demand	Anodyne	CCR5	29	46
CCN1CC[C@@H](N(CC)C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853829964	FE	On-Demand	Anodyne	KCNQ2	74	39
CCN1CC[C@@H](N(CC)C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853829964	FE	On-Demand	Anodyne	CCR5	29	46
Cc1cc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)ccn1	ZINC000853829990	GH	On-Demand	Anodyne	CCR5	42	33
COCCN(CCF)C(=O)NCCn1c(O)nc2ccccc21	ZINC000853829991	DD	On-Demand	Anodyne	HRH1	21	41
O=C(N[C@H]1CN(c2ncccn2)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853829992	FF	On-Demand	Anodyne	CCR5	55	34
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853830046	FE	On-Demand	Mild	CASR	17	42
Cn1cnc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)cc1=O	ZINC000853830047	GD	On-Demand	Anodyne	CCR5	58	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853830048	EE	On-Demand	Mild	CACNA1D	44	36
COC(=O)c1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853830067	ED	On-Demand	Anodyne	KCNK3	41	33
COC(=O)c1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853830069	ED	On-Demand	Anodyne	KCNK3	41	33
O=C(NNc1ccnc(Cl)c1)Nc1nc2c(s1)CCCC2	ZINC000853830082	DG	On-Demand	Reactive	SLC27A1	32	42
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)o2)CC1	ZINC000853830103	JG	On-Demand	Anodyne	P2RY12	86	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)o2)CC1	ZINC000853830108	JG	On-Demand	Anodyne	P2RY12	86	37
O=C(Nc1nc2ccccc2s1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830110	EE	On-Demand	Anodyne	LTA4H	19	49
O=C(Nc1nc2ccccc2s1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830110	EE	On-Demand	Anodyne	BCL2L1	40	32
O=C(Nc1nc2ccccc2s1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830113	EE	On-Demand	Anodyne	LTA4H	19	49
O=C(Nc1nc2ccccc2s1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830113	EE	On-Demand	Anodyne	BCL2L1	40	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(NC(C)=O)c1	ZINC000853830145	EE	On-Demand	Mild	KCNK3	60	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(NC(C)=O)c1	ZINC000853830145	EE	On-Demand	Mild	KCNK9	55	32
O=C(N[C@H]1CN(c2ncccc2F)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853830159	GG	On-Demand	Anodyne	CCR5	60	34
CC(C)c1ccccc1NC(=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830164	DF	On-Demand	Anodyne	SMO	31	52
CC(C)c1ccccc1NC(=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830167	DF	On-Demand	Anodyne	SMO	31	52
O=C(NC[C@H](O)c1cccc2ccccc12)N1CCCCC1	ZINC000853830174	CG	On-Demand	Anodyne	DPP7	40	42
O=C(NC[C@@H](O)c1cccc2ccccc12)N1CCCCC1	ZINC000853830176	CG	On-Demand	Anodyne	DPP7	40	42
O=C(Nc1ccc(Cl)cn1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830233	DD	On-Demand	Anodyne	F10	35	40
O=C(Nc1ccc(Cl)cn1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830235	DD	On-Demand	Anodyne	F10	35	40
O=C(NC[C@H](O)c1cccc2ccccc12)Nc1nc2c(s1)CCC2	ZINC000853830237	FH	On-Demand	Anodyne	SLC27A1	32	43
O=C(NC[C@@H](O)c1cccc2ccccc12)Nc1nc2c(s1)CCC2	ZINC000853830242	FH	On-Demand	Anodyne	SLC27A1	32	43
C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cscn1	ZINC000853830270	EF	On-Demand	Anodyne	KCNQ2	73	42
O=C(N[C@H]1CCCc2[nH]ccc21)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853830272	ED	On-Demand	Anodyne	L3MBTL3	43	32
O=C(N[C@@H]1CCCc2[nH]ccc21)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853830274	ED	On-Demand	Anodyne	L3MBTL3	43	32
O=C(N[C@@H]1CCCc2[nH]ccc21)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853830276	ED	On-Demand	Anodyne	L3MBTL3	43	32
O=C(N[C@H]1CCCc2[nH]ccc21)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853830278	ED	On-Demand	Anodyne	L3MBTL3	43	32
O=C(N[C@@H]1CCCc2[nH]ccc21)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853830287	EG	On-Demand	Anodyne	EPHX2	19	47
O=C(N[C@H]1CCCc2[nH]ccc21)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853830288	EG	On-Demand	Anodyne	EPHX2	19	47
CCC(CC)NC(=O)[C@H](C)OC(=O)c1ccc(-c2nc3ccccc3s2)o1	ZINC000853830293	GI	On-Demand	Anodyne	TMPRSS6	40	32
O=C(N[C@H]1CN(c2cccnn2)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853830341	FF	On-Demand	Anodyne	CCR5	58	34
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1nccs1	ZINC000853830344	CD	On-Demand	Mild	MAP1	117	37
N#Cc1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853830362	DD	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853830363	DD	On-Demand	Mild	CCR3	19	41
O=C(NC[C@H](O)c1cccc2ccccc12)Nc1cccnc1N1CCCC1	ZINC000853830389	GH	On-Demand	Anodyne	KCNQ2	68	35
O=C(NC[C@H](O)c1cccc2ccccc12)Nc1cccnc1N1CCCC1	ZINC000853830389	GH	On-Demand	Anodyne	TRPV1	20	41
O=C(NC[C@@H](O)c1cccc2ccccc12)Nc1cccnc1N1CCCC1	ZINC000853830390	GH	On-Demand	Anodyne	KCNQ2	68	35
O=C(NC[C@@H](O)c1cccc2ccccc12)Nc1cccnc1N1CCCC1	ZINC000853830390	GH	On-Demand	Anodyne	TRPV1	20	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853830391	FF	On-Demand	Mild	NPY2R	48	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853830406	FE	On-Demand	Mild	KCNK3	42	33
O=C(N[C@@H]1CN(c2nccc(CO)n2)CC[C@@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853830414	GE	On-Demand	Anodyne	CCR5	58	32
COc1ccnc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)n1	ZINC000853830416	GF	On-Demand	Anodyne	CCR5	44	40
O=C(N[C@H]1CN(c2cnccn2)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853830425	FF	On-Demand	Anodyne	CCR5	51	38
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830427	FG	On-Demand	Anodyne	NPY5R	18	40
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830427	FG	On-Demand	Anodyne	MTOR	70	35
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830427	FG	On-Demand	Anodyne	EPHX2	17	42
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830427	FG	On-Demand	Anodyne	SMO	37	50
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830429	FG	On-Demand	Anodyne	NPY5R	18	40
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830429	FG	On-Demand	Anodyne	MTOR	70	35
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830429	FG	On-Demand	Anodyne	EPHX2	17	42
O=C(Nc1ccc(-c2ccccc2)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830429	FG	On-Demand	Anodyne	SMO	37	50
Cc1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853830433	CE	On-Demand	Anodyne	LIMK2	16	41
Cc1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853830433	CE	On-Demand	Anodyne	KCNK3	62	38
Cc1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853830433	CE	On-Demand	Anodyne	KCNK9	47	38
Cc1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853830435	CE	On-Demand	Anodyne	LIMK2	16	41
Cc1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853830435	CE	On-Demand	Anodyne	KCNK3	62	38
Cc1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853830435	CE	On-Demand	Anodyne	KCNK9	47	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC000853830437	FF	On-Demand	Mild	ACR	55	34
Cc1cncc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)n1	ZINC000853830445	GF	On-Demand	Anodyne	CCR5	57	33
C[C@H]1CN(c2ccc(NC(=O)NNc3ccnc(Cl)c3)cc2F)C[C@H](C)O1	ZINC000853830453	GH	On-Demand	Reactive	NPY2R	68	35
C[C@H]1CN(c2ccc(NC(=O)NNc3ccnc(Cl)c3)cc2F)C[C@@H](C)O1	ZINC000853830457	GH	On-Demand	Reactive	NPY2R	68	35
O=C(NNc1ccnc(Cl)c1)Nc1nc2c(s1)CCC2	ZINC000853830535	DF	On-Demand	Reactive	SLC27A1	30	40
O=C1CC[C@H]2CN(c3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000853830544	CD	On-Demand	Bother	CHRNA3	20	44
O=C1CC[C@H]2CN(c3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000853830546	CD	On-Demand	Bother	CHRNA3	20	44
O=C1CC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3)CC[C@@H]2N1	ZINC000853830548	CD	On-Demand	Bother	CHRNA3	20	44
O=C1CC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3)CC[C@H]2N1	ZINC000853830550	CD	On-Demand	Bother	CHRNA3	20	44
O=C(Nc1ccccc1F)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830651	CD	On-Demand	Anodyne	RBP4	40	36
O=C(Nc1ccccc1F)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830652	CD	On-Demand	Anodyne	RBP4	40	36
O=C(NC[C@H](O)c1cccc2ccccc12)N1CCOCC1	ZINC000853830656	DD	On-Demand	Anodyne	ADCY5	17	41
O=C(NC[C@H](O)c1cccc2ccccc12)N1CCOCC1	ZINC000853830656	DD	On-Demand	Anodyne	PTGDS	38	41
O=C(NC[C@@H](O)c1cccc2ccccc12)N1CCOCC1	ZINC000853830657	DD	On-Demand	Anodyne	ADCY5	17	41
O=C(NC[C@@H](O)c1cccc2ccccc12)N1CCOCC1	ZINC000853830657	DD	On-Demand	Anodyne	PTGDS	38	41
Cc1nc(O)cc(-c2ccc(NC(=O)N3CC[C@H](N4CCOC4=O)C3)cc2)n1	ZINC000853830658	GE	On-Demand	Anodyne	MTOR	76	34
Cc1nc(O)cc(-c2ccc(NC(=O)N3CC[C@@H](N4CCOC4=O)C3)cc2)n1	ZINC000853830659	GE	On-Demand	Anodyne	MTOR	76	34
Cc1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1C	ZINC000853830677	DE	On-Demand	Anodyne	SMO	26	40
Cc1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1C	ZINC000853830678	DE	On-Demand	Anodyne	SMO	26	40
O=C(Nc1ccc(F)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830689	CD	On-Demand	Anodyne	HTR1F	20	44
O=C(Nc1ccc(F)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830690	CD	On-Demand	Anodyne	HTR1F	20	44
CC(=O)c1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853830699	DD	On-Demand	Anodyne	KCNK3	59	32
CC(=O)c1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853830700	DD	On-Demand	Anodyne	KCNK3	59	32
CCN1CC[C@@H](N(CC)C(=O)Nc2cccnc2Cl)C1	ZINC000853830712	CF	On-Demand	Anodyne	CCR5	21	42
CCN1CC[C@@H](N(CC)C(=O)Nc2cccnc2Cl)C1	ZINC000853830712	CF	On-Demand	Anodyne	G2YM83_BOTF4	70	38
CCN1CC[C@H](N(CC)C(=O)Nc2cccnc2Cl)C1	ZINC000853830713	CF	On-Demand	Anodyne	CCR5	21	42
CCN1CC[C@H](N(CC)C(=O)Nc2cccnc2Cl)C1	ZINC000853830713	CF	On-Demand	Anodyne	G2YM83_BOTF4	70	38
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](N3CCOC3=O)C2)CC1	ZINC000853830714	FD	On-Demand	Anodyne	KCNQ2	66	38
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](N3CCOC3=O)C2)CC1	ZINC000853830715	FD	On-Demand	Anodyne	KCNQ2	66	38
O=C(Nc1nccs1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830716	CD	On-Demand	Anodyne	MAP1	69	37
O=C(Nc1nccs1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830717	CD	On-Demand	Anodyne	MAP1	69	37
O=C(Nc1cc(C2CC2)nn1-c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830725	GF	On-Demand	Anodyne	SMO	15	40
O=C(Nc1cc(C2CC2)nn1-c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830726	GF	On-Demand	Anodyne	SMO	15	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(C)n1	ZINC000853830734	DE	On-Demand	Mild	GRM5	15	40
COc1ccc2cc(CNC(=O)N[C@H](C)C3(CO)CC3)ccc2c1	ZINC000853830778	EF	On-Demand	Anodyne	ANPEP	16	50
COc1ccc2cc(CNC(=O)N[C@H](C)C3(CO)CC3)ccc2c1	ZINC000853830778	EF	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc2cc(CNC(=O)N[C@H](C)C3(CO)CC3)ccc2c1	ZINC000853830778	EF	On-Demand	Anodyne	MTNR1B	48	36
COc1ccc2cc(CNC(=O)N[C@@H](C)C3(CO)CC3)ccc2c1	ZINC000853830779	EF	On-Demand	Anodyne	ANPEP	16	50
COc1ccc2cc(CNC(=O)N[C@@H](C)C3(CO)CC3)ccc2c1	ZINC000853830779	EF	On-Demand	Anodyne	MTNR1A	60	38
COc1ccc2cc(CNC(=O)N[C@@H](C)C3(CO)CC3)ccc2c1	ZINC000853830779	EF	On-Demand	Anodyne	MTNR1B	48	36
COC(=O)c1nc(CNC(=O)Nc2cccc(OCC(C)C)c2)ccc1Cl	ZINC000853830787	GH	On-Demand	Anodyne	ADRB1	17	40
COC(=O)c1nc(CNC(=O)Nc2cccc(OCC(C)C)c2)ccc1Cl	ZINC000853830787	GH	On-Demand	Anodyne	PDS	59	37
COC(=O)c1nc(CNC(=O)Nc2nc3c(s2)CCCC3)ccc1Cl	ZINC000853830808	GG	On-Demand	Anodyne	SLC27A1	31	41
O=C(Nc1cccc2ccccc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830955	EF	On-Demand	Anodyne	CCR8	62	33
O=C(Nc1cccc2ccccc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830956	EF	On-Demand	Anodyne	CCR8	62	33
O=C(Nc1cc(F)cc(F)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853830957	DE	On-Demand	Anodyne	CACNA1H	29	42
O=C(Nc1cc(F)cc(F)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853830958	DE	On-Demand	Anodyne	CACNA1H	29	42
Cc1cc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)ncn1	ZINC000853830994	GF	On-Demand	Anodyne	CCR5	59	34
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(F)cc1F	ZINC000853830996	DF	On-Demand	Mild	SOAT1	34	45
N#CCC1CN(C(=O)Nc2ccc(N3CCOCC3)cn2)C1	ZINC000853831035	DD	On-Demand	Mild	STAT6	56	35
Cn1ncnc1N1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853831040	FD	On-Demand	Anodyne	CCR5	43	33
CN1CCN(c2ccccc2NC(=O)N2CC3(CCCC3)[C@@H]2c2ccco2)CC1	ZINC000853831069	GI	On-Demand	Anodyne	KCNQ2	67	37
CN1CCN(c2ccccc2NC(=O)N2CC3(CCCC3)[C@H]2c2ccco2)CC1	ZINC000853831072	GI	On-Demand	Anodyne	KCNQ2	67	37
CCC1(CNC(=O)NNc2cccc(C(=O)OC)c2C)CC1	ZINC000853831089	DF	On-Demand	Reactive	HCN1	49	30
CCC1(CNC(=O)NNc2cccc(C(=O)OC)c2C)CC1	ZINC000853831089	DF	On-Demand	Reactive	HCN4	47	30
O=C(Nc1ccccc1C(F)(F)F)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831106	EF	On-Demand	Anodyne	RBP4	96	48
O=C(Nc1ccccc1C(F)(F)F)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831106	EF	On-Demand	Anodyne	SMO	28	52
O=C(Nc1ccccc1C(F)(F)F)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831107	EF	On-Demand	Anodyne	RBP4	96	48
O=C(Nc1ccccc1C(F)(F)F)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831107	EF	On-Demand	Anodyne	SMO	28	52
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](O)C(F)(F)C2)CC1	ZINC000853831110	FD	On-Demand	Anodyne	HTR1B	15	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](O)C(F)(F)C2)CC1	ZINC000853831110	FD	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](O)C(F)(F)C2)CC1	ZINC000853831111	FD	On-Demand	Anodyne	HTR1B	15	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](O)C(F)(F)C2)CC1	ZINC000853831111	FD	On-Demand	Anodyne	KCNQ2	72	40
O=C(N1CC[C@H](O)C(F)(F)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853831138	FD	On-Demand	Bother	CACNA1C	42	34
O=C(N1CC[C@H](O)C(F)(F)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853831138	FD	On-Demand	Bother	CACNA1D	66	34
O=C(N1CC[C@@H](O)C(F)(F)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853831140	FD	On-Demand	Bother	CACNA1C	42	34
O=C(N1CC[C@@H](O)C(F)(F)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853831140	FD	On-Demand	Bother	CACNA1D	66	34
O=C(NNc1ccnc(Cl)c1)Nc1ccc(N2CCOCC2)cn1	ZINC000853831174	EE	On-Demand	Reactive	MTOR	17	42
O=C(NNc1ccnc(Cl)c1)Nc1ccc(N2CCOCC2)cn1	ZINC000853831174	EE	On-Demand	Reactive	STAT6	55	34
Cc1ccccc1CCNC(=O)N[C@H](C)C1(CO)CC1	ZINC000853831202	CD	On-Demand	Anodyne	ANPEP	21	46
Cc1ccccc1CCNC(=O)N[C@@H](C)C1(CO)CC1	ZINC000853831203	CD	On-Demand	Anodyne	ANPEP	21	46
C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)C3(CO)CC3)cc2F)C[C@@H](C)O1	ZINC000853831234	FF	On-Demand	Anodyne	NPY2R	78	41
C[C@H]1CN(c2ccc(NC(=O)N[C@@H](C)C3(CO)CC3)cc2F)C[C@@H](C)O1	ZINC000853831237	FF	On-Demand	Anodyne	NPY2R	78	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccnc1N1CCCC1	ZINC000853831248	FE	On-Demand	Mild	KCNQ2	46	31
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CA2	83	48
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CA1	77	48
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CA7	32	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CA4	72	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CA14	35	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CA12	54	44
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CA9	57	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	CYNT	38	43
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	MTCA1	48	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853831256	FD	On-Demand	Mild	P96878_MYCTU	60	40
O=C(c1nc(=O)c2ccccc2[nH]1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831265	EC	On-Demand	Anodyne	PDE11A	47	31
O=C(c1nc(=O)c2ccccc2[nH]1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831266	EC	On-Demand	Anodyne	PDE11A	47	31
O=C(NC[C@H](O)c1cccc2ccccc12)N1CCCC1	ZINC000853831267	CF	On-Demand	Anodyne	DPP7	34	40
O=C(NC[C@@H](O)c1cccc2ccccc12)N1CCCC1	ZINC000853831268	CF	On-Demand	Anodyne	DPP7	34	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853831276	FD	On-Demand	Mild	CASP2	17	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853831276	FD	On-Demand	Mild	CASP6	15	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cccc(C(C)=O)c1	ZINC000853831281	EF	On-Demand	Mild	KCNK3	69	34
O=C(N1CCCC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831291	CC	On-Demand	Anodyne	L3MBTL3	41	35
O=C(N1CCCC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831292	CC	On-Demand	Anodyne	L3MBTL3	41	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1cc(Cl)ccc1OC	ZINC000853831293	FG	On-Demand	Mild	RBP4	17	42
N#Cc1ccncc1N1CC[C@@H](c2cccc(F)c2)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853831301	GG	On-Demand	Mild	CCR5	42	34
Cc1cc(N2CC[C@H](c3cccc(F)c3)[C@H](NC(=O)C(F)(F)F)C2)nc(C)n1	ZINC000853831306	GG	On-Demand	Anodyne	CCR5	57	33
C#CCN(CC(=O)OC(C)(C)C)C(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853831308	FD	On-Demand	Mild	STAT6	52	32
NS(=O)(=O)c1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853831309	FC	On-Demand	Anodyne	CA2	16	45
NS(=O)(=O)c1cccc(NC(=O)N2CC[C@@H](N3CCOC3=O)C2)c1	ZINC000853831309	FC	On-Demand	Anodyne	CA4	18	45
NS(=O)(=O)c1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853831310	FC	On-Demand	Anodyne	CA2	16	45
NS(=O)(=O)c1cccc(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c1	ZINC000853831310	FC	On-Demand	Anodyne	CA4	18	45
O=C(Nc1ccc(Cl)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831317	DE	On-Demand	Anodyne	EPHX2	27	49
O=C(Nc1ccc(Cl)cc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831317	DE	On-Demand	Anodyne	SMO	22	41
O=C(Nc1ccc(Cl)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831318	DE	On-Demand	Anodyne	EPHX2	27	49
O=C(Nc1ccc(Cl)cc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831318	DE	On-Demand	Anodyne	SMO	22	41
O=C(Nc1cccc(Cl)c1Cl)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831330	EG	On-Demand	Anodyne	SMO	35	50
O=C(Nc1cccc(Cl)c1Cl)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831331	EG	On-Demand	Anodyne	SMO	35	50
O=C(Nc1ncc(Cc2ccccc2)s1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853831336	FF	On-Demand	Anodyne	MGEA5	34	40
O=C(Nc1ncc(Cc2ccccc2)s1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853831337	FF	On-Demand	Anodyne	MGEA5	34	40
O=C(N[C@H]1CN(c2ccccn2)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853831355	FG	On-Demand	Anodyne	CCR5	45	33
O=C1NC(=O)c2cc(NC(=O)N3CC[C@H](N4CCOC4=O)C3)ccc21	ZINC000853831356	EC	On-Demand	Anodyne	CASP2	15	40
O=C1NC(=O)c2cc(NC(=O)N3CC[C@@H](N4CCOC4=O)C3)ccc21	ZINC000853831357	EC	On-Demand	Anodyne	CASP2	15	40
O=C(N[C@H]1CN(c2ncc(F)cn2)CC[C@H]1c1cccc(F)c1)C(F)(F)F	ZINC000853831364	GF	On-Demand	Anodyne	CCR5	47	35
CCN1CC[C@H](N(CC)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1	ZINC000853831374	GG	On-Demand	Anodyne	NPY2R	75	40
CCN1CC[C@H](N(CC)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853831375	GG	On-Demand	Anodyne	NPY2R	75	40
CCN1CC[C@H](N(CC)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853831376	GG	On-Demand	Anodyne	NPY2R	75	40
CCN1CC[C@@H](N(CC)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853831377	GG	On-Demand	Anodyne	NPY2R	75	40
O=C(NC[C@H](O)c1cccc2ccccc12)Nc1ccc(N2CCOCC2)cn1	ZINC000853831383	GF	On-Demand	Anodyne	STAT6	68	38
O=C(NC[C@@H](O)c1cccc2ccccc12)Nc1ccc(N2CCOCC2)cn1	ZINC000853831384	GF	On-Demand	Anodyne	STAT6	68	38
O=C(NC1CCC(N2CCCCC2)CC1)NC1CC(CO)C1	ZINC000853831389	DD	On-Demand	Anodyne	L3MBTL3	47	35
COC[C@H](NC(=O)Nc1cccnc1Cl)c1cccc(OC)c1	ZINC000853831400	EG	On-Demand	Anodyne	G2YM83_BOTF4	66	33
COC[C@@H](NC(=O)Nc1cccnc1Cl)c1cccc(OC)c1	ZINC000853831401	EG	On-Demand	Anodyne	G2YM83_BOTF4	66	33
COCc1cc([N+](=O)[O-])ccc1N1CCC(O)(CO)CC1	ZINC000853831417	CD	On-Demand	Bother	CACNA1D	64	34
Cc1cc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n2nc(C)cc2n1	ZINC000853831425	GE	On-Demand	Anodyne	DRD4	20	45
Cc1cc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n2nc(C)cc2n1	ZINC000853831425	GE	On-Demand	Anodyne	ACHE	27	43
Cc1cc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n2nc(C)cc2n1	ZINC000853831425	GE	On-Demand	Anodyne	HTR4	55	43
Cc1cc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n2nc(C)cc2n1	ZINC000853831425	GE	On-Demand	Anodyne	SIGMAR1	16	40
Cc1cc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n2nc(C)cc2n1	ZINC000853831425	GE	On-Demand	Anodyne	SSTR5	48	35
Cc1cc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n2nc(C)cc2n1	ZINC000853831425	GE	On-Demand	Anodyne	CACNA1I	67	48
COC[C@@H](NC(=O)c1nc(C)ns1)c1cccc(OC)c1	ZINC000853831439	DD	On-Demand	Anodyne	TACR3	23	45
COC[C@H](NC(=O)c1nc(C)ns1)c1cccc(OC)c1	ZINC000853831440	DD	On-Demand	Anodyne	TACR3	23	45
COCc1n[nH]c(CNC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)n1	ZINC000853831466	GE	On-Demand	Anodyne	ROCK1	41	45
COCc1n[nH]c(CNC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)n1	ZINC000853831466	GE	On-Demand	Anodyne	ROCK2	48	45
COCc1n[nH]c(CNC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)n1	ZINC000853831466	GE	On-Demand	Anodyne	SCD1	36	40
COCc1n[nH]c(CNC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)n1	ZINC000853831466	GE	On-Demand	Anodyne	SCD	33	47
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	DRD4	22	47
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	ACHE	36	48
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	HTR4	67	45
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	SIGMAR1	27	42
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	SSTR5	56	36
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	CCR3	19	41
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	PDK1	43	43
Cc1nc(C(=O)NCC2CCN(Cc3ccncc3)CC2)no1	ZINC000853831467	DD	On-Demand	Anodyne	CACNA1I	76	50
Cc1ccccc1[C@H](NC(=O)NNC(=O)c1cccc(F)n1)C(C)(C)C	ZINC000853831470	FG	On-Demand	Reactive	CTSA	50	36
Cc1ccccc1[C@@H](NC(=O)NNC(=O)c1cccc(F)n1)C(C)(C)C	ZINC000853831471	FG	On-Demand	Reactive	CTSA	50	36
COC[C@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831476	CF	On-Demand	Anodyne	DRD4	44	34
COC[C@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831476	CF	On-Demand	Anodyne	KCNQ2	24	45
COC[C@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831476	CF	On-Demand	Anodyne	MTNR1A	41	41
COC[C@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831476	CF	On-Demand	Anodyne	MTNR1B	50	41
COC[C@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831476	CF	On-Demand	Anodyne	DPP7	33	46
COC[C@@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831477	CF	On-Demand	Anodyne	DRD4	44	34
COC[C@@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831477	CF	On-Demand	Anodyne	KCNQ2	24	45
COC[C@@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831477	CF	On-Demand	Anodyne	MTNR1A	41	41
COC[C@@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831477	CF	On-Demand	Anodyne	MTNR1B	50	41
COC[C@@H](NC(=O)N1CCCCC1)c1cccc(OC)c1	ZINC000853831477	CF	On-Demand	Anodyne	DPP7	33	46
CCO[C@@H]1C[C@@H](NC(=O)Nc2cccc(N3CCOC3=O)c2)C1	ZINC000853831487	DE	On-Demand	Anodyne	EPHX2	44	40
COC[C@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831488	EG	On-Demand	Anodyne	ROCK1	21	52
COC[C@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831488	EG	On-Demand	Anodyne	MTNR1A	19	41
COC[C@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831488	EG	On-Demand	Anodyne	MTNR1B	25	41
COC[C@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831488	EG	On-Demand	Anodyne	TAAR1	19	40
COC[C@@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831489	EG	On-Demand	Anodyne	ROCK1	21	52
COC[C@@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831489	EG	On-Demand	Anodyne	MTNR1A	19	41
COC[C@@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831489	EG	On-Demand	Anodyne	MTNR1B	25	41
COC[C@@H](NC(=O)Nc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853831489	EG	On-Demand	Anodyne	TAAR1	19	40
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	DRD4	22	42
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	ACHE	42	50
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	HTR4	54	42
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	GRIN2B	18	40
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	HRH3	31	55
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	SIGMAR1	34	48
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	CCR3	27	42
O=C(NCC1CCN(Cc2ccncc2)CC1)N1CCCCC1	ZINC000853831490	DE	On-Demand	Anodyne	CACNA1I	69	45
CCO[C@@H]1C[C@@H](NC(=O)Nc2cccnc2Cl)C1	ZINC000853831497	CE	On-Demand	Anodyne	G2YM83_BOTF4	74	40
COC(=O)N(C)CCNC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000853831500	FD	On-Demand	Anodyne	TPSAB1	57	37
COC(=O)N(C)CCNC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000853831501	FD	On-Demand	Anodyne	TPSAB1	57	37
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853831506	FG	On-Demand	Anodyne	L3MBTL3	71	36
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1CCc2ccc(O)cc21	ZINC000853831507	FG	On-Demand	Anodyne	L3MBTL3	71	36
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	DRD4	32	48
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	ACHE	39	48
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	HTR4	71	45
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	HRH3	15	47
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	SIGMAR1	30	45
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	SSTR5	71	40
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	CCR3	24	41
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	MCHR1	40	41
Cn1ccnc1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831516	DD	On-Demand	Anodyne	CACNA1I	83	48
Cc1ccccc1[C@H](NC(=O)NCc1ncccn1)C(C)(C)C	ZINC000853831524	DG	On-Demand	Anodyne	CTSA	52	33
Cc1ccccc1[C@@H](NC(=O)NCc1ncccn1)C(C)(C)C	ZINC000853831525	DG	On-Demand	Anodyne	CTSA	52	33
CON(C)CCNC(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000853831532	ED	On-Demand	Anodyne	TPSAB1	52	37
CON(C)CCNC(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000853831533	ED	On-Demand	Anodyne	TPSAB1	52	37
COCCN(CCF)C(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC000853831537	FG	On-Demand	Anodyne	UTS2	40	32
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831550	EH	On-Demand	Mild	L3MBTL3	58	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853831552	EH	On-Demand	Anodyne	L3MBTL3	56	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@H](CCF)C1	ZINC000853831553	EH	On-Demand	Anodyne	L3MBTL3	56	37
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1COc2cc(F)ccc2C1	ZINC000853831559	GG	On-Demand	Anodyne	L3MBTL3	51	33
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1COc2cc(F)ccc2C1	ZINC000853831560	GG	On-Demand	Anodyne	L3MBTL3	51	33
O=C(NC1CCC(N2CCCCC2)CC1)N1CCc2nccnc2C1	ZINC000853831563	EE	On-Demand	Anodyne	L3MBTL3	74	37
Cc1ccccc1[C@H](NC(=O)NNC(=O)c1cn(C)nn1)C(C)(C)C	ZINC000853831564	ED	On-Demand	Reactive	CTSA	48	33
Cc1ccccc1[C@@H](NC(=O)NNC(=O)c1cn(C)nn1)C(C)(C)C	ZINC000853831565	ED	On-Demand	Reactive	CTSA	48	33
O=C1CCCN1C[C@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853831568	GE	On-Demand	Anodyne	L3MBTL3	69	37
O=C1CCCN1C[C@@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853831569	GE	On-Demand	Anodyne	L3MBTL3	69	37
COCc1n[nH]c(CNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1	ZINC000853831572	GE	On-Demand	Anodyne	NPY2R	44	33
COCc1n[nH]c(CNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1	ZINC000853831573	GE	On-Demand	Anodyne	NPY2R	44	33
COCc1n[nH]c(CNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1	ZINC000853831574	GE	On-Demand	Anodyne	NPY2R	44	33
C[C@H]1c2ccccc2OCCN1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831588	FH	On-Demand	Anodyne	XIAP	15	40
C[C@H]1c2ccccc2OCCN1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831588	FH	On-Demand	Anodyne	BIRC3	44	40
C[C@H]1c2ccccc2OCCN1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831588	FH	On-Demand	Anodyne	BIRC2	19	40
C[C@H]1c2ccccc2OCCN1C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831588	FH	On-Demand	Anodyne	L3MBTL3	56	36
COCc1n[nH]c(CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)n1	ZINC000853831598	FD	On-Demand	Bother	CACNA1C	54	41
COCc1n[nH]c(CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)n1	ZINC000853831598	FD	On-Demand	Bother	CACNA1D	82	38
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	DRD4	22	43
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	ACHE	34	47
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	HTR4	36	40
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	SIGMAR1	30	43
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	P2RY1	19	43
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	CCR3	65	44
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	FAAH	19	42
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	CACNA1I	64	43
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1cccnc1Cl	ZINC000853831604	FG	On-Demand	Anodyne	G2YM83_BOTF4	58	33
COC[C@H](NC(=O)Nc1nc(C)c(C)s1)c1cccc(OC)c1	ZINC000853831616	EG	On-Demand	Anodyne	CSNK1D	32	44
COC[C@H](NC(=O)Nc1nc(C)c(C)s1)c1cccc(OC)c1	ZINC000853831616	EG	On-Demand	Anodyne	ROCK1	19	48
COC[C@H](NC(=O)Nc1nc(C)c(C)s1)c1cccc(OC)c1	ZINC000853831616	EG	On-Demand	Anodyne	ROCK2	18	48
COC[C@@H](NC(=O)Nc1nc(C)c(C)s1)c1cccc(OC)c1	ZINC000853831617	EG	On-Demand	Anodyne	CSNK1D	32	44
COC[C@@H](NC(=O)Nc1nc(C)c(C)s1)c1cccc(OC)c1	ZINC000853831617	EG	On-Demand	Anodyne	ROCK1	19	48
COC[C@@H](NC(=O)Nc1nc(C)c(C)s1)c1cccc(OC)c1	ZINC000853831617	EG	On-Demand	Anodyne	ROCK2	18	48
CC[C@@H](CNC(=O)NCCN(C)OC)Oc1cccc(C(F)(F)F)c1	ZINC000853831621	FF	On-Demand	Anodyne	PDS	82	46
CON(C)CCNC(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC000853831627	FE	On-Demand	Anodyne	UTS2	41	34
CON(C)CCNC(=O)N[C@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC000853831628	FE	On-Demand	Anodyne	UTS2	41	34
CN1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)CCC1=O	ZINC000853831643	ED	On-Demand	Anodyne	L3MBTL3	61	37
CN(CC(=O)N1CCCC1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831669	FE	On-Demand	Anodyne	L3MBTL3	47	36
COC(=O)N(C)CCNC(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC000853831673	GE	On-Demand	Anodyne	UTS2	40	33
COC(=O)N(C)CCNC(=O)N[C@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC000853831674	GE	On-Demand	Anodyne	UTS2	40	33
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2C[C@H]2C1	ZINC000853831676	DF	On-Demand	Anodyne	L3MBTL3	103	45
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853831677	DF	On-Demand	Anodyne	L3MBTL3	103	45
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853831678	DF	On-Demand	Anodyne	L3MBTL3	103	45
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853831679	DF	On-Demand	Anodyne	L3MBTL3	103	45
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(O)(CO)CC1	ZINC000853831685	DC	On-Demand	Bother	WDR5	36	42
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	ACHE	26	46
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	LTA4H	15	41
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	SIGMAR1	25	46
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	SSTR5	43	41
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	CCR3	76	48
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	EPHX2	15	42
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	MCHR1	27	41
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc(Cl)nc1	ZINC000853831686	FG	On-Demand	Anodyne	CACNA1I	67	45
CN(Cc1cn(C)nn1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831696	ED	On-Demand	Anodyne	L3MBTL3	57	35
Cc1nc(NC(=O)N2CC3(CCC3)OC[C@H]2C)sc1-c1ccccc1	ZINC000853831703	FI	On-Demand	Anodyne	PIK3CG	20	44
Cc1nc(NC(=O)N2CC3(CCC3)OC[C@@H]2C)sc1-c1ccccc1	ZINC000853831704	FI	On-Demand	Anodyne	PIK3CG	20	44
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853831705	GC	On-Demand	Anodyne	ACHE	32	45
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853831705	GC	On-Demand	Anodyne	SIGMAR1	24	44
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853831705	GC	On-Demand	Anodyne	CACNA1I	64	41
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)NC1CCC(N2CCCCC2)CC1	ZINC000853831713	GG	On-Demand	Anodyne	L3MBTL3	69	38
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)NC1CCC(N2CCCCC2)CC1	ZINC000853831714	GG	On-Demand	Anodyne	L3MBTL3	69	38
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853831715	EE	On-Demand	Anodyne	EPHX2	20	48
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853831715	EE	On-Demand	Anodyne	L3MBTL3	43	36
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853831716	FG	On-Demand	Anodyne	NPY2R	68	37
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853831716	FG	On-Demand	Anodyne	EPHX2	40	35
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1	ZINC000853831717	FG	On-Demand	Anodyne	NPY2R	68	37
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1	ZINC000853831717	FG	On-Demand	Anodyne	EPHX2	40	35
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853831718	FG	On-Demand	Anodyne	NPY2R	68	37
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853831718	FG	On-Demand	Anodyne	EPHX2	40	35
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853831722	FH	On-Demand	Anodyne	CHRM2	15	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853831722	FH	On-Demand	Anodyne	HRH3	36	44
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853831722	FH	On-Demand	Anodyne	CCR3	23	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853831722	FH	On-Demand	Anodyne	EPHX2	46	51
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853831722	FH	On-Demand	Anodyne	L3MBTL3	92	43
NC(=O)c1cccc2c1CCN(C(=O)NC1CCC(N3CCCCC3)CC1)C2	ZINC000853831731	GF	On-Demand	Anodyne	L3MBTL3	81	39
O=C(NC1CCC(N2CCCCC2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853831745	DG	On-Demand	Anodyne	L3MBTL3	71	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(c2ccon2)CC1	ZINC000853831747	FG	On-Demand	Anodyne	SMO	36	47
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(c2ccon2)CC1	ZINC000853831747	FG	On-Demand	Anodyne	L3MBTL3	85	40
COCCN(CCF)C(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000853831750	FE	On-Demand	Anodyne	TPSAB1	68	35
C[C@H]1CN(c2ccc(NC(=O)N3CC4(CCC4)OC[C@@H]3C)cc2F)C[C@@H](C)O1	ZINC000853831756	GH	On-Demand	Anodyne	NPY2R	42	33
C[C@H]1CN(c2ccc(NC(=O)N3CC4(CCC4)OC[C@H]3C)cc2F)C[C@@H](C)O1	ZINC000853831757	GH	On-Demand	Anodyne	NPY2R	42	33
O=C(NCC1CCN(Cc2ccncc2)CC1)n1ccnc1	ZINC000853831761	CD	On-Demand	Anodyne	DRD4	16	41
O=C(NCC1CCN(Cc2ccncc2)CC1)n1ccnc1	ZINC000853831761	CD	On-Demand	Anodyne	ACHE	35	48
O=C(NCC1CCN(Cc2ccncc2)CC1)n1ccnc1	ZINC000853831761	CD	On-Demand	Anodyne	HTR4	37	43
O=C(NCC1CCN(Cc2ccncc2)CC1)n1ccnc1	ZINC000853831761	CD	On-Demand	Anodyne	SIGMAR1	30	45
O=C(NCC1CCN(Cc2ccncc2)CC1)n1ccnc1	ZINC000853831761	CD	On-Demand	Anodyne	CACNA1I	67	44
O=C(NCC1CCN(Cc2ccncc2)CC1)c1nc(Br)cs1	ZINC000853831765	GF	On-Demand	Anodyne	DRD4	18	44
O=C(NCC1CCN(Cc2ccncc2)CC1)c1nc(Br)cs1	ZINC000853831765	GF	On-Demand	Anodyne	ACHE	27	47
O=C(NCC1CCN(Cc2ccncc2)CC1)c1nc(Br)cs1	ZINC000853831765	GF	On-Demand	Anodyne	HTR4	48	42
O=C(NCC1CCN(Cc2ccncc2)CC1)c1nc(Br)cs1	ZINC000853831765	GF	On-Demand	Anodyne	SIGMAR1	23	41
O=C(NCC1CCN(Cc2ccncc2)CC1)c1nc(Br)cs1	ZINC000853831765	GF	On-Demand	Anodyne	SSTR5	40	33
O=C(NCC1CCN(Cc2ccncc2)CC1)c1nc(Br)cs1	ZINC000853831765	GF	On-Demand	Anodyne	CACNA1I	72	49
COCc1n[nH]c(CNC(=O)Nc2nc(C)c(-c3ccccc3)s2)n1	ZINC000853831785	FF	On-Demand	Anodyne	PIK3CG	16	41
COCc1n[nH]c(CNC(=O)Nc2nc(C)c(-c3ccccc3)s2)n1	ZINC000853831785	FF	On-Demand	Anodyne	PI4KB	38	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853831797	GH	On-Demand	Anodyne	L3MBTL3	63	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853831798	GH	On-Demand	Anodyne	L3MBTL3	63	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853831799	GH	On-Demand	Anodyne	L3MBTL3	63	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853831800	GH	On-Demand	Anodyne	L3MBTL3	63	37
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	DRD4	20	42
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	ACHE	46	50
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	HTR4	53	45
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	SIGMAR1	34	44
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	SSTR5	46	35
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	CCR3	24	41
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	MCHR1	20	40
CC(C)(C)OC(=O)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000853831817	ED	On-Demand	Anodyne	CACNA1I	75	45
CN(CC1=CCSC1)C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831819	EG	On-Demand	Anodyne	L3MBTL3	45	39
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853831821	CE	On-Demand	Anodyne	TIMP3	50	33
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853831821	CE	On-Demand	Anodyne	EPHX2	52	42
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853831837	GH	On-Demand	Anodyne	L3MBTL3	73	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC([C@H]2CCCCO2)CC1	ZINC000853831838	GH	On-Demand	Anodyne	L3MBTL3	73	38
Cc1nc(NC(=O)NCC2CCN(Cc3ccncc3)CC2)sc1C	ZINC000853831842	FG	On-Demand	Anodyne	ACHE	23	43
Cc1nc(NC(=O)NCC2CCN(Cc3ccncc3)CC2)sc1C	ZINC000853831842	FG	On-Demand	Anodyne	SIGMAR1	18	40
Cc1nc(NC(=O)NCC2CCN(Cc3ccncc3)CC2)sc1C	ZINC000853831842	FG	On-Demand	Anodyne	CCR3	55	47
Cc1nc(NC(=O)NCC2CCN(Cc3ccncc3)CC2)sc1C	ZINC000853831842	FG	On-Demand	Anodyne	CACNA1I	61	43
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	DRD4	28	41
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	ACHE	48	53
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	HTR4	52	41
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	SIGMAR1	39	47
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	CCR3	40	40
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	MCHR1	33	41
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	CACNA1G	38	40
O=C(NCC1CCN(Cc2ccncc2)CC1)C(F)(F)c1ccccc1F	ZINC000853831848	GG	On-Demand	Anodyne	CACNA1I	62	43
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853831850	GF	On-Demand	Anodyne	L3MBTL3	93	46
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853831851	GF	On-Demand	Anodyne	L3MBTL3	93	46
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853831859	EH	On-Demand	Anodyne	L3MBTL3	43	35
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)C1CCSCC1	ZINC000853831876	FE	On-Demand	Anodyne	ACHE	28	47
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)C1CCSCC1	ZINC000853831876	FE	On-Demand	Anodyne	HTR4	29	40
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)C1CCSCC1	ZINC000853831876	FE	On-Demand	Anodyne	SIGMAR1	28	45
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)C1CCSCC1	ZINC000853831876	FE	On-Demand	Anodyne	CCR3	18	40
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)C1CCSCC1	ZINC000853831876	FE	On-Demand	Anodyne	CACNA1I	61	42
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853831896	FG	On-Demand	Anodyne	L3MBTL3	88	40
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853831897	FG	On-Demand	Anodyne	L3MBTL3	88	40
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853831898	FG	On-Demand	Anodyne	L3MBTL3	88	40
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853831899	FG	On-Demand	Anodyne	L3MBTL3	88	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(CO)(CO)C1	ZINC000853831901	ED	On-Demand	Anodyne	L3MBTL3	53	36
CN(C)CCC[C@@H]1CN(C(=O)NC2CCC(N3CCCCC3)CC2)CCO1	ZINC000853831903	GF	On-Demand	Anodyne	L3MBTL3	42	34
COCc1n[nH]c(CNC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853831906	FD	On-Demand	Anodyne	HTR1A	41	35
COCc1n[nH]c(CNC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853831906	FD	On-Demand	Anodyne	DRD3	40	34
COCc1n[nH]c(CNC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853831906	FD	On-Demand	Anodyne	KCNQ2	70	38
CON(C)CCNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000853831907	ED	On-Demand	Anodyne	DRD2	16	46
CON(C)CCNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000853831907	ED	On-Demand	Anodyne	DRD3	21	46
CON(C)CCNC(=O)N[C@@H]1CCN(c2cccc(Cl)c2)C1	ZINC000853831907	ED	On-Demand	Anodyne	NPY1R	15	45
CON(C)CCNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000853831908	ED	On-Demand	Anodyne	DRD2	16	46
CON(C)CCNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000853831908	ED	On-Demand	Anodyne	DRD3	21	46
CON(C)CCNC(=O)N[C@H]1CCN(c2cccc(Cl)c2)C1	ZINC000853831908	ED	On-Demand	Anodyne	NPY1R	15	45
C[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1noc(Cc2ccccc2)n1	ZINC000853831914	GD	On-Demand	Anodyne	TPSAB1	49	34
C[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1noc(Cc2ccccc2)n1	ZINC000853831915	GD	On-Demand	Anodyne	TPSAB1	49	34
COC(=O)c1cccc(N2CCC(O)(CO)CC2)n1	ZINC000853831921	CC	On-Demand	Anodyne	HSD11B1	15	43
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853831922	GG	On-Demand	Anodyne	DRD4	15	40
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853831922	GG	On-Demand	Anodyne	ACHE	27	43
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853831922	GG	On-Demand	Anodyne	F10	15	43
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853831922	GG	On-Demand	Anodyne	SSTR5	40	39
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853831922	GG	On-Demand	Anodyne	CCR3	64	47
O=C(NCC1CCN(Cc2ccncc2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853831922	GG	On-Demand	Anodyne	CACNA1I	60	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(N2CCOC2=O)CC1	ZINC000853831936	GE	On-Demand	Anodyne	L3MBTL3	85	41
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N(CC)C(C)C)cc2)C1	ZINC000853831938	DH	On-Demand	Anodyne	TIMP3	48	35
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N(CC)C(C)C)cc2)C1	ZINC000853831938	DH	On-Demand	Anodyne	EPHX2	44	38
C#CCCN(CCOC)C(=O)N[C@@H](C)c1noc(Cc2ccccc2)n1	ZINC000853831944	FE	On-Demand	Mild	TPSAB1	42	33
C#CCCN(CCOC)C(=O)N[C@H](C)c1noc(Cc2ccccc2)n1	ZINC000853831945	FE	On-Demand	Mild	TPSAB1	42	33
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853831946	GG	On-Demand	Anodyne	CCR3	21	41
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H](CO)c1ccc(F)cc1F	ZINC000853831946	GG	On-Demand	Anodyne	L3MBTL3	53	33
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853831947	GG	On-Demand	Anodyne	CCR3	21	41
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H](CO)c1ccc(F)cc1F	ZINC000853831947	GG	On-Demand	Anodyne	L3MBTL3	53	33
Cc1nsc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853831963	ED	On-Demand	Anodyne	DRD4	21	46
Cc1nsc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853831963	ED	On-Demand	Anodyne	ACHE	34	47
Cc1nsc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853831963	ED	On-Demand	Anodyne	HTR4	65	46
Cc1nsc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853831963	ED	On-Demand	Anodyne	SIGMAR1	27	43
Cc1nsc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853831963	ED	On-Demand	Anodyne	SSTR5	50	35
Cc1nsc(C(=O)NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000853831963	ED	On-Demand	Anodyne	CACNA1I	72	49
COC(=O)[C@@H]1CCN(C(=O)NC2CCC(N3CCCCC3)CC2)C[C@@H]1C	ZINC000853831971	FF	On-Demand	Anodyne	L3MBTL3	71	37
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853831979	CD	On-Demand	Anodyne	L3MBTL3	56	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853831980	DD	On-Demand	Anodyne	L3MBTL3	57	36
COC[C@@H](NC(=O)C(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853831982	DD	On-Demand	Anodyne	MTNR1A	32	42
COC[C@@H](NC(=O)C(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853831982	DD	On-Demand	Anodyne	MTNR1B	34	42
COC[C@H](NC(=O)C(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853831983	DD	On-Demand	Anodyne	MTNR1A	32	42
COC[C@H](NC(=O)C(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853831983	DD	On-Demand	Anodyne	MTNR1B	34	42
CCO[C@@H]1C[C@@H](NC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853831987	FG	On-Demand	Anodyne	SCD1	40	44
CCO[C@@H]1C[C@@H](NC(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853831987	FG	On-Demand	Anodyne	SCD	38	49
CON(C)CCNC(=O)N[C@@H](c1ccccc1C)C(C)(C)C	ZINC000853831988	DF	On-Demand	Anodyne	CTSA	48	32
CON(C)CCNC(=O)N[C@H](c1ccccc1C)C(C)(C)C	ZINC000853831989	DF	On-Demand	Anodyne	CTSA	48	32
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853831991	GE	On-Demand	Anodyne	L3MBTL3	90	41
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853831992	GE	On-Demand	Anodyne	L3MBTL3	90	41
O=C(NCC1(O)CCC(F)(F)CC1)NC1CCC(N2CCCCC2)CC1	ZINC000853831994	FG	On-Demand	Anodyne	L3MBTL3	56	36
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2COC[C@H]2C1	ZINC000853832001	EE	On-Demand	Anodyne	L3MBTL3	86	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853832002	EE	On-Demand	Anodyne	L3MBTL3	86	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853832003	EE	On-Demand	Anodyne	L3MBTL3	86	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853832004	EE	On-Demand	Anodyne	L3MBTL3	86	40
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@H]21	ZINC000853832034	FH	On-Demand	Anodyne	L3MBTL3	41	33
O=C(NC1CCC(N2CCCCC2)CC1)N[C@H]1[C@@H]2c3ccc(F)cc3C[C@H]21	ZINC000853832035	FH	On-Demand	Anodyne	L3MBTL3	41	33
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853832036	FH	On-Demand	Anodyne	L3MBTL3	41	33
O=C(NC1CCC(N2CCCCC2)CC1)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21	ZINC000853832037	FH	On-Demand	Anodyne	L3MBTL3	41	33
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853832048	EE	On-Demand	Anodyne	DRD2	16	41
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853832048	EE	On-Demand	Anodyne	HTR7	24	42
CCO[C@@H]1C[C@@H](NC(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853832048	EE	On-Demand	Anodyne	KCNQ2	79	42
COCc1n[nH]c(CNC(=O)Nc2cccnc2Cl)n1	ZINC000853832058	CD	On-Demand	Anodyne	G2YM83_BOTF4	64	31
O=C(NC1CCC(N2CCCCC2)CC1)N1CCOc2ccc(O)cc2C1	ZINC000853832063	FG	On-Demand	Anodyne	L3MBTL3	87	36
COC(=O)c1ccc(CNC(=O)NC2CCC(N3CCCCC3)CC2)c(F)c1	ZINC000853832070	GG	On-Demand	Anodyne	BDKRB1	27	45
COC(=O)c1ccc(CNC(=O)NC2CCC(N3CCCCC3)CC2)c(F)c1	ZINC000853832070	GG	On-Demand	Anodyne	EPHX2	31	42
COC(=O)c1ccc(CNC(=O)NC2CCC(N3CCCCC3)CC2)c(F)c1	ZINC000853832070	GG	On-Demand	Anodyne	L3MBTL3	77	36
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	HTR1A	41	42
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	DRD2	34	41
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	DRD4	49	41
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	HTR1D	15	42
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	HTR1B	24	42
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	DRD3	42	40
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	KCNQ2	85	59
COC[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832071	GF	On-Demand	Anodyne	NPY2R	29	43
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	HTR1A	41	42
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	DRD2	34	41
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	DRD4	49	41
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	HTR1D	15	42
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	HTR1B	24	42
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	DRD3	42	40
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	KCNQ2	85	59
COC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1cccc(OC)c1	ZINC000853832072	GF	On-Demand	Anodyne	NPY2R	29	43
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccc(Cl)c1	ZINC000853832081	EE	On-Demand	Anodyne	RAF1	15	40
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccc(Cl)c1	ZINC000853832081	EE	On-Demand	Anodyne	EPHX2	17	49
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853832082	FF	On-Demand	Anodyne	RAF1	20	40
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)c(Cl)c1	ZINC000853832082	FF	On-Demand	Anodyne	EPHX2	18	42
O=C(Nc1ccc2oc(=O)ccc2c1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832088	GI	On-Demand	Anodyne	KCNH2	39	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853832100	GF	On-Demand	Anodyne	CA1	15	51
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853832100	GF	On-Demand	Anodyne	RAF1	15	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853832100	GF	On-Demand	Anodyne	EPHX2	36	50
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853832100	GF	On-Demand	Anodyne	FPR2	18	40
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(C(F)(F)F)cc1	ZINC000853832100	GF	On-Demand	Anodyne	MTCA1	34	51
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853832105	GD	On-Demand	Anodyne	KCNQ2	50	33
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccnc1N1CCCC1	ZINC000853832105	GD	On-Demand	Anodyne	TRPV1	28	40
CC(C)c1ccccc1NC(=O)NCCS(=O)(=O)CC(F)(F)F	ZINC000853832123	FF	On-Demand	Anodyne	SOAT1	45	38
O=C(N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)C(F)(F)c1ccccc1F	ZINC000853832124	GI	On-Demand	Anodyne	RBP4	19	41
O=C(N1CCC[C@H]1c1nccc(C(F)(F)F)n1)C(F)(F)c1ccccc1F	ZINC000853832125	GI	On-Demand	Anodyne	RBP4	19	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccccc1Cl	ZINC000853832165	EE	On-Demand	Anodyne	CXCL8	43	38
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccccc1Cl	ZINC000853832165	EE	On-Demand	Anodyne	EPHB3	42	33
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853832203	DH	On-Demand	Anodyne	G2YM83_BOTF4	78	47
CC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832290	FD	On-Demand	Anodyne	CCR3	36	48
CC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832290	FD	On-Demand	Anodyne	EPHX2	18	41
CC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832290	FD	On-Demand	Anodyne	AKR1C3	22	44
CC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832290	FD	On-Demand	Anodyne	IMDH_CRYPV	46	38
CC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832290	FD	On-Demand	Anodyne	KCNK3	65	34
CC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832290	FD	On-Demand	Anodyne	KCNK9	48	33
Cc1nc(C(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)no1	ZINC000853832296	DF	On-Demand	Anodyne	KCNH2	42	39
Cc1nc(C(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)no1	ZINC000853832296	DF	On-Demand	Anodyne	GLRA1	44	33
N#Cc1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853832304	ED	On-Demand	Mild	ADRB1	45	36
N#Cc1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853832304	ED	On-Demand	Mild	MTCA1	32	48
N#Cc1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853832304	ED	On-Demand	Mild	P96878_MYCTU	26	48
CON(C)CCNC(=O)N[C@H](C)c1ccc(F)c(C)c1	ZINC000853832306	CD	On-Demand	Anodyne	LEF	45	36
CON(C)CCNC(=O)N[C@@H](C)c1ccc(F)c(C)c1	ZINC000853832307	CD	On-Demand	Anodyne	LEF	45	36
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(N2CCOCC2)cn1	ZINC000853832318	GD	On-Demand	Anodyne	STAT6	54	33
Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)n1	ZINC000853832319	ED	On-Demand	Anodyne	GRM5	19	43
Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)n1	ZINC000853832319	ED	On-Demand	Anodyne	SORT1	20	41
Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832330	DE	On-Demand	Anodyne	CCKAR	21	47
Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832330	DE	On-Demand	Anodyne	FBP1	15	41
Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832330	DE	On-Demand	Anodyne	IDO1	15	40
Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832330	DE	On-Demand	Anodyne	KCNK3	71	40
Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832330	DE	On-Demand	Anodyne	KCNK9	62	39
O=C(NCCS(=O)(=O)CC(F)(F)F)N1CCc2ccccc2C1	ZINC000853832335	FD	On-Demand	Anodyne	NAMPT	17	40
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc2c(c1)OCCO2	ZINC000853832340	FD	On-Demand	Anodyne	QPCT	18	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ncc(-c2ccccc2)s1	ZINC000853832357	GF	On-Demand	Anodyne	ADRB1	41	30
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ncc(-c2ccccc2)s1	ZINC000853832357	GF	On-Demand	Anodyne	CDK5	22	40
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	CA1	21	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	EPHX2	24	40
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	CA12	20	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	CA9	19	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	NCE103	20	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	MTCA1	33	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	P96878_MYCTU	33	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cc1	ZINC000853832362	EE	On-Demand	Anodyne	NAMPT	23	43
O=C(N1CCCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832370	DH	On-Demand	Anodyne	KCNH2	44	43
O=C(N1CCCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832370	DH	On-Demand	Anodyne	HRH3	19	46
O=C(N1CCCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832370	DH	On-Demand	Anodyne	PREP	39	45
O=C(N1CCCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832370	DH	On-Demand	Anodyne	EPHX2	15	44
O=C(N1CCCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832370	DH	On-Demand	Anodyne	GLRA1	44	33
CC(=O)Nc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832374	FD	On-Demand	Anodyne	KCNK3	60	34
CC(=O)Nc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832374	FD	On-Demand	Anodyne	KCNK9	57	34
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@@](O)(C2CC2)C1	ZINC000853832384	DE	On-Demand	Bother	CACNA1D	51	34
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@](O)(C2CC2)C1	ZINC000853832385	DE	On-Demand	Bother	CACNA1D	51	34
Cc1nnc(CN(C)C(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)o1	ZINC000853832400	GH	On-Demand	Anodyne	SCD1	39	50
Cc1nnc(CN(C)C(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)o1	ZINC000853832400	GH	On-Demand	Anodyne	SCD	33	50
CC[C@@H](O)CNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832436	ED	On-Demand	Anodyne	CTSD	24	42
CC[C@@H](O)CNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832436	ED	On-Demand	Anodyne	CTSK	19	46
CC[C@@H](O)CNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832436	ED	On-Demand	Anodyne	ECE1	36	42
CC[C@@H](O)CNC(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832436	ED	On-Demand	Anodyne	POLG_HCV1	23	40
CC[C@@H](O)CNC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832437	ED	On-Demand	Anodyne	CTSD	24	42
CC[C@@H](O)CNC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832437	ED	On-Demand	Anodyne	CTSK	19	46
CC[C@@H](O)CNC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832437	ED	On-Demand	Anodyne	ECE1	36	42
CC[C@@H](O)CNC(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C	ZINC000853832437	ED	On-Demand	Anodyne	POLG_HCV1	23	40
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000853832442	EH	On-Demand	Anodyne	DGAT1	40	39
Cc1nnc(CN(C)C(=O)Nc2ccccc2N2CCN(C)CC2)o1	ZINC000853832443	ED	On-Demand	Anodyne	KCNQ2	70	37
O=C(Nc1ccc2c(c1)[C@@H](O)CCCC2)Nc1cccnc1N1CCCC1	ZINC000853832462	FI	On-Demand	Anodyne	TRPV1	16	40
O=C(Nc1ccc2c(c1)[C@@H](O)CCCC2)Nc1cccnc1N1CCCC1	ZINC000853832462	FI	On-Demand	Anodyne	P2RY1	40	41
O=C(Nc1ccc2c(c1)[C@H](O)CCCC2)Nc1cccnc1N1CCCC1	ZINC000853832466	FI	On-Demand	Anodyne	TRPV1	16	40
O=C(Nc1ccc2c(c1)[C@H](O)CCCC2)Nc1cccnc1N1CCCC1	ZINC000853832466	FI	On-Demand	Anodyne	P2RY1	40	41
CON(C)CCNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000853832479	FC	On-Demand	Anodyne	CACNA1H	20	44
CON(C)CCNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000853832479	FC	On-Demand	Anodyne	CACNA1I	61	53
N#C[C@H]1CCCC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853832481	CF	On-Demand	Mild	G2YM83_BOTF4	63	36
N#C[C@@H]1CCCC[C@@H]1NC(=O)Nc1cccnc1Cl	ZINC000853832483	CF	On-Demand	Mild	G2YM83_BOTF4	63	36
N#C[C@@H]1CCCC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853832485	CF	On-Demand	Mild	G2YM83_BOTF4	63	36
N#C[C@H]1CCCC[C@@H]1NC(=O)Nc1cccnc1Cl	ZINC000853832486	CF	On-Demand	Mild	G2YM83_BOTF4	63	36
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	KCNA5	22	49
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	CCR3	29	44
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	RAF1	15	50
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	KDR	15	42
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	MTNR1A	30	47
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	MTNR1B	38	47
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	EPHX2	26	48
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	PDGFRA	23	42
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832492	EI	On-Demand	Anodyne	TAAR1	33	40
O=C(Nc1nccs1)N1CCCC[C@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853832494	GG	On-Demand	Anodyne	MAP1	53	41
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	KCNA5	22	49
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	CCR3	29	44
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	RAF1	15	50
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	KDR	15	42
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	MTNR1A	30	47
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	MTNR1B	38	47
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	EPHX2	26	48
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	PDGFRA	23	42
COc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832495	EI	On-Demand	Anodyne	TAAR1	33	40
O=C(Nc1nccs1)N1CCCC[C@@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853832497	GG	On-Demand	Anodyne	MAP1	53	41
O=C(Nc1nccs1)N1CCCC[C@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853832498	GG	On-Demand	Anodyne	MAP1	53	41
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	CA2	92	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	CA1	88	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	KCNA5	18	42
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	CA7	61	41
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	CA4	71	50
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	CA14	49	43
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	CA12	84	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	CA9	82	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	NCE103	36	41
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	MTCA1	64	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853832519	GF	On-Demand	Anodyne	P96878_MYCTU	79	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	CA2	92	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	CA1	88	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	KCNA5	18	42
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	CA7	61	41
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	CA4	71	50
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	CA14	49	43
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	CA12	84	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	CA9	82	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	NCE103	36	41
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	MTCA1	64	67
NS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853832520	GF	On-Demand	Anodyne	P96878_MYCTU	79	67
CCn1ccc(NC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1	ZINC000853832521	FG	On-Demand	Anodyne	NPY2R	75	41
CCn1ccc(NC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1	ZINC000853832522	FG	On-Demand	Anodyne	NPY2R	75	41
CCn1ccc(NC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1	ZINC000853832523	FG	On-Demand	Anodyne	NPY2R	75	41
O=C(NC1CCC(N2CCCCC2)CC1)N1CCN([C@H]2CCOC2)CC1	ZINC000853832532	FD	On-Demand	Anodyne	L3MBTL3	44	35
O=C(NC1CCC(N2CCCCC2)CC1)N1CCN([C@@H]2CCOC2)CC1	ZINC000853832533	FD	On-Demand	Anodyne	L3MBTL3	44	35
O=C(Nc1nccs1)N[C@H]1Cc2ccccc2N(C(=O)C(F)(F)F)C1	ZINC000853832546	FF	On-Demand	Anodyne	MAP1	90	35
O=C(Nc1nccs1)N[C@@H]1Cc2ccccc2N(C(=O)C(F)(F)F)C1	ZINC000853832547	FF	On-Demand	Anodyne	MAP1	90	35
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@H]2C=CCC2)CC1	ZINC000853832566	ED	On-Demand	Anodyne	CACNA1I	62	53
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2C=CCC2)CC1	ZINC000853832567	ED	On-Demand	Anodyne	CACNA1I	62	53
CC(C)(C)OC(=O)C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832578	EF	On-Demand	Anodyne	KCNH2	44	42
CC(C)(C)OC(=O)C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832578	EF	On-Demand	Anodyne	GLRA1	45	35
N#Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832588	ED	On-Demand	Mild	ADRB1	43	36
N#Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832588	ED	On-Demand	Mild	CCR3	30	48
N#Cc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832588	ED	On-Demand	Mild	MCHR1	24	42
CC(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853832595	FD	On-Demand	Anodyne	CA1	25	44
CC(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853832595	FD	On-Demand	Anodyne	CA12	15	47
CC(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853832595	FD	On-Demand	Anodyne	CA9	16	47
CC(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853832595	FD	On-Demand	Anodyne	P96878_MYCTU	33	47
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA2	58	55
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA1	50	47
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA7	29	41
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA5B	57	33
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA4	53	53
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA5A	61	33
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA14	21	41
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA12	41	55
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	CA9	43	46
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	NCE103	16	44
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	MTCA1	45	40
NS(=O)(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832598	GC	On-Demand	Anodyne	P96878_MYCTU	58	40
Cc1nc(NC(=O)N2CCc3nc(-c4ccccc4)sc3C2)sc1C	ZINC000853832613	FI	On-Demand	Anodyne	P2RY14	52	41
Cc1cc(C(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n2nc(C)cc2n1	ZINC000853832617	GH	On-Demand	Anodyne	KCNH2	41	38
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	DRD4	40	30
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	CCR3	33	49
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	RAF1	27	45
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	MTNR1A	53	42
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	MTNR1B	50	42
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	EPHX2	27	44
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	TAAR1	39	45
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	KCNK3	56	37
COc1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853832627	ED	On-Demand	Anodyne	KCNK9	48	37
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853832629	FE	On-Demand	Anodyne	CSNK1D	44	48
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853832629	FE	On-Demand	Anodyne	PIK3CA	17	45
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853832629	FE	On-Demand	Anodyne	PIK3CG	16	45
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1nc2ccccc2s1	ZINC000853832629	FE	On-Demand	Anodyne	TMPRSS6	54	33
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1nccs1	ZINC000853832656	DD	On-Demand	Anodyne	MAP1	111	38
C[C@@H]1CC[C@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832680	DD	On-Demand	Anodyne	HRH4	15	51
C[C@@H]1CC[C@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832680	DD	On-Demand	Anodyne	MAPK9	33	43
C[C@@H]1CC[C@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832680	DD	On-Demand	Anodyne	MAPK8	37	43
O=C(Nc1nccs1)N1CCCC[C@@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853832681	GG	On-Demand	Anodyne	MAP1	53	41
COC(=O)c1ccc2c(c1)[C@H](CNC(=O)Nc1cccnc1Cl)CCC2	ZINC000853832709	FH	On-Demand	Anodyne	G2YM83_BOTF4	61	35
COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)Nc1cccnc1Cl)CCC2	ZINC000853832710	FH	On-Demand	Anodyne	G2YM83_BOTF4	61	35
Cn1nnnc1N1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853832726	FD	On-Demand	Anodyne	CCR3	46	33
COC(=O)c1ccc2c(c1)[C@H](CNC(=O)N1CCCCC1)CCC2	ZINC000853832743	EG	On-Demand	Anodyne	NQO2	21	41
COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)N1CCCCC1)CCC2	ZINC000853832745	EG	On-Demand	Anodyne	NQO2	21	41
CON(C)CCNC(=O)NC[C@H](c1cccnc1)C(C)C	ZINC000853832789	CD	On-Demand	Anodyne	KCNA5	28	52
CON(C)CCNC(=O)NC[C@@H](c1cccnc1)C(C)C	ZINC000853832791	CD	On-Demand	Anodyne	KCNA5	28	52
O=C(NCc1ccc2c(=O)cc[nH]c2c1)NC1CCC(N2CCCCC2)CC1	ZINC000853832796	GG	On-Demand	Anodyne	L3MBTL3	43	34
CN(C(=O)NC1CCC(N2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853832799	FG	On-Demand	Anodyne	TACR1	19	42
CN(C(=O)NC1CCC(N2CCCCC2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853832799	FG	On-Demand	Anodyne	L3MBTL3	68	36
CN(C(=O)NC1CCC(N2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853832801	FG	On-Demand	Anodyne	TACR1	19	42
CN(C(=O)NC1CCC(N2CCCCC2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853832801	FG	On-Demand	Anodyne	L3MBTL3	68	36
O=C(NC1CCC(N2CCCCC2)CC1)N1C[C@@H]2CCCC[C@@H]21	ZINC000853832819	DG	On-Demand	Anodyne	L3MBTL3	59	36
O=[N+]([O-])c1ccc(N2CCC[C@@](O)(C3CC3)C2)c2nonc12	ZINC000853832826	DD	On-Demand	Bother	GSTM2	101	40
O=[N+]([O-])c1ccc(N2CCC[C@@](O)(C3CC3)C2)c2nonc12	ZINC000853832826	DD	On-Demand	Bother	GSTP1	59	40
N#C[C@H]1CCCC[C@@H]1NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853832827	EF	On-Demand	Mild	CCR3	16	40
O=[N+]([O-])c1ccc(N2CCC[C@](O)(C3CC3)C2)c2nonc12	ZINC000853832828	DD	On-Demand	Bother	GSTM2	101	40
O=[N+]([O-])c1ccc(N2CCC[C@](O)(C3CC3)C2)c2nonc12	ZINC000853832828	DD	On-Demand	Bother	GSTP1	59	40
N#C[C@H]1CCCC[C@H]1NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853832829	EF	On-Demand	Mild	CCR3	16	40
N#C[C@@H]1CCCC[C@H]1NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853832834	EF	On-Demand	Mild	CCR3	16	40
N#C[C@@H]1CCCC[C@@H]1NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853832835	EF	On-Demand	Mild	CCR3	16	40
Cc1ccc(F)c(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853832842	EJ	On-Demand	Anodyne	TEK	19	42
Cc1ccc(F)c(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853832843	EJ	On-Demand	Anodyne	TEK	19	42
COCCN(CCF)C(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000853832844	FD	On-Demand	Anodyne	CACNA1I	59	51
COc1ccccc1NC(=O)N[C@@H]1Cc2ccccc2N(C(=O)C(F)(F)F)C1	ZINC000853832845	GG	On-Demand	Anodyne	P2RY1	54	37
COc1ccccc1NC(=O)N[C@H]1Cc2ccccc2N(C(=O)C(F)(F)F)C1	ZINC000853832846	GG	On-Demand	Anodyne	P2RY1	54	37
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC2SCCS2)CC1	ZINC000853832860	GD	On-Demand	Anodyne	CACNA1H	18	46
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCC2SCCS2)CC1	ZINC000853832860	GD	On-Demand	Anodyne	CACNA1I	62	55
C[C@H]1CC[C@@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832881	DD	On-Demand	Anodyne	HRH4	15	51
C[C@H]1CC[C@@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832881	DD	On-Demand	Anodyne	MAPK9	33	43
C[C@H]1CC[C@@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832881	DD	On-Demand	Anodyne	MAPK8	37	43
C[C@H]1CC[C@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832882	DD	On-Demand	Anodyne	HRH4	15	51
C[C@H]1CC[C@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832882	DD	On-Demand	Anodyne	MAPK9	33	43
C[C@H]1CC[C@H](Nc2nccc(N3CCCC3)n2)CS1(=O)=O	ZINC000853832882	DD	On-Demand	Anodyne	MAPK8	37	43
Cn1ccnc1C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832893	DF	On-Demand	Anodyne	KCNH2	42	43
Cn1ccnc1C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853832893	DF	On-Demand	Anodyne	GLRA1	54	41
CC(C)(C)OC(=O)C(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853832902	EF	On-Demand	Anodyne	SFRP1	44	34
CC(C)(C)OC(=O)C(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853832902	EF	On-Demand	Anodyne	WNT3	50	34
CC(C)(C)OC(=O)C(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853832903	EF	On-Demand	Anodyne	SFRP1	44	34
CC(C)(C)OC(=O)C(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853832903	EF	On-Demand	Anodyne	WNT3	50	34
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853832938	GF	On-Demand	Anodyne	CA2	17	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853832938	GF	On-Demand	Anodyne	CA1	48	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853832938	GF	On-Demand	Anodyne	P2RY1	62	39
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853832938	GF	On-Demand	Anodyne	EPHX2	64	47
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853832938	GF	On-Demand	Anodyne	CA12	27	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853832938	GF	On-Demand	Anodyne	CA9	28	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(OC(F)(F)F)cc1	ZINC000853832938	GF	On-Demand	Anodyne	NCE103	24	41
C[C@H]1CC[C@H](Nc2nc(C(F)(F)F)nc3ccccc23)CS1(=O)=O	ZINC000853832940	FG	On-Demand	Anodyne	CHEK2	19	41
C[C@H]1CC[C@@H](Nc2nc(C(F)(F)F)nc3ccccc23)CS1(=O)=O	ZINC000853832941	FG	On-Demand	Anodyne	CHEK2	19	41
C[C@@H]1CC[C@H](Nc2nc(C(F)(F)F)nc3ccccc23)CS1(=O)=O	ZINC000853832942	FG	On-Demand	Anodyne	CHEK2	19	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Br)cc1	ZINC000853832945	GF	On-Demand	Anodyne	CA1	16	42
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Br)cc1	ZINC000853832945	GF	On-Demand	Anodyne	MTCA1	33	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Br)cc1	ZINC000853832945	GF	On-Demand	Anodyne	P96878_MYCTU	33	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1nc2c(s1)CCCCC2	ZINC000853832955	GF	On-Demand	Anodyne	SLC27A1	28	40
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)cn1	ZINC000853832968	ED	On-Demand	Anodyne	F10	48	31
CC(C)(C)OC(=O)N1CC(NC(=O)N(CCN2CCOCC2)CC2CC2)C1	ZINC000853832986	GD	On-Demand	Anodyne	CASR	36	40
COC(=O)c1cccc(N2CCC[C@@](O)(C3CC3)C2)n1	ZINC000853833004	CD	On-Demand	Anodyne	HSD11B1	15	47
COC(=O)c1cccc(N2CCC[C@](O)(C3CC3)C2)n1	ZINC000853833005	CD	On-Demand	Anodyne	HSD11B1	15	47
CC(C)(C)OC(=O)N1CC(NC(=O)NCCc2ccc(C#N)cc2)C1	ZINC000853833006	EE	On-Demand	Mild	GPR119	28	49
O=C(Nc1nc2c(s1)CCCCC2)N1CC[C@H]1c1ccc(F)cc1	ZINC000853833013	EJ	On-Demand	Anodyne	SLC27A1	59	56
O=C(Nc1nc2c(s1)CCCCC2)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853833014	EJ	On-Demand	Anodyne	SLC27A1	59	56
CCn1cc(NC(=O)N2CC[C@H]2c2ccc(F)cc2)ccc1=O	ZINC000853833035	DF	On-Demand	Anodyne	TRPM8	35	42
CCn1cc(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)ccc1=O	ZINC000853833036	DF	On-Demand	Anodyne	TRPM8	35	42
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)C1	ZINC000853833041	FC	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)C1	ZINC000853833042	FC	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)C1	ZINC000853833043	FC	On-Demand	Anodyne	GPR119	27	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)C1	ZINC000853833044	FC	On-Demand	Anodyne	GPR119	27	41
COC(=O)c1ccc2c(c1)[C@H](CNC(=O)N1CCCC1)CCC2	ZINC000853833090	DF	On-Demand	Anodyne	NQO2	22	42
COC(=O)c1ccc2c(c1)[C@H](CNC(=O)N1CCCC1)CCC2	ZINC000853833090	DF	On-Demand	Anodyne	MTNR1B	15	47
COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)N1CCCC1)CCC2	ZINC000853833091	DF	On-Demand	Anodyne	NQO2	22	42
COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)N1CCCC1)CCC2	ZINC000853833091	DF	On-Demand	Anodyne	MTNR1B	15	47
Cc1ccc(NC(=O)N2CCCC[C@@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)cc1	ZINC000853833104	GI	On-Demand	Anodyne	EPHX2	40	39
Cc1ccc(NC(=O)N2CCCC[C@@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)cc1	ZINC000853833105	GI	On-Demand	Anodyne	EPHX2	40	39
Cc1ccc(NC(=O)N2CCCC[C@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)cc1	ZINC000853833106	GI	On-Demand	Anodyne	EPHX2	40	39
Cc1ccc(NC(=O)N2CCCC[C@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)cc1	ZINC000853833107	GI	On-Demand	Anodyne	EPHX2	40	39
CCN1CCC[C@H](CN(C)C(=O)Nc2cccnc2Cl)[C@H]1c1cnn(C)c1	ZINC000853833116	GG	On-Demand	Anodyne	G2YM83_BOTF4	52	33
CCN1CCC[C@H](CN(C)C(=O)Nc2cccnc2Cl)[C@@H]1c1cnn(C)c1	ZINC000853833117	GG	On-Demand	Anodyne	G2YM83_BOTF4	52	33
CC(C)(C)OC(=O)C(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853833120	GF	On-Demand	Anodyne	PREP	20	42
CC(C)(C)OC(=O)C(=O)N1CCCC[C@H]1[C@@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853833121	GF	On-Demand	Anodyne	PREP	20	42
CC(C)(C)OC(=O)C(=O)N1CCCC[C@@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853833122	GF	On-Demand	Anodyne	PREP	20	42
CC(C)(C)OC(=O)C(=O)N1CCCC[C@H]1[C@H]1CCCN(C(=O)C(F)(F)F)C1	ZINC000853833123	GF	On-Demand	Anodyne	PREP	20	42
Cc1nnc(CN(C)C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)o1	ZINC000853833148	GI	On-Demand	Anodyne	MPL	30	44
Cc1nnc(CN(C)C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)o1	ZINC000853833148	GI	On-Demand	Anodyne	ROCK1	20	47
Cc1nnc(CN(C)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)o1	ZINC000853833175	GF	On-Demand	Anodyne	NPY2R	61	35
Cc1nnc(CN(C)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)o1	ZINC000853833177	GF	On-Demand	Anodyne	NPY2R	61	35
Cc1nnc(CN(C)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)o1	ZINC000853833179	GF	On-Demand	Anodyne	NPY2R	61	35
O=C1CC[C@@H]2CN(C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@H]2N1	ZINC000853833202	FE	On-Demand	Anodyne	L3MBTL3	82	40
O=C1CC[C@H]2CN(C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@@H]2N1	ZINC000853833203	FE	On-Demand	Anodyne	L3MBTL3	82	40
O=C1CC[C@@H]2CN(C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@@H]2N1	ZINC000853833204	FE	On-Demand	Anodyne	L3MBTL3	82	40
O=C1CC[C@H]2CN(C(=O)NC3CCC(N4CCCCC4)CC3)CC[C@H]2N1	ZINC000853833205	FE	On-Demand	Anodyne	L3MBTL3	82	40
O[C@@]1(C2CC2)CCCN(c2cc(OCc3ccccc3)ncn2)C1	ZINC000853833206	EF	On-Demand	Anodyne	SLC12A5	49	33
O[C@]1(C2CC2)CCCN(c2cc(OCc3ccccc3)ncn2)C1	ZINC000853833207	EF	On-Demand	Anodyne	SLC12A5	49	33
O=C(Nc1ccc(-c2ncon2)cc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853833211	FI	On-Demand	Anodyne	MTOR	41	36
O=C(Nc1ccc(-c2ncon2)cc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853833212	FI	On-Demand	Anodyne	MTOR	41	36
C[C@@H](CNC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccn1	ZINC000853833217	EG	On-Demand	Anodyne	ADRA1D	29	40
C[C@@H](CNC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccn1	ZINC000853833217	EG	On-Demand	Anodyne	ADRA1A	23	40
C[C@@H](CNC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccn1	ZINC000853833217	EG	On-Demand	Anodyne	ADRA1B	25	40
C[C@@H](CNC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccn1	ZINC000853833217	EG	On-Demand	Anodyne	EPHX2	28	45
C[C@@H](CNC(=O)NC1CCC(N2CCCCC2)CC1)c1ccccn1	ZINC000853833217	EG	On-Demand	Anodyne	L3MBTL3	55	34
COc1cccc(NC(=O)N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833221	GG	On-Demand	Anodyne	CCKAR	33	49
COc1cccc(NC(=O)N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833221	GG	On-Demand	Anodyne	P2RY1	57	34
COc1cccc(NC(=O)N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833221	GG	On-Demand	Anodyne	CCR3	22	42
COc1cccc(NC(=O)N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833221	GG	On-Demand	Anodyne	CCKBR	40	49
COc1cccc(NC(=O)N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833221	GG	On-Demand	Anodyne	EPHX2	43	38
COc1cccc(NC(=O)N[C@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833221	GG	On-Demand	Anodyne	TAAR1	41	42
COc1cccc(NC(=O)N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833222	GG	On-Demand	Anodyne	CCKAR	33	49
COc1cccc(NC(=O)N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833222	GG	On-Demand	Anodyne	P2RY1	57	34
COc1cccc(NC(=O)N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833222	GG	On-Demand	Anodyne	CCR3	22	42
COc1cccc(NC(=O)N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833222	GG	On-Demand	Anodyne	CCKBR	40	49
COc1cccc(NC(=O)N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833222	GG	On-Demand	Anodyne	EPHX2	43	38
COc1cccc(NC(=O)N[C@@H]2Cc3ccccc3N(C(=O)C(F)(F)F)C2)c1	ZINC000853833222	GG	On-Demand	Anodyne	TAAR1	41	42
COCCn1cc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cn1	ZINC000853833236	EF	On-Demand	Anodyne	PANC	52	34
COCCn1cc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cn1	ZINC000853833237	EF	On-Demand	Anodyne	PANC	52	34
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(O)(CO)CC1	ZINC000853833250	ED	On-Demand	Anodyne	L3MBTL3	55	35
COc1ccc2c(N3C[C@H](C)[C@@H](O)[C@H](C)C3)ccnc2c1	ZINC000853833251	CF	On-Demand	Anodyne	KDR	24	41
COc1ccc2c(N3C[C@H](C)C(O)[C@@H](C)C3)ccnc2c1	ZINC000853833252	CF	On-Demand	Anodyne	KDR	24	41
COc1ccc2c(N3C[C@@H](C)C(O)[C@H](C)C3)ccnc2c1	ZINC000853833253	CF	On-Demand	Anodyne	KDR	24	41
O=C(Nc1ccc2c(c1)[C@@H](O)CCCC2)Nc1ccccc1Cl	ZINC000853833264	EJ	On-Demand	Anodyne	GRM4	32	40
O=C(Nc1ccc2c(c1)[C@@H](O)CCCC2)Nc1ccccc1Cl	ZINC000853833264	EJ	On-Demand	Anodyne	EPHB3	42	32
O=C(Nc1ccc2c(c1)[C@H](O)CCCC2)Nc1ccccc1Cl	ZINC000853833265	EJ	On-Demand	Anodyne	GRM4	32	40
O=C(Nc1ccc2c(c1)[C@H](O)CCCC2)Nc1ccccc1Cl	ZINC000853833265	EJ	On-Demand	Anodyne	EPHB3	42	32
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853833272	EF	On-Demand	Anodyne	L3MBTL3	73	38
CCn1ccc(NC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853833273	EE	On-Demand	Anodyne	KCNQ2	80	42
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](C)C1=O	ZINC000853833307	CE	On-Demand	Anodyne	RBP4	44	31
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](C)C1=O	ZINC000853833307	CE	On-Demand	Anodyne	G2YM83_BOTF4	78	43
Cc1nsc(C(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853833311	EG	On-Demand	Anodyne	KCNH2	43	40
Cc1nsc(C(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)n1	ZINC000853833311	EG	On-Demand	Anodyne	GLRA1	47	35
O=C(Nc1ccc(Cl)nc1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853833318	FI	On-Demand	Anodyne	KCNH2	40	42
C[C@H]1CC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)CS1(=O)=O	ZINC000853833327	ED	On-Demand	Bother	GSTM2	114	44
C[C@H]1CC[C@@H](Nc2ccc([N+](=O)[O-])c3nonc23)CS1(=O)=O	ZINC000853833327	ED	On-Demand	Bother	GSTP1	70	44
C[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)CS1(=O)=O	ZINC000853833328	ED	On-Demand	Bother	GSTM2	114	44
C[C@@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)CS1(=O)=O	ZINC000853833328	ED	On-Demand	Bother	GSTP1	70	44
C[C@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)CS1(=O)=O	ZINC000853833329	ED	On-Demand	Bother	GSTM2	114	44
C[C@H]1CC[C@H](Nc2ccc([N+](=O)[O-])c3nonc23)CS1(=O)=O	ZINC000853833329	ED	On-Demand	Bother	GSTP1	70	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1F	ZINC000853833338	FD	On-Demand	Bother	TRPV1	48	33
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)C1=O	ZINC000853833339	EE	On-Demand	Anodyne	HTR1B	15	44
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)C1=O	ZINC000853833339	EE	On-Demand	Anodyne	KCNQ2	75	40
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)C1=O	ZINC000853833339	EE	On-Demand	Anodyne	RBP4	52	34
C[C@H]1CC[C@@H](Nc2ncnc3sc(-c4ccccc4)cc23)CS1(=O)=O	ZINC000853833354	FH	On-Demand	Anodyne	CHEK1	15	41
C[C@H]1CC[C@@H](Nc2ncnc3sc(-c4ccccc4)cc23)CS1(=O)=O	ZINC000853833354	FH	On-Demand	Anodyne	CD38	46	39
C[C@H]1CC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)CS1(=O)=O	ZINC000853833355	FH	On-Demand	Anodyne	CHEK1	15	41
C[C@H]1CC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)CS1(=O)=O	ZINC000853833355	FH	On-Demand	Anodyne	CD38	46	39
C[C@@H]1CC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)CS1(=O)=O	ZINC000853833356	FH	On-Demand	Anodyne	CHEK1	15	41
C[C@@H]1CC[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)CS1(=O)=O	ZINC000853833356	FH	On-Demand	Anodyne	CD38	46	39
C[C@H]1CC[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)CS1(=O)=O	ZINC000853833364	FG	On-Demand	Anodyne	CHEK2	26	45
C[C@@H]1CC[C@H](Nc2nc(-c3cccnc3)nc3ccccc23)CS1(=O)=O	ZINC000853833365	FG	On-Demand	Anodyne	CHEK2	26	45
C[C@H]1CC[C@H](Nc2nc(-c3cccnc3)nc3ccccc23)CS1(=O)=O	ZINC000853833367	FG	On-Demand	Anodyne	CHEK2	26	45
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853833371	GC	On-Demand	Anodyne	CASP3	16	48
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853833371	GC	On-Demand	Anodyne	CASP2	18	44
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853833371	GC	On-Demand	Anodyne	CASP6	15	44
CC(C)(C)OC(=O)N1CC(NC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)C1	ZINC000853833384	GE	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CC(NC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)C1	ZINC000853833385	GE	On-Demand	Anodyne	GPR119	21	40
CS(=O)(=O)c1ccc(NC(=O)N2CC[C@H]2c2ccc(F)cc2)cn1	ZINC000853833394	EF	On-Demand	Anodyne	TRPM8	30	40
CS(=O)(=O)c1ccc(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)cn1	ZINC000853833395	EF	On-Demand	Anodyne	TRPM8	30	40
COC(=O)c1ccc(C)c(NC(=O)N2CC[C@H]2c2ccc(F)cc2)c1	ZINC000853833424	EH	On-Demand	Anodyne	MAPK11	25	40
COC(=O)c1ccc(C)c(NC(=O)N2CC[C@H]2c2ccc(F)cc2)c1	ZINC000853833424	EH	On-Demand	Anodyne	MAPK14	22	40
COC(=O)c1ccc(C)c(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000853833425	EH	On-Demand	Anodyne	MAPK11	25	40
COC(=O)c1ccc(C)c(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000853833425	EH	On-Demand	Anodyne	MAPK14	22	40
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccnc2N2CCCC2)C1	ZINC000853833467	GE	On-Demand	Anodyne	TRPV1	15	43
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccnc2N2CCCC2)C1	ZINC000853833467	GE	On-Demand	Anodyne	SCN2A	17	42
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccnc2N2CCCC2)C1	ZINC000853833467	GE	On-Demand	Anodyne	SCN10A	27	42
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cccnc2N2CCCC2)C1	ZINC000853833467	GE	On-Demand	Anodyne	GPR119	36	41
CC(C)(C)OC(=O)N1CC(NC(=O)N2CCc3nccnc3C2)C1	ZINC000853833478	ED	On-Demand	Anodyne	GPR119	30	42
Nc1nc(Cl)cc(N2CCC[C@](O)(C3CC3)C2)n1	ZINC000853833486	CD	On-Demand	Anodyne	HRH4	41	35
Nc1nc(Cl)cc(N2CCC[C@@](O)(C3CC3)C2)n1	ZINC000853833487	CD	On-Demand	Anodyne	HRH4	41	35
CCC(CC)(CNC(=O)N1CCCC[C@H]1c1nc[nH]n1)NC(=O)OC(C)(C)C	ZINC000853833495	GG	On-Demand	Anodyne	CPT1A	61	35
CCC(CC)(CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)NC(=O)OC(C)(C)C	ZINC000853833496	GG	On-Demand	Anodyne	CPT1A	61	35
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853833498	GF	On-Demand	Anodyne	NPY1R	34	47
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853833498	GF	On-Demand	Anodyne	CCKBR	50	37
CS(=O)(=O)C1CN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853833546	ED	On-Demand	Anodyne	L3MBTL3	53	35
CC[C@@H](O)CNC(=O)NC1CCC(N2CCCCC2)CC1	ZINC000853833559	CD	On-Demand	Anodyne	EPHX2	16	41
Cc1cc(N2CCC[C@@](O)(C3CC3)C2)nc(N)n1	ZINC000853833590	BD	On-Demand	Anodyne	HRH4	44	38
COCCN(CCF)C(=O)NCC1CCN(CCC(C)C)CC1	ZINC000853833601	EE	On-Demand	Anodyne	CACNA1I	55	35
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853833620	FE	On-Demand	Anodyne	L3MBTL3	98	42
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853833622	FE	On-Demand	Anodyne	L3MBTL3	98	42
Cc1nnc(CN(C)C(=O)Nc2cccnc2Cl)o1	ZINC000853833625	CE	On-Demand	Anodyne	G2YM83_BOTF4	67	33
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853833627	EI	On-Demand	Anodyne	KCNA5	18	41
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853833627	EI	On-Demand	Anodyne	CCR3	28	46
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853833627	EI	On-Demand	Anodyne	EPHX2	19	46
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853833627	EI	On-Demand	Anodyne	IMDH_CRYPV	45	36
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853833627	EI	On-Demand	Anodyne	KCNK3	44	38
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853833629	EI	On-Demand	Anodyne	KCNA5	18	41
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853833629	EI	On-Demand	Anodyne	CCR3	28	46
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853833629	EI	On-Demand	Anodyne	EPHX2	19	46
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853833629	EI	On-Demand	Anodyne	IMDH_CRYPV	45	36
CC(=O)c1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853833629	EI	On-Demand	Anodyne	KCNK3	44	38
O=C(NCCCc1nc[nH]n1)NC1CCC(N2CCCCC2)CC1	ZINC000853833661	ED	On-Demand	Anodyne	HRH2	18	44
COCc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)C(O)[C@H](C)C1	ZINC000853833662	CE	On-Demand	Bother	CACNA1C	53	38
COCc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)C(O)[C@H](C)C1	ZINC000853833662	CE	On-Demand	Bother	CACNA1D	83	38
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)[C@@H](O)[C@H](C)C1	ZINC000853833664	CE	On-Demand	Bother	CACNA1C	53	38
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)[C@@H](O)[C@H](C)C1	ZINC000853833664	CE	On-Demand	Bother	CACNA1D	83	38
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)C(O)[C@@H](C)C1	ZINC000853833665	CE	On-Demand	Bother	CACNA1C	53	38
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)C(O)[C@@H](C)C1	ZINC000853833665	CE	On-Demand	Bother	CACNA1D	83	38
COCCOc1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cn1	ZINC000853833676	GD	On-Demand	Anodyne	ADRB1	37	41
COC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853833735	FD	On-Demand	Anodyne	EPHX2	19	44
COC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853833735	FD	On-Demand	Anodyne	KCNK3	67	34
COC(=O)c1cccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853833735	FD	On-Demand	Anodyne	KCNK9	56	32
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccc2cccnc12	ZINC000853833737	FE	On-Demand	Anodyne	TRPV1	19	48
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cnc(-c2ccccc2)nc1	ZINC000853833741	GE	On-Demand	Anodyne	ADRB1	43	33
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853833759	FD	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853833761	FD	On-Demand	Anodyne	GPR119	30	42
Cc1nc(C(=O)N2CC[C@@H]2c2ccc(F)cc2)no1	ZINC000853833779	CE	On-Demand	Anodyne	KCNA5	17	41
Cc1nc(C(=O)N2CC[C@H]2c2ccc(F)cc2)no1	ZINC000853833781	CE	On-Demand	Anodyne	KCNA5	17	41
O=C(N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2)n1ccnc1	ZINC000853833818	CF	On-Demand	Anodyne	KCNH2	44	42
O=C(N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2)n1ccnc1	ZINC000853833818	CF	On-Demand	Anodyne	GLRA1	48	37
CC(C)(C)OC(=O)N1CC(NC(=O)N[C@@H](CO)c2ccc(F)cc2F)C1	ZINC000853833837	FD	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CC(NC(=O)N[C@H](CO)c2ccc(F)cc2F)C1	ZINC000853833838	FD	On-Demand	Anodyne	GPR119	22	42
Cc1nc(NC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)sc1C	ZINC000853833850	FI	On-Demand	Anodyne	KCNH2	41	38
Cc1nc(NC(=O)N2[C@H]3CC[C@H]2CC(Oc2ccccc2)C3)sc1C	ZINC000853833850	FI	On-Demand	Anodyne	GLRA1	42	31
O=C(C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2)C1CCSCC1	ZINC000853833856	FG	On-Demand	Anodyne	KCNH2	43	41
O=C(C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2)C1CCSCC1	ZINC000853833856	FG	On-Demand	Anodyne	GLRA1	43	32
CS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853833857	GD	On-Demand	Anodyne	CA2	18	42
CS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853833857	GD	On-Demand	Anodyne	CA12	24	40
CS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853833857	GD	On-Demand	Anodyne	CA9	21	40
CS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853833857	GD	On-Demand	Anodyne	NCE103	15	42
CS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853833857	GD	On-Demand	Anodyne	MTCA1	42	40
CS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853833857	GD	On-Demand	Anodyne	P96878_MYCTU	52	40
CS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853833857	GD	On-Demand	Anodyne	NAMPT	41	37
CC(C)(C)OC(=O)N1CC(NC(=O)NCC2CCN(C3CCOCC3)CC2)C1	ZINC000853833872	GD	On-Demand	Anodyne	CACNA1I	42	33
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(c2ccco2)CC1	ZINC000853833891	FH	On-Demand	Anodyne	SMO	15	41
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(c2ccco2)CC1	ZINC000853833891	FH	On-Demand	Anodyne	L3MBTL3	87	41
C[C@H]1CN(c2ccc(NC(=O)N3C[C@@]4(C)COC[C@@]4(C)C3)cc2F)C[C@H](C)O1	ZINC000853833893	GG	On-Demand	Anodyne	NPY2R	58	35
C[C@H]1CN(c2ccc(NC(=O)N3C[C@@]4(C)COC[C@@]4(C)C3)cc2F)C[C@@H](C)O1	ZINC000853833896	GG	On-Demand	Anodyne	NPY2R	58	35
C#CCCN(CCOC)C(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000853833898	GD	On-Demand	Mild	CACNA1I	45	48
COC(=O)c1ccc2c(c1)[C@H](CNC(=O)C(=O)OC(C)(C)C)CCC2	ZINC000853833910	EE	On-Demand	Anodyne	NQO2	21	43
O=C(NC[C@@]1(O)C[C@H]2C=C[C@H]1C2)NC1CCC(N2CCCCC2)CC1	ZINC000853833911	EE	On-Demand	Anodyne	L3MBTL3	45	33
COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)C(=O)OC(C)(C)C)CCC2	ZINC000853833912	EE	On-Demand	Anodyne	NQO2	21	43
O=C(NC[C@]1(O)C[C@H]2C=C[C@H]1C2)NC1CCC(N2CCCCC2)CC1	ZINC000853833913	EE	On-Demand	Anodyne	L3MBTL3	45	33
Cc1cc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)no1	ZINC000853833917	DG	On-Demand	Anodyne	FLT3	40	35
Cc1cc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)no1	ZINC000853833919	DG	On-Demand	Anodyne	FLT3	40	35
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCCC[C@@H]2C#N)CC1	ZINC000853833923	EF	On-Demand	Mild	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCCC[C@@H]2C#N)CC1	ZINC000853833923	EF	On-Demand	Mild	CSF1R	20	42
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCCC[C@H]2C#N)CC1	ZINC000853833927	EF	On-Demand	Mild	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCCC[C@H]2C#N)CC1	ZINC000853833927	EF	On-Demand	Mild	CSF1R	20	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCCC[C@@H]2C#N)CC1	ZINC000853833929	EF	On-Demand	Mild	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCCC[C@@H]2C#N)CC1	ZINC000853833929	EF	On-Demand	Mild	CSF1R	20	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCCC[C@H]2C#N)CC1	ZINC000853833930	EF	On-Demand	Mild	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCCC[C@H]2C#N)CC1	ZINC000853833930	EF	On-Demand	Mild	CSF1R	20	42
C[C@@H](CCNC(=O)NC1CCC(N2CCCCC2)CC1)N(C)C	ZINC000853833935	DE	On-Demand	Anodyne	CHRNA4	15	41
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853833943	FI	On-Demand	Anodyne	L3MBTL3	74	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853833945	FI	On-Demand	Anodyne	L3MBTL3	74	37
CN(C)c1ncc(CNC(=O)NNc2nc3ccc(Cl)cc3s2)n1C	ZINC000853833980	GF	On-Demand	Reactive	CSNK1D	33	43
O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853833995	EH	On-Demand	Bother	P96878_MYCTU	15	43
O=C(Nc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853833996	EH	On-Demand	Bother	P96878_MYCTU	15	43
N#CC[C@@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853834029	EG	On-Demand	Mild	L3MBTL3	51	36
N#CC[C@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853834031	EG	On-Demand	Mild	L3MBTL3	51	36
Cc1nnc(CN(C)C(=O)Nc2ccc(N3CCCC3)nc2)o1	ZINC000853834069	DE	On-Demand	Anodyne	DGAT1	40	41
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H]2c2ccc(F)cc2)c1	ZINC000853834086	GG	On-Demand	Anodyne	CCR3	59	40
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000853834087	GG	On-Demand	Anodyne	CCR3	59	40
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@H]2c2ccc(F)cc2)c1	ZINC000853834088	GG	On-Demand	Anodyne	CCR3	59	40
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)c1	ZINC000853834089	GG	On-Demand	Anodyne	CCR3	59	40
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3COC[C@@H]3C2)C1	ZINC000853834117	ED	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3COC[C@H]3C2)C1	ZINC000853834119	ED	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3COC[C@@H]3C2)C1	ZINC000853834121	ED	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3COC[C@H]3C2)C1	ZINC000853834123	ED	On-Demand	Anodyne	GPR119	30	43
O=C(Nc1nc2c(s1)CCC2)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853834145	DH	On-Demand	Anodyne	SLC27A1	58	56
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(N2CCCC2)nc1	ZINC000853834149	GD	On-Demand	Anodyne	DGAT1	37	42
O=C(Nc1nc2c(s1)CCC2)N1CC[C@H]1c1ccc(F)cc1	ZINC000853834152	DH	On-Demand	Anodyne	SLC27A1	58	56
O=C(N1CCCC1)N1CCc2nc(-c3ccccc3)sc2C1	ZINC000853834180	DG	On-Demand	Anodyne	GRM5	16	66
CC(C)(C)OC(=O)N1CC(NC(=O)NCCc2ccnc3ccccc23)C1	ZINC000853834190	FF	On-Demand	Anodyne	ADAM17	17	41
CC(C)(C)OC(=O)N1CC(NC(=O)NCCc2ccnc3ccccc23)C1	ZINC000853834190	FF	On-Demand	Anodyne	MTNR1A	17	40
CN(C(=O)NC1CN(C(=O)OC(C)(C)C)C1)[C@H](CO)Cc1ccccc1	ZINC000853834201	FD	On-Demand	Anodyne	FPR1	42	32
CN(C(=O)NC1CN(C(=O)OC(C)(C)C)C1)[C@@H](CO)Cc1ccccc1	ZINC000853834202	FD	On-Demand	Anodyne	FPR1	42	32
CC(C)(C)OC(=O)N1CC(NC(=O)NCC2CCN(CC3CC3)CC2)C1	ZINC000853834214	FE	On-Demand	Anodyne	CACNA1I	61	38
O=C(N1CCOCC1)C(F)(F)C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834230	GE	On-Demand	Anodyne	KCNH2	40	38
O=C(N1CCOCC1)C(F)(F)C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834230	GE	On-Demand	Anodyne	ITGAL	60	38
O=C(N1CCOCC1)C(F)(F)C(=O)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834230	GE	On-Demand	Anodyne	GLRA1	42	32
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)c(Cl)c1	ZINC000853834244	GG	On-Demand	Anodyne	RAF1	30	41
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(Cl)c(Cl)c1	ZINC000853834244	GG	On-Demand	Anodyne	EPHX2	18	51
Cc1nc(NC(=O)N2C[C@@H](C)C(=O)[C@H](C)C2)sc1-c1ccccc1	ZINC000853834247	EH	On-Demand	Anodyne	PIK3CG	21	45
Cc1nc(NC(=O)N2C[C@@H](C)C(=O)[C@H](C)C2)sc1-c1ccccc1	ZINC000853834247	EH	On-Demand	Anodyne	PI4KB	40	37
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1	ZINC000853834263	FD	On-Demand	Bother	NMBR	41	31
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccnc1	ZINC000853834264	DD	On-Demand	Anodyne	NAMPT	64	45
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccnc1Cl	ZINC000853834265	ED	On-Demand	Anodyne	G2YM83_BOTF4	56	31
O=C(N1CCCCC1)N1CCc2nc(-c3ccccc3)sc2C1	ZINC000853834272	EH	On-Demand	Anodyne	GRM5	15	67
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)cc1F	ZINC000853834276	EE	On-Demand	Anodyne	TRPV1	67	34
N#Cc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853834290	DH	On-Demand	Mild	CCR3	18	45
N#Cc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1	ZINC000853834290	DH	On-Demand	Mild	MCHR1	40	42
N#Cc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853834291	DH	On-Demand	Mild	CCR3	18	45
N#Cc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1	ZINC000853834291	DH	On-Demand	Mild	MCHR1	40	42
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCC(N2CCCCC2)CC1	ZINC000853834326	GH	On-Demand	Anodyne	SIGMAR1	17	44
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCC(N2CCCCC2)CC1	ZINC000853834326	GH	On-Demand	Anodyne	EPHX2	18	40
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCC(N2CCCCC2)CC1	ZINC000853834326	GH	On-Demand	Anodyne	L3MBTL3	76	39
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCC(N2CCCCC2)CC1	ZINC000853834327	GH	On-Demand	Anodyne	SIGMAR1	17	44
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCC(N2CCCCC2)CC1	ZINC000853834327	GH	On-Demand	Anodyne	EPHX2	18	40
O=C(NC[C@@H](O)c1cccc2ccccc12)NC1CCC(N2CCCCC2)CC1	ZINC000853834327	GH	On-Demand	Anodyne	L3MBTL3	76	39
Cc1nc(NC(=O)N2C[C@@]3(C)COC[C@@]3(C)C2)sc1-c1ccccc1	ZINC000853834328	FI	On-Demand	Anodyne	PIK3CG	22	44
Cc1nc(NC(=O)N2C[C@@]3(C)COC[C@@]3(C)C2)sc1-c1ccccc1	ZINC000853834328	FI	On-Demand	Anodyne	PI4KB	41	40
C#C[C@@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)C1CCOCC1	ZINC000853834352	GD	On-Demand	Mild	CACNA1I	45	46
C#C[C@H](NC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)C1CCOCC1	ZINC000853834353	GD	On-Demand	Mild	CACNA1I	45	46
COC(=O)[C@@H]1CCN(C(=O)N[C@@H](CNC(=O)OC(C)(C)C)CC(C)C)C[C@@H]1C	ZINC000853834405	GF	On-Demand	Anodyne	FPR1	42	35
COC(=O)[C@@H]1CCN(C(=O)N[C@H](CNC(=O)OC(C)(C)C)CC(C)C)C[C@@H]1C	ZINC000853834406	GF	On-Demand	Anodyne	FPR1	42	35
Cc1nnc(CN(C)C(=O)Nc2nc(C)c(-c3ccccc3)s2)o1	ZINC000853834415	EG	On-Demand	Anodyne	PIK3CG	20	41
Cc1nnc(CN(C)C(=O)Nc2nc(C)c(-c3ccccc3)s2)o1	ZINC000853834415	EG	On-Demand	Anodyne	PI4KB	38	42
COc1ccc(N2CC[C@H](NC(=O)NCc3c(F)c(F)cc(F)c3F)C2)cc1	ZINC000853834431	GG	On-Demand	Clean	MTNR1A	16	47
COc1ccc(N2CC[C@H](NC(=O)NCc3c(F)c(F)cc(F)c3F)C2)cc1	ZINC000853834431	GG	On-Demand	Clean	MTNR1B	17	47
COc1ccc(N2CC[C@H](NC(=O)NCc3c(F)c(F)cc(F)c3F)C2)cc1	ZINC000853834431	GG	On-Demand	Clean	MCHR1	18	46
O[C@@]1(C2CC2)CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853834455	CD	On-Demand	Anodyne	SORD	50	36
O[C@]1(C2CC2)CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853834456	CD	On-Demand	Anodyne	SORD	50	36
C[C@H]1c2ccccc2C[C@H]1NC(=O)N1CCCCC1	ZINC000853834476	CF	On-Demand	Anodyne	EPHX2	21	48
C[C@@H](CCNC(=O)NC1CN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853834485	DD	On-Demand	Anodyne	CHRNA3	25	44
C[C@@H](CCNC(=O)NC1CN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853834485	DD	On-Demand	Anodyne	CHRNA4	21	44
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2ncccn2)C1	ZINC000853834495	DC	On-Demand	Anodyne	GPR119	34	44
COCCOc1ccc(NC(=O)N2CC[C@H]2c2ccc(F)cc2)cn1	ZINC000853834525	EG	On-Demand	Anodyne	TRPM8	27	40
COCCOc1ccc(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)cn1	ZINC000853834526	EG	On-Demand	Anodyne	TRPM8	27	40
CC(C)(C)OC(=O)N1CC(NC(=O)NCc2cnccc2C(F)(F)F)C1	ZINC000853834530	FF	On-Demand	Anodyne	GPR119	28	40
O=C(Nc1nc(C(F)(F)F)cs1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853834554	EI	On-Demand	Anodyne	TRPM8	53	45
O=C(Nc1nc(C(F)(F)F)cs1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853834555	EI	On-Demand	Anodyne	TRPM8	53	45
COC(=O)c1ccc(CNC(=O)NC2CN(C(=O)OC(C)(C)C)C2)c(F)c1	ZINC000853834567	GE	On-Demand	Anodyne	GPR119	23	40
COc1ccc(N2CC[C@H](NC(=O)NC3CN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853834569	GE	On-Demand	Clean	GPR119	37	47
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]2c2ccc(F)cc2)CC1	ZINC000853834572	FH	On-Demand	Anodyne	KCNQ2	74	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC000853834573	FH	On-Demand	Anodyne	KCNQ2	74	46
Cc1ccncc1CCNC(=O)NC1CN(C(=O)OC(C)(C)C)C1	ZINC000853834575	ED	On-Demand	Anodyne	GPR119	30	42
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccccc1C(F)(F)F	ZINC000853834581	GF	On-Demand	Anodyne	TRPV1	18	45
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA2	132	56
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA1	122	56
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA7	56	46
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA5B	56	43
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA4	99	53
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA5A	59	43
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA14	49	46
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	EPHX2	15	45
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA12	96	56
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CA9	106	56
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	CYNT	50	42
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	NCE103	47	56
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	MTCA1	65	56
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	P96878_MYCTU	81	56
NS(=O)(=O)c1ccc(NC(=O)NCCS(=O)(=O)CC(F)(F)F)cc1	ZINC000853834598	GC	On-Demand	Anodyne	NAMPT	41	39
C[C@H]1CN(c2ccc(NC(=O)N3C[C@@H](C)C(=O)[C@H](C)C3)cc2F)C[C@H](C)O1	ZINC000853834632	GG	On-Demand	Anodyne	NPY2R	62	37
C[C@H]1CN(c2ccc(NC(=O)N3C[C@@H](C)C(=O)[C@H](C)C3)cc2F)C[C@@H](C)O1	ZINC000853834633	GG	On-Demand	Anodyne	NPY2R	62	37
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853834645	FF	On-Demand	Anodyne	KCNJ11	89	33
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853834645	FF	On-Demand	Anodyne	TRPV1	36	47
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1cccc2ccccc12	ZINC000853834645	FF	On-Demand	Anodyne	HDAH	18	41
COc1ncccc1NC(=O)NCCS(=O)(=O)CC(F)(F)F	ZINC000853834651	ED	On-Demand	Anodyne	P2RY1	50	43
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853834652	ED	On-Demand	Anodyne	CA1	20	43
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853834652	ED	On-Demand	Anodyne	CCR3	20	43
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853834652	ED	On-Demand	Anodyne	CA12	20	45
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853834652	ED	On-Demand	Anodyne	CA9	18	43
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853834652	ED	On-Demand	Anodyne	MTCA1	33	45
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1ccc(F)cc1	ZINC000853834652	ED	On-Demand	Anodyne	P96878_MYCTU	37	45
O=C(N1CCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834653	DG	On-Demand	Anodyne	KCNH2	45	44
O=C(N1CCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834653	DG	On-Demand	Anodyne	HRH3	20	46
O=C(N1CCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834653	DG	On-Demand	Anodyne	PREP	44	45
O=C(N1CCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834653	DG	On-Demand	Anodyne	EPHX2	17	45
O=C(N1CCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834653	DG	On-Demand	Anodyne	GLRA1	44	34
O=C(N1CCCC1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834653	DG	On-Demand	Anodyne	L3MBTL3	41	36
O=C(NCCS(=O)(=O)CC(F)(F)F)Nc1nc2c(s1)CCCC2	ZINC000853834668	FE	On-Demand	Anodyne	SLC27A1	28	40
O=C(c1nc(Br)cs1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853834672	GI	On-Demand	Anodyne	KCNH2	42	40
COC(=O)c1ccc2c(c1)[C@@H](CNC(=O)C(C)(F)F)CCC2	ZINC000853834720	DF	On-Demand	Anodyne	NQO2	26	54
COC(=O)c1ccc2c(c1)[C@H](CNC(=O)C(C)(F)F)CCC2	ZINC000853834721	DF	On-Demand	Anodyne	NQO2	26	54
O=C(Nc1ccc2c(c1)[C@H](O)CCCC2)Nc1nccs1	ZINC000853834740	DH	On-Demand	Anodyne	MAP1	97	40
O=C(Nc1ccc2c(c1)[C@@H](O)CCCC2)Nc1nccs1	ZINC000853834742	DH	On-Demand	Anodyne	MAP1	97	40
Cc1nnc(CN(C)C(=O)Nc2ccc(N3CCOCC3)cn2)o1	ZINC000853834753	ED	On-Demand	Anodyne	STAT6	61	35
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@@H]2COC3(CCC3)C2)CC1	ZINC000853834754	GD	On-Demand	Anodyne	CACNA1I	47	47
CC(C)(C)NC(=O)CN1CCC(CNC(=O)N[C@H]2COC3(CCC3)C2)CC1	ZINC000853834758	GD	On-Demand	Anodyne	CACNA1I	47	47
O=C(Nc1ccc(F)cc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834785	DI	On-Demand	Anodyne	HTR1F	22	40
O=C(Nc1ccc(F)cc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834785	DI	On-Demand	Anodyne	CCR3	52	38
O=C(Nc1ccc(F)cc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834785	DI	On-Demand	Anodyne	EPHX2	19	40
O=C(Nc1ccc(F)cc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834787	DI	On-Demand	Anodyne	HTR1F	22	40
O=C(Nc1ccc(F)cc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834787	DI	On-Demand	Anodyne	CCR3	52	38
O=C(Nc1ccc(F)cc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834787	DI	On-Demand	Anodyne	EPHX2	19	40
CCC(CC)(CNC(=O)N[C@@H](c1ccccc1)[C@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834788	GG	On-Demand	Anodyne	CTSK	15	43
CCC(CC)(CNC(=O)N[C@@H](c1ccccc1)[C@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834788	GG	On-Demand	Anodyne	FPR1	48	36
COc1ncccc1NC(=O)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834789	EG	On-Demand	Anodyne	P2RY1	57	43
CCC(CC)(CNC(=O)N[C@@H](c1ccccc1)[C@@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834790	GG	On-Demand	Anodyne	CTSK	15	43
CCC(CC)(CNC(=O)N[C@@H](c1ccccc1)[C@@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834790	GG	On-Demand	Anodyne	FPR1	48	36
COc1ncccc1NC(=O)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834791	EG	On-Demand	Anodyne	P2RY1	57	43
CCC(CC)(CNC(=O)N[C@H](c1ccccc1)[C@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834792	GG	On-Demand	Anodyne	CTSK	15	43
CCC(CC)(CNC(=O)N[C@H](c1ccccc1)[C@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834792	GG	On-Demand	Anodyne	FPR1	48	36
CCC(CC)(CNC(=O)N[C@H](c1ccccc1)[C@@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834794	GG	On-Demand	Anodyne	CTSK	15	43
CCC(CC)(CNC(=O)N[C@H](c1ccccc1)[C@@H](C)O)NC(=O)OC(C)(C)C	ZINC000853834794	GG	On-Demand	Anodyne	FPR1	48	36
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834819	CI	On-Demand	Anodyne	KCNA5	17	43
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834819	CI	On-Demand	Anodyne	EPHX2	25	48
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834819	CI	On-Demand	Anodyne	DGAT1	16	42
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834819	CI	On-Demand	Anodyne	MTCA1	18	44
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853834819	CI	On-Demand	Anodyne	P96878_MYCTU	21	44
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834821	CI	On-Demand	Anodyne	KCNA5	17	43
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834821	CI	On-Demand	Anodyne	EPHX2	25	48
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834821	CI	On-Demand	Anodyne	DGAT1	16	42
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834821	CI	On-Demand	Anodyne	MTCA1	18	44
O=C(Nc1ccccc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853834821	CI	On-Demand	Anodyne	P96878_MYCTU	21	44
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853834823	GH	On-Demand	Anodyne	CCR5	25	40
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853834823	GH	On-Demand	Anodyne	EPHX2	29	42
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853834823	GH	On-Demand	Anodyne	L3MBTL3	93	41
COC(=O)c1cccc(NNC(=O)NC[C@H](c2cccnc2)C(C)C)c1C	ZINC000853834829	FG	On-Demand	Reactive	KCNA5	21	41
COC(=O)c1cccc(NNC(=O)NC[C@@H](c2cccnc2)C(C)C)c1C	ZINC000853834831	FG	On-Demand	Reactive	KCNA5	21	41
O=C(NC1CCC(N2CCCCC2)CC1)N1CCn2c(O)nnc2C1	ZINC000853834836	ED	On-Demand	Anodyne	L3MBTL3	42	35
COC(=O)N(C)CCNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000853834838	GC	On-Demand	Anodyne	CACNA1H	18	41
COC(=O)N(C)CCNC(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1	ZINC000853834838	GC	On-Demand	Anodyne	CACNA1I	51	50
CC(=O)c1ccc(N2C[C@@H](C)C(O)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000853834844	CE	On-Demand	Bother	TAAR1	18	44
CC(=O)c1ccc(N2C[C@H](C)[C@@H](O)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000853834846	CE	On-Demand	Bother	TAAR1	18	44
CC(=O)c1ccc(N2C[C@H](C)C(O)[C@@H](C)C2)c([N+](=O)[O-])c1	ZINC000853834848	CE	On-Demand	Bother	TAAR1	18	44
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853834902	EH	On-Demand	Anodyne	TRPM8	31	41
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853834902	EH	On-Demand	Anodyne	DGAT1	40	42
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853834902	EH	On-Demand	Anodyne	SLC27A1	55	39
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853834903	EH	On-Demand	Anodyne	TRPM8	31	41
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853834903	EH	On-Demand	Anodyne	DGAT1	40	42
O=C(Nc1ccc(N2CCCC2)nc1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853834903	EH	On-Demand	Anodyne	SLC27A1	55	39
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853834915	GE	On-Demand	Anodyne	EPHX2	26	40
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H](c3ccccc3)[C@H](CO)C2)C1	ZINC000853834915	GE	On-Demand	Anodyne	GPR119	36	40
C[C@@H](CNC(=O)NC1CN(C(=O)OC(C)(C)C)C1)c1ccccn1	ZINC000853834934	EE	On-Demand	Anodyne	GPR119	29	42
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853834935	FF	On-Demand	Anodyne	STAT6	58	35
O=C(Nc1ccc(N2CCOCC2)cn1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853834970	FG	On-Demand	Anodyne	STAT6	60	39
O=C(Nc1ccc(N2CCOCC2)cn1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853834971	FG	On-Demand	Anodyne	STAT6	60	39
Cc1cccc(NC(=O)N2CC[C@H]2c2ccc(F)cc2)n1	ZINC000853834974	CH	On-Demand	Anodyne	GRM5	21	47
Cc1cccc(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)n1	ZINC000853834975	CH	On-Demand	Anodyne	GRM5	21	47
Cc1cccc(NC(=O)N2CCCC[C@@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)c1	ZINC000853835039	GI	On-Demand	Anodyne	EPHX2	17	41
Cc1cccc(NC(=O)N2CCCC[C@@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c1	ZINC000853835041	GI	On-Demand	Anodyne	EPHX2	17	41
Cc1cccc(NC(=O)N2CCCC[C@H]2[C@H]2CCCN(C(=O)C(F)(F)F)C2)c1	ZINC000853835043	GI	On-Demand	Anodyne	EPHX2	17	41
Cc1cccc(NC(=O)N2CCCC[C@H]2[C@@H]2CCCN(C(=O)C(F)(F)F)C2)c1	ZINC000853835046	GI	On-Demand	Anodyne	EPHX2	17	41
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](O)C(F)(F)C1	ZINC000853835059	EE	On-Demand	Anodyne	L3MBTL3	64	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853835061	EE	On-Demand	Anodyne	L3MBTL3	64	38
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3C[C@@H]3C2)C1	ZINC000853835071	CD	On-Demand	Anodyne	GPR119	29	44
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853835072	FG	On-Demand	Anodyne	KCNQ2	76	45
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@@H]3C[C@H]3C2)C1	ZINC000853835074	CD	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3C[C@H]3C2)C1	ZINC000853835077	CD	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CC(NC(=O)N2CC[C@H]3C[C@@H]3C2)C1	ZINC000853835080	CD	On-Demand	Anodyne	GPR119	29	44
COC(=O)c1cc(NC(=O)N2CC[C@H]2c2ccc(F)cc2)cc(C(=O)OC)c1	ZINC000853835089	GG	On-Demand	Anodyne	CACNA1H	21	40
COC(=O)c1cc(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)cc(C(=O)OC)c1	ZINC000853835092	GG	On-Demand	Anodyne	CACNA1H	21	40
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCc2ncccn2)CC1	ZINC000853835121	FC	On-Demand	Anodyne	CACNA1H	18	41
CC(C)(C)NC(=O)CN1CCC(CNC(=O)NCc2ncccn2)CC1	ZINC000853835121	FC	On-Demand	Anodyne	CACNA1I	79	55
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA2	91	50
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA1	82	47
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA7	49	46
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA5B	26	40
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA4	70	45
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA5A	29	40
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA14	42	42
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA12	64	50
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CA9	69	50
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	CYNT	40	42
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	MTCA1	55	46
CN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CC(C)(C)CC(C)(C)C1	ZINC000853835129	FG	On-Demand	Anodyne	P96878_MYCTU	68	46
Cc1cccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c1C	ZINC000853835149	DJ	On-Demand	Anodyne	TRPV1	15	40
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853835151	GF	On-Demand	Anodyne	NPY1R	31	42
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853835151	GF	On-Demand	Anodyne	CCR3	36	40
Cc1cccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c1C	ZINC000853835152	DJ	On-Demand	Anodyne	TRPV1	15	40
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853835153	GF	On-Demand	Anodyne	NPY1R	31	42
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853835153	GF	On-Demand	Anodyne	CCR3	36	40
C[C@H]1c2ccccc2C[C@H]1NC(=O)Nc1cccc(N2C(=O)CNC2=O)c1	ZINC000853835155	FF	On-Demand	Anodyne	CCKBR	52	36
O=C(NCCc1ccc(F)cc1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853835171	EH	On-Demand	Anodyne	CCR3	78	39
O=C(NCCc1ccc(F)cc1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853835172	EH	On-Demand	Anodyne	CCR3	78	39
CON(C)CCNC(=O)NCC1CCN(CCC(C)C)CC1	ZINC000853835190	DD	On-Demand	Anodyne	CACNA1I	58	38
O=C(NC1CCC(N2CCCCC2)CC1)N1CCC(n2cnnc2O)CC1	ZINC000853835199	GE	On-Demand	Anodyne	L3MBTL3	94	42
COC[C@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1cccc(OC)c1	ZINC000853835206	GG	On-Demand	Anodyne	HRH2	16	41
COC[C@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1cccc(OC)c1	ZINC000853835206	GG	On-Demand	Anodyne	HRH3	21	40
COC[C@@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1cccc(OC)c1	ZINC000853835207	GG	On-Demand	Anodyne	HRH2	16	41
COC[C@@H](NC(=O)NC1CCC(N2CCCCC2)CC1)c1cccc(OC)c1	ZINC000853835207	GG	On-Demand	Anodyne	HRH3	21	40
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853835234	FG	On-Demand	Anodyne	CA1	24	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853835234	FG	On-Demand	Anodyne	KCNA5	19	44
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853835234	FG	On-Demand	Anodyne	CA12	26	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853835234	FG	On-Demand	Anodyne	CA9	20	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853835234	FG	On-Demand	Anodyne	MTCA1	45	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)cc1	ZINC000853835234	FG	On-Demand	Anodyne	P96878_MYCTU	56	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853835235	FG	On-Demand	Anodyne	CA1	24	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853835235	FG	On-Demand	Anodyne	KCNA5	19	44
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853835235	FG	On-Demand	Anodyne	CA12	26	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853835235	FG	On-Demand	Anodyne	CA9	20	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853835235	FG	On-Demand	Anodyne	MTCA1	45	51
CS(=O)(=O)c1ccc(NC(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)cc1	ZINC000853835235	FG	On-Demand	Anodyne	P96878_MYCTU	56	51
Cc1nc(NC(=O)N[C@H]2CCCC[C@@H]2C#N)sc1-c1ccccc1	ZINC000853835236	EI	On-Demand	Mild	PIK3CG	20	40
Cc1nc(NC(=O)N[C@H]2CCCC[C@H]2C#N)sc1-c1ccccc1	ZINC000853835237	EI	On-Demand	Mild	PIK3CG	20	40
Cc1nc(NC(=O)N[C@@H]2CCCC[C@@H]2C#N)sc1-c1ccccc1	ZINC000853835238	EI	On-Demand	Mild	PIK3CG	20	40
Cc1nc(NC(=O)N[C@@H]2CCCC[C@H]2C#N)sc1-c1ccccc1	ZINC000853835239	EI	On-Demand	Mild	PIK3CG	20	40
O=C(Nc1cccc(F)c1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853835269	DI	On-Demand	Anodyne	CCR3	42	40
O=C(Nc1cccc(F)c1)Nc1ccc2c(c1)[C@@H](O)CCCC2	ZINC000853835269	DI	On-Demand	Anodyne	EPHX2	19	42
O=C(Nc1cccc(F)c1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853835270	DI	On-Demand	Anodyne	CCR3	42	40
O=C(Nc1cccc(F)c1)Nc1ccc2c(c1)[C@H](O)CCCC2	ZINC000853835270	DI	On-Demand	Anodyne	EPHX2	19	42
C[C@H]1CN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)C[C@H](C)C1O	ZINC000853835302	FF	On-Demand	Anodyne	HSD11B1	17	40
C[C@H]1CN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)C[C@@H](C)[C@@H]1O	ZINC000853835304	FF	On-Demand	Anodyne	HSD11B1	17	40
COC(=O)c1cccc(NNC(=O)NC2CCC(N3CCCCC3)CC2)c1C	ZINC000853835309	GG	On-Demand	Reactive	L3MBTL3	52	37
C=CC[C@@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853835326	EH	On-Demand	Mild	L3MBTL3	47	36
C=CC[C@H]1CCCN(C(=O)NC2CCC(N3CCCCC3)CC2)C1	ZINC000853835327	EH	On-Demand	Mild	L3MBTL3	47	36
CN1CCN(c2ccccc2NC(=O)N2C[C@@]3(C)COC[C@@]3(C)C2)CC1	ZINC000853835328	FE	On-Demand	Anodyne	HTR1B	16	43
CN1CCN(c2ccccc2NC(=O)N2C[C@@]3(C)COC[C@@]3(C)C2)CC1	ZINC000853835328	FE	On-Demand	Anodyne	KCNQ2	74	39
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@H](Cn2ccnn2)C1	ZINC000853835339	FE	On-Demand	Anodyne	L3MBTL3	67	37
O=C(NC1CCC(N2CCCCC2)CC1)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853835340	FE	On-Demand	Anodyne	L3MBTL3	67	37
O=C(NCc1cccc(OC2CC2)c1F)Nc1cccnc1Cl	ZINC000853835393	EH	On-Demand	Anodyne	P2RX7	40	37
O=C(NCc1cccc(OC2CC2)c1F)Nc1cccnc1Cl	ZINC000853835393	EH	On-Demand	Anodyne	SCD	18	40
O=C(NCc1cccc(OC2CC2)c1F)Nc1cccnc1Cl	ZINC000853835393	EH	On-Demand	Anodyne	G2YM83_BOTF4	71	35
O=C(NCCO[C@H]1CC1(F)F)Nc1ccc(-c2ccccc2)cc1	ZINC000853835396	EH	On-Demand	Anodyne	CA1	21	40
O=C(NCCO[C@H]1CC1(F)F)Nc1ccc(-c2ccccc2)cc1	ZINC000853835396	EH	On-Demand	Anodyne	ROCK2	15	44
O=C(NCCO[C@H]1CC1(F)F)Nc1ccc(-c2ccccc2)cc1	ZINC000853835396	EH	On-Demand	Anodyne	EPHX2	32	40
O=C(NCCO[C@@H]1CC1(F)F)Nc1ccc(-c2ccccc2)cc1	ZINC000853835397	EH	On-Demand	Anodyne	CA1	21	40
O=C(NCCO[C@@H]1CC1(F)F)Nc1ccc(-c2ccccc2)cc1	ZINC000853835397	EH	On-Demand	Anodyne	ROCK2	15	44
O=C(NCCO[C@@H]1CC1(F)F)Nc1ccc(-c2ccccc2)cc1	ZINC000853835397	EH	On-Demand	Anodyne	EPHX2	32	40
C[C@H]1CN(c2ccc(NC(=O)NCCO[C@@H]3CC3(F)F)cc2F)C[C@@H](C)O1	ZINC000853835398	GF	On-Demand	Anodyne	NPY2R	54	35
C[C@H]1CN(c2ccc(NC(=O)NCCO[C@H]3CC3(F)F)cc2F)C[C@@H](C)O1	ZINC000853835400	GF	On-Demand	Anodyne	NPY2R	54	35
CO[C@@H](C)CNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853835520	EF	On-Demand	Anodyne	NPY2R	73	38
CO[C@@H](C)CNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853835521	EF	On-Demand	Anodyne	NPY2R	73	38
O=C(NCc1cccc(OC2CC2)c1F)C(F)(F)C(=O)N1CCOCC1	ZINC000853835525	FD	On-Demand	Anodyne	ITGAL	40	30
O=C(NCc1cccc(OC2CC2)c1F)C(F)(F)C(=O)N1CCOCC1	ZINC000853835525	FD	On-Demand	Anodyne	EPHX2	20	40
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	HTR1A	53	39
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	DRD2	42	40
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	ADRA1D	40	40
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	ADRA1A	35	40
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	ADRA1B	31	40
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	DRD3	43	36
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	HTR7	45	39
CN1CCN(c2ccccc2NC(=O)NCc2cccc(OC3CC3)c2F)CC1	ZINC000853835530	GG	On-Demand	Anodyne	KCNQ2	76	41
O=C(NCCO[C@@H]1CC1(F)F)Nc1cccnc1Cl	ZINC000853835554	CE	On-Demand	Anodyne	G2YM83_BOTF4	71	36
O=C(NCCO[C@H]1CC1(F)F)Nc1cccnc1Cl	ZINC000853835555	CE	On-Demand	Anodyne	G2YM83_BOTF4	71	36
CO[C@@H](C)c1nc(CNC(=O)NNc2nc3ccc(Cl)cc3s2)cs1	ZINC000853835594	GH	On-Demand	Reactive	CSNK1D	37	47
O=C(NCc1cccc(OC2CC2)c1F)N1CCCCC1	ZINC000853835619	CG	On-Demand	Anodyne	EPHX2	29	50
O=C(NCc1cccc(OC2CC2)c1F)Nc1ccc(Cl)nc1	ZINC000853835623	EH	On-Demand	Anodyne	P2RX7	41	35
O=C(NCc1cccc(OC2CC2)c1F)Nc1ccc(Cl)nc1	ZINC000853835623	EH	On-Demand	Anodyne	NAMPT	24	42
COCCN(CCF)C(=O)N1CCc2ccccc2C1	ZINC000853835771	CE	On-Demand	Anodyne	NOD2	42	38
CC[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)C(=O)N1CCOCC1	ZINC000853835792	GE	On-Demand	Reactive	CASR	19	47
O=C(NCc1cccc(OC2CC2)c1F)Nc1cccc(N2CCOC2=O)c1	ZINC000853835806	GH	On-Demand	Anodyne	CCR3	40	37
Cc1nc(NC(=O)NCCO[C@@H]2CC2(F)F)sc1-c1ccccc1	ZINC000853835837	FH	On-Demand	Anodyne	PIK3CG	20	45
Cc1nc(NC(=O)NCCO[C@@H]2CC2(F)F)sc1-c1ccccc1	ZINC000853835837	FH	On-Demand	Anodyne	PI4KB	41	42
Cc1nc(NC(=O)NCCO[C@H]2CC2(F)F)sc1-c1ccccc1	ZINC000853835838	FH	On-Demand	Anodyne	PIK3CG	20	45
Cc1nc(NC(=O)NCCO[C@H]2CC2(F)F)sc1-c1ccccc1	ZINC000853835838	FH	On-Demand	Anodyne	PI4KB	41	42
CN1CCN(c2ccccc2NC(=O)NCCO[C@H]2CC2(F)F)CC1	ZINC000853835848	FD	On-Demand	Anodyne	HTR1A	32	41
CN1CCN(c2ccccc2NC(=O)NCCO[C@H]2CC2(F)F)CC1	ZINC000853835848	FD	On-Demand	Anodyne	DRD2	29	40
CN1CCN(c2ccccc2NC(=O)NCCO[C@H]2CC2(F)F)CC1	ZINC000853835848	FD	On-Demand	Anodyne	DRD3	44	35
CN1CCN(c2ccccc2NC(=O)NCCO[C@H]2CC2(F)F)CC1	ZINC000853835848	FD	On-Demand	Anodyne	KCNQ2	75	38
CN1CCN(c2ccccc2NC(=O)NCCO[C@@H]2CC2(F)F)CC1	ZINC000853835849	FD	On-Demand	Anodyne	HTR1A	32	41
CN1CCN(c2ccccc2NC(=O)NCCO[C@@H]2CC2(F)F)CC1	ZINC000853835849	FD	On-Demand	Anodyne	DRD2	29	40
CN1CCN(c2ccccc2NC(=O)NCCO[C@@H]2CC2(F)F)CC1	ZINC000853835849	FD	On-Demand	Anodyne	DRD3	44	35
CN1CCN(c2ccccc2NC(=O)NCCO[C@@H]2CC2(F)F)CC1	ZINC000853835849	FD	On-Demand	Anodyne	KCNQ2	75	38
Cc1cccc(C(NC(=O)N2CC[C@H](N3CCOC3=O)C2)c2cccc(C)c2)c1	ZINC000853835859	GH	On-Demand	Anodyne	BIRC8	46	35
O=C(NCCO[C@H]1CC1(F)F)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853835909	FE	On-Demand	Bother	CACNA1C	46	43
O=C(NCCO[C@H]1CC1(F)F)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853835909	FE	On-Demand	Bother	CACNA1D	72	35
O=C(NCCO[C@@H]1CC1(F)F)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853835910	FE	On-Demand	Bother	CACNA1C	46	43
O=C(NCCO[C@@H]1CC1(F)F)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853835910	FE	On-Demand	Bother	CACNA1D	72	35
CN(C)C(=O)OCCNC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000853835960	CD	On-Demand	Bother	NMBR	54	32
CN(C)C(=O)OCCNC(=O)Nc1cccnc1N1CCCC1	ZINC000853835967	DD	On-Demand	Anodyne	KCNQ2	53	32
COC(=O)/C=C\c1ccc(N(C)CC2=CCCOC2)c([N+](=O)[O-])c1	ZINC000853835981	EF	On-Demand	Clean	NR1H4	42	34
CN(C)C(=O)OCCNC(=O)Nc1ccccc1OC(F)(F)F	ZINC000853835986	EE	On-Demand	Anodyne	P2RY1	50	37
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA2	155	56
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA1	146	53
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA7	64	46
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA5B	52	43
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA4	114	53
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA5A	55	43
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA14	59	49
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA12	114	53
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CA9	125	53
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	CYNT	49	42
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	NCE103	50	56
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	MTCA1	65	53
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853835988	EC	On-Demand	Anodyne	P96878_MYCTU	82	53
CN(C)C(=O)OCCNC(=O)Nc1ccc(-c2ncon2)cc1	ZINC000853836016	DD	On-Demand	Anodyne	MTOR	46	35
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)cc1	ZINC000853836019	CD	On-Demand	Anodyne	CA12	17	43
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)cc1	ZINC000853836019	CD	On-Demand	Anodyne	CA9	15	43
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)cc1	ZINC000853836019	CD	On-Demand	Anodyne	MTCA1	17	42
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)cc1	ZINC000853836019	CD	On-Demand	Anodyne	P96878_MYCTU	24	42
CN(C)C(=O)OCCNC(=O)Nc1nc2ccccc2s1	ZINC000853836020	DE	On-Demand	Anodyne	LCK	23	45
CN(C)C(=O)OCCNC(=O)Nc1nc2ccccc2s1	ZINC000853836020	DE	On-Demand	Anodyne	CSNK1D	42	48
CN(C)C(=O)OCCNC(=O)Nc1nc2ccccc2s1	ZINC000853836020	DE	On-Demand	Anodyne	TMPRSS6	54	33
COc1ncccc1NC(=O)NCCOC(=O)N(C)C	ZINC000853836022	CC	On-Demand	Anodyne	P2RY1	43	39
NC(=O)c1ccc(CNC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cn1	ZINC000853836029	GD	On-Demand	Clean	STAT6	66	35
CN(C)C(=O)OCCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853836042	FD	On-Demand	Anodyne	CCR3	45	40
O=C(Nc1ccc2c(c1)C(=O)NC2=O)N[C@@H]1COC2(CCC2)C1	ZINC000853836071	DD	On-Demand	Anodyne	CASP2	16	40
O=C(Nc1ccc2c(c1)C(=O)NC2=O)N[C@H]1COC2(CCC2)C1	ZINC000853836073	DD	On-Demand	Anodyne	CASP2	16	40
O=C(Nc1ccc(N2CCCC2)nc1)N[C@@H]1COC2(CCC2)C1	ZINC000853836076	DF	On-Demand	Anodyne	DGAT1	35	41
O=C(Nc1ccc(N2CCCC2)nc1)N[C@H]1COC2(CCC2)C1	ZINC000853836078	DF	On-Demand	Anodyne	DGAT1	35	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(C(N)=O)nc1	ZINC000853836093	GD	On-Demand	Anodyne	GPR119	34	44
Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836122	CF	On-Demand	Anodyne	CCKAR	28	44
Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836122	CF	On-Demand	Anodyne	CCKBR	43	44
Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836122	CF	On-Demand	Anodyne	EPHX2	26	50
Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836122	CF	On-Demand	Anodyne	KCNK3	54	38
Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836122	CF	On-Demand	Anodyne	KCNK9	42	38
O=[N+]([O-])c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836127	EI	On-Demand	Bother	RBP4	45	31
O=[N+]([O-])c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836128	EI	On-Demand	Bother	RBP4	45	31
O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836129	EI	On-Demand	Bother	RBP4	45	31
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836130	EI	On-Demand	Bother	RBP4	45	31
Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836131	CF	On-Demand	Anodyne	CCKAR	28	44
Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836131	CF	On-Demand	Anodyne	CCKBR	43	44
Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836131	CF	On-Demand	Anodyne	EPHX2	26	50
Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836131	CF	On-Demand	Anodyne	KCNK3	54	38
Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836131	CF	On-Demand	Anodyne	KCNK9	42	38
Cc1noc(C)c1CCCNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853836162	FG	On-Demand	Anodyne	EPHX2	15	40
COC[C@@H](NC(=O)NCCCc1c(C)noc1C)c1cccc(OC)c1	ZINC000853836209	FF	On-Demand	Anodyne	MTNR1A	40	41
COC[C@@H](NC(=O)NCCCc1c(C)noc1C)c1cccc(OC)c1	ZINC000853836209	FF	On-Demand	Anodyne	MTNR1B	38	41
COC[C@H](NC(=O)NCCCc1c(C)noc1C)c1cccc(OC)c1	ZINC000853836212	FF	On-Demand	Anodyne	MTNR1A	40	41
COC[C@H](NC(=O)NCCCc1c(C)noc1C)c1cccc(OC)c1	ZINC000853836212	FF	On-Demand	Anodyne	MTNR1B	38	41
COc1ccc([C@@H]2CCCN2c2ccc(C(C)=O)cc2[N+](=O)[O-])cc1F	ZINC000853836215	FI	On-Demand	Bother	TAAR1	18	41
O=C(NNc1cc(F)cc(Cl)c1)Nc1ccc(N2CCOCC2)cn1	ZINC000853836217	FF	On-Demand	Reactive	MAPK10	40	36
O=C(NNc1cc(F)cc(Cl)c1)Nc1ccc(N2CCOCC2)cn1	ZINC000853836217	FF	On-Demand	Reactive	STAT6	69	39
COc1ccc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2C#N)cc1F	ZINC000853836220	EH	On-Demand	Mild	WDR5	24	40
COC(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836248	DE	On-Demand	Anodyne	CCKBR	17	40
COC(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836248	DE	On-Demand	Anodyne	EPHX2	34	54
COC(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836248	DE	On-Demand	Anodyne	HIF1A	15	42
COC(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836251	DE	On-Demand	Anodyne	CCKBR	17	40
COC(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836251	DE	On-Demand	Anodyne	EPHX2	34	54
COC(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836251	DE	On-Demand	Anodyne	HIF1A	15	42
O[C@H]1C[C@@H](Nc2nc3ccccc3nc2N2CCOCC2)c2ccccc21	ZINC000853836264	FG	On-Demand	Anodyne	PIK3CA	22	42
O[C@H]1C[C@H](Nc2nc3ccccc3nc2N2CCOCC2)c2ccccc21	ZINC000853836268	FG	On-Demand	Anodyne	PIK3CA	22	42
O[C@@H]1C[C@H](Nc2nc3ccccc3nc2N2CCOCC2)c2ccccc21	ZINC000853836271	FG	On-Demand	Anodyne	PIK3CA	22	42
O[C@@H]1C[C@@H](Nc2nc3ccccc3nc2N2CCOCC2)c2ccccc21	ZINC000853836275	FG	On-Demand	Anodyne	PIK3CA	22	42
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853836276	FD	On-Demand	Anodyne	HTR1B	15	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853836276	FD	On-Demand	Anodyne	KCNQ2	68	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853836276	FD	On-Demand	Anodyne	RBP4	53	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853836278	FD	On-Demand	Anodyne	HTR1B	15	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853836278	FD	On-Demand	Anodyne	KCNQ2	68	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853836278	FD	On-Demand	Anodyne	RBP4	53	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853836280	FD	On-Demand	Anodyne	HTR1B	15	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853836280	FD	On-Demand	Anodyne	KCNQ2	68	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)CC1	ZINC000853836280	FD	On-Demand	Anodyne	RBP4	53	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853836283	FD	On-Demand	Anodyne	HTR1B	15	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853836283	FD	On-Demand	Anodyne	KCNQ2	68	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)CC1	ZINC000853836283	FD	On-Demand	Anodyne	RBP4	53	34
COC(=O)c1sc(N2CC[C@H](N(C)CCc3ccccc3)C2)nc1Cl	ZINC000853836343	GG	On-Demand	Anodyne	PARE	98	36
COC(=O)c1sc(N2CC[C@@H](N(C)CCc3ccccc3)C2)nc1Cl	ZINC000853836344	GG	On-Demand	Anodyne	PARE	98	36
Cc1nc(NC(=O)NCCOC(=O)N(C)C)sc1-c1ccccc1	ZINC000853836359	EF	On-Demand	Anodyne	PIK3CG	21	48
Cc1nc(NC(=O)NCCOC(=O)N(C)C)sc1-c1ccccc1	ZINC000853836359	EF	On-Demand	Anodyne	PI4KB	41	44
CN(C)C(=O)OCCNC(=O)Nc1ccccc1	ZINC000853836366	CD	On-Demand	Anodyne	LPL	27	40
CN(C)C(=O)OCCNC(=O)Nc1ccccc1	ZINC000853836366	CD	On-Demand	Anodyne	CA1	51	43
CN(C)C(=O)OCCNC(=O)Nc1ccccc1	ZINC000853836366	CD	On-Demand	Anodyne	CA12	19	43
CN(C)C(=O)OCCNC(=O)Nc1ccccc1	ZINC000853836366	CD	On-Demand	Anodyne	CA9	21	43
CN(C)C(=O)OCCNC(=O)Nc1ccccc1	ZINC000853836366	CD	On-Demand	Anodyne	NCE103	18	43
CN(C)C(=O)OCCNC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853836367	DD	On-Demand	Anodyne	KCNK3	85	38
CN(C)C(=O)OCCNC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853836367	DD	On-Demand	Anodyne	KCNK9	52	34
CN(C)C(=O)OCCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853836378	EF	On-Demand	Anodyne	PI4KB	16	41
CN(C)C(=O)OCCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853836378	EF	On-Demand	Anodyne	CDK5	21	40
C[C@H]1CN(c2ccc(NC(=O)NCCOC(=O)N(C)C)cc2F)C[C@@H](C)O1	ZINC000853836382	GE	On-Demand	Anodyne	NPY2R	65	35
C[C@H]1CN(c2ccc(NC(=O)NCCOC(=O)N(C)C)cc2F)C[C@H](C)O1	ZINC000853836384	GE	On-Demand	Anodyne	NPY2R	65	35
CN(C)C(=O)OCCNC(=O)Nc1ccc2c(c1)OCCO2	ZINC000853836391	DD	On-Demand	Anodyne	QPCT	17	40
CN(C)C(=O)OCCNC(=O)Nc1cccnc1Cl	ZINC000853836400	CD	On-Demand	Anodyne	G2YM83_BOTF4	68	34
COC(=O)c1cnc(N2CCC[C@@H]2CS(C)(=O)=O)cc1C(F)(F)F	ZINC000853836401	FD	On-Demand	Anodyne	SFRP1	41	31
CN(C)C(=O)OCCNC(=O)Nc1cccc(Cl)c1	ZINC000853836415	CE	On-Demand	Anodyne	MCHR1	15	50
CN(C)C(=O)OCCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853836422	DC	On-Demand	Anodyne	CASP2	18	42
CN(C)C(=O)OCCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853836422	DC	On-Demand	Anodyne	CASP6	15	42
Cc1nc(O)cc(-c2ccc(NC(=O)NCCOC(=O)N(C)C)cc2)n1	ZINC000853836425	FD	On-Demand	Anodyne	SMG1	44	33
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	CA2	33	44
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	CA1	53	39
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	CA4	20	42
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	CA12	47	42
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	CA9	47	42
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	NCE103	24	44
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	MTCA1	46	42
CN(C)C(=O)OCCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853836432	EC	On-Demand	Anodyne	P96878_MYCTU	57	42
CN(C)C(=O)OCCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853836439	CD	On-Demand	Bother	CACNA1C	55	39
CN(C)C(=O)OCCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853836439	CD	On-Demand	Bother	CACNA1D	89	39
Cc1cccc(NC(=O)NCCOC(=O)N(C)C)n1	ZINC000853836451	CD	On-Demand	Anodyne	GRM5	20	45
Cc1cc(NC(=O)NCCOC(=O)N(C)C)n(-c2cccc(C(F)(F)F)c2)n1	ZINC000853836453	GG	On-Demand	Anodyne	MAPK14	17	45
Cc1cc(NC(=O)NCCOC(=O)N(C)C)n(-c2cccc(C(F)(F)F)c2)n1	ZINC000853836453	GG	On-Demand	Anodyne	CARM1	43	37
Cc1cc(NC(=O)NCCOC(=O)N(C)C)n(-c2cccc(C(F)(F)F)c2)n1	ZINC000853836453	GG	On-Demand	Anodyne	PDS	42	35
O=C(Nc1cccc2ccccc12)N[C@@H]1COC2(CCC2)C1	ZINC000853836473	CH	On-Demand	Anodyne	TRPV1	30	41
O=C(Nc1cccc2ccccc12)N[C@H]1COC2(CCC2)C1	ZINC000853836474	CH	On-Demand	Anodyne	TRPV1	30	41
C#CCNC(=O)c1ccc(N2CCC[C@H]2c2ccc(OC)c(F)c2)nc1	ZINC000853836477	FF	On-Demand	Mild	ACKR3	58	33
C#CCNC(=O)c1ccc(N2CCC[C@@H]2c2ccc(OC)c(F)c2)nc1	ZINC000853836478	FF	On-Demand	Mild	ACKR3	58	33
O=C(Nc1ccc(F)c(F)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853836479	CF	On-Demand	Anodyne	EPHX2	37	40
O=C(Nc1ccc(F)c(F)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853836479	CF	On-Demand	Anodyne	ENV	45	40
O=C(Nc1ccc(F)c(F)c1)N[C@H]1COC2(CCC2)C1	ZINC000853836480	CF	On-Demand	Anodyne	EPHX2	37	40
O=C(Nc1ccc(F)c(F)c1)N[C@H]1COC2(CCC2)C1	ZINC000853836480	CF	On-Demand	Anodyne	ENV	45	40
O=C(NNc1ccc([N+](=O)[O-])cc1F)Nc1nc2c(s1)CCCC2	ZINC000853836643	FG	On-Demand	Reactive	SLC27A1	31	40
NS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836667	FF	On-Demand	Anodyne	RBP4	56	31
NS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836669	FF	On-Demand	Anodyne	RBP4	56	31
NS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836674	FF	On-Demand	Anodyne	RBP4	56	31
NS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853836675	FF	On-Demand	Anodyne	RBP4	56	31
O=C(NC1CC1)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1	ZINC000853836698	DF	On-Demand	Anodyne	SSTR5	22	41
O=C(NC1CC1)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1	ZINC000853836698	DF	On-Demand	Anodyne	HPGDS	34	40
O=C(NC1CC1)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1	ZINC000853836699	DF	On-Demand	Anodyne	SSTR5	22	41
O=C(NC1CC1)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1	ZINC000853836699	DF	On-Demand	Anodyne	HPGDS	34	40
O=C(NC1CC1)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1	ZINC000853836700	DF	On-Demand	Anodyne	SSTR5	22	41
O=C(NC1CC1)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1	ZINC000853836700	DF	On-Demand	Anodyne	HPGDS	34	40
O=C(NC1CC1)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1	ZINC000853836701	DF	On-Demand	Anodyne	SSTR5	22	41
O=C(NC1CC1)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1	ZINC000853836701	DF	On-Demand	Anodyne	HPGDS	34	40
CN(C)C(=O)OCCNC(=O)Nc1nccs1	ZINC000853836782	CC	On-Demand	Anodyne	MAP1	124	40
CN(C)C(=O)OCCNC(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853836790	EF	On-Demand	Anodyne	CDK5	20	46
CN(C)C(=O)OCCNC(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853836791	FF	On-Demand	Anodyne	SCD1	38	41
CN(C)C(=O)OCCNC(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853836791	FF	On-Demand	Anodyne	SCD	32	41
CN1CCN(c2ccccc2NC(=O)NCCOC(=O)N(C)C)CC1	ZINC000853836801	ED	On-Demand	Anodyne	ADRA1D	25	41
CN1CCN(c2ccccc2NC(=O)NCCOC(=O)N(C)C)CC1	ZINC000853836801	ED	On-Demand	Anodyne	ADRA1A	20	41
CN1CCN(c2ccccc2NC(=O)NCCOC(=O)N(C)C)CC1	ZINC000853836801	ED	On-Demand	Anodyne	DRD3	42	35
CN1CCN(c2ccccc2NC(=O)NCCOC(=O)N(C)C)CC1	ZINC000853836801	ED	On-Demand	Anodyne	KCNQ2	76	39
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)cn1	ZINC000853836806	CD	On-Demand	Anodyne	KLKB1	19	40
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)cn1	ZINC000853836806	CD	On-Demand	Anodyne	F10	53	38
COC(=O)c1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853836809	DD	On-Demand	Anodyne	ROCK2	19	41
COC(=O)c1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853836809	DD	On-Demand	Anodyne	KCNK3	58	35
CN(C)C(=O)OCCNC(=O)Nc1cccc(C(N)=O)c1	ZINC000853836812	CC	On-Demand	Anodyne	PPIA	15	41
CN(C)C(=O)OCCNC(=O)Nc1cccc(C(N)=O)c1	ZINC000853836812	CC	On-Demand	Anodyne	CA1	19	41
CN(C)C(=O)OCCNC(=O)Nc1cccc(C(N)=O)c1	ZINC000853836812	CC	On-Demand	Anodyne	KCNK3	84	36
CN(C)C(=O)OCCNC(=O)Nc1cccc(C(N)=O)c1	ZINC000853836812	CC	On-Demand	Anodyne	KCNK9	52	34
CN(C)C(=O)OCCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853836815	FF	On-Demand	Anodyne	SCD1	40	43
CN(C)C(=O)OCCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853836815	FF	On-Demand	Anodyne	SCD	37	43
C[C@H]1CN(c2ccc(NC(=O)N(C)CC3CN(C)C3)cc2F)C[C@H](C)O1	ZINC000853836820	FE	On-Demand	Anodyne	NPY2R	64	36
C[C@H]1CN(c2ccc(NC(=O)N(C)CC3CN(C)C3)cc2F)C[C@@H](C)O1	ZINC000853836821	FE	On-Demand	Anodyne	NPY2R	64	36
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853836823	DE	On-Demand	Anodyne	SLC1A1	19	41
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853836823	DE	On-Demand	Anodyne	SLC1A2	21	41
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853836823	DE	On-Demand	Anodyne	ERBB4	41	36
CN(C)C(=O)OCCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853836823	DE	On-Demand	Anodyne	MCHR1	20	42
CN(C)C(=O)OCCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853836824	GG	On-Demand	Anodyne	SCD1	41	53
CN(C)C(=O)OCCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853836824	GG	On-Demand	Anodyne	SCD	35	53
CN(C)C(=O)OCCNC(=O)Nc1cnc(-c2ccccc2)nc1	ZINC000853836830	ED	On-Demand	Anodyne	ADRB1	43	33
CC(=O)Nc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853836848	DD	On-Demand	Anodyne	KCNK3	62	35
CC(=O)Nc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853836848	DD	On-Demand	Anodyne	KCNK9	56	34
CC(C)c1ccccc1NC(=O)NCCOC(=O)N(C)C	ZINC000853836850	CF	On-Demand	Anodyne	SOAT1	55	36
Cc1noc(C)c1CCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853836863	GH	On-Demand	Reactive	CSNK1D	31	41
O=C1CC[C@@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@H]2N1	ZINC000853836873	DD	On-Demand	Anodyne	RBP4	53	34
O=C1CC[C@@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@H]2N1	ZINC000853836873	DD	On-Demand	Anodyne	G2YM83_BOTF4	60	36
O=C1CC[C@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@@H]2N1	ZINC000853836874	DD	On-Demand	Anodyne	RBP4	53	34
O=C1CC[C@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@@H]2N1	ZINC000853836874	DD	On-Demand	Anodyne	G2YM83_BOTF4	60	36
O=C1CC[C@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@H]2N1	ZINC000853836875	DD	On-Demand	Anodyne	RBP4	53	34
O=C1CC[C@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@H]2N1	ZINC000853836875	DD	On-Demand	Anodyne	G2YM83_BOTF4	60	36
O=C1CC[C@@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@@H]2N1	ZINC000853836876	DD	On-Demand	Anodyne	RBP4	53	34
O=C1CC[C@@H]2CN(C(=O)Nc3cccnc3Cl)CC[C@@H]2N1	ZINC000853836876	DD	On-Demand	Anodyne	G2YM83_BOTF4	60	36
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3COC4(CCC4)C3)cc2F)C[C@@H](C)O1	ZINC000853836885	GG	On-Demand	Anodyne	NPY2R	50	33
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3COC4(CCC4)C3)cc2F)C[C@@H](C)O1	ZINC000853836885	GG	On-Demand	Anodyne	ENV	40	35
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3COC4(CCC4)C3)cc2F)C[C@@H](C)O1	ZINC000853836886	GG	On-Demand	Anodyne	NPY2R	50	33
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3COC4(CCC4)C3)cc2F)C[C@@H](C)O1	ZINC000853836886	GG	On-Demand	Anodyne	ENV	40	35
O=C(Nc1ncc(Cc2ccc(F)cc2)s1)N[C@@H]1COC2(CCC2)C1	ZINC000853836894	FH	On-Demand	Anodyne	CDK5	43	35
O=C(Nc1ncc(Cc2ccc(F)cc2)s1)N[C@H]1COC2(CCC2)C1	ZINC000853836895	FH	On-Demand	Anodyne	CDK5	43	35
O=C1CC[C@H]2CN(C(=O)C(F)(F)c3ccccc3F)CC[C@@H]2N1	ZINC000853836970	EE	On-Demand	Anodyne	RBP4	59	34
O=C1CC[C@H]2CN(C(=O)C(F)(F)c3ccccc3F)CC[C@H]2N1	ZINC000853836973	EE	On-Demand	Anodyne	RBP4	59	34
O=C1CC[C@@H]2CN(C(=O)C(F)(F)c3ccccc3F)CC[C@@H]2N1	ZINC000853836977	EE	On-Demand	Anodyne	RBP4	59	34
O=C1CC[C@@H]2CN(C(=O)C(F)(F)c3ccccc3F)CC[C@H]2N1	ZINC000853836980	EE	On-Demand	Anodyne	RBP4	59	34
Cc1cc(C(F)(F)F)c(N[C@@H]2C[C@@H](O)c3ccccc32)nn1	ZINC000853836981	DG	On-Demand	Anodyne	RBP4	50	36
Cc1cc(C(F)(F)F)c(N[C@@H]2C[C@H](O)c3ccccc32)nn1	ZINC000853836983	DG	On-Demand	Anodyne	RBP4	50	36
Cc1cc(C(F)(F)F)c(N[C@H]2C[C@@H](O)c3ccccc32)nn1	ZINC000853836985	DG	On-Demand	Anodyne	RBP4	50	36
Cc1cc(C(F)(F)F)c(N[C@H]2C[C@H](O)c3ccccc32)nn1	ZINC000853836988	DG	On-Demand	Anodyne	RBP4	50	36
CC(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836991	CF	On-Demand	Anodyne	CCR3	20	42
CC(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836991	CF	On-Demand	Anodyne	EPHX2	33	52
CC(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853836991	CF	On-Demand	Anodyne	KCNK3	48	33
CC(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836995	CF	On-Demand	Anodyne	CCR3	20	42
CC(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836995	CF	On-Demand	Anodyne	EPHX2	33	52
CC(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853836995	CF	On-Demand	Anodyne	KCNK3	48	33
O=C(Nc1ccc(Cl)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853836999	CG	On-Demand	Anodyne	EPHX2	45	45
O=C(Nc1ccc(Cl)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853837002	CG	On-Demand	Anodyne	EPHX2	45	45
CN1CCN(c2nc3ccccc3nc2N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853837062	GF	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853837062	GF	On-Demand	Anodyne	HRH4	23	51
CN1CCN(c2nc3ccccc3nc2N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853837063	GF	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853837063	GF	On-Demand	Anodyne	HRH4	23	51
CN1CCN(c2nc3ccccc3nc2N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853837064	GF	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853837064	GF	On-Demand	Anodyne	HRH4	23	51
CN1CCN(c2nc3ccccc3nc2N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853837065	GF	On-Demand	Anodyne	HTR3A	26	51
CN1CCN(c2nc3ccccc3nc2N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853837065	GF	On-Demand	Anodyne	HRH4	23	51
CC(C)(C)OC(=O)[C@]12COC[C@H]1CN(C(=O)Nc1cccnc1Cl)C2	ZINC000853837119	FF	On-Demand	Anodyne	G2YM83_BOTF4	65	33
COC(=O)c1cnc(N[C@H]2C[C@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853837120	FG	On-Demand	Anodyne	RBP4	69	40
COC(=O)c1cnc(N[C@@H]2C[C@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853837122	FG	On-Demand	Anodyne	RBP4	69	40
COC(=O)c1cnc(N[C@H]2C[C@@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853837124	FG	On-Demand	Anodyne	RBP4	69	40
COC(=O)c1cnc(N[C@@H]2C[C@@H](O)c3ccccc32)cc1C(F)(F)F	ZINC000853837126	FG	On-Demand	Anodyne	RBP4	69	40
O[C@H]1C[C@@H](Nc2nccc(N3CCCC3)n2)c2ccccc21	ZINC000853837142	CF	On-Demand	Anodyne	SORD	73	35
O[C@H]1C[C@H](Nc2nccc(N3CCCC3)n2)c2ccccc21	ZINC000853837143	CF	On-Demand	Anodyne	SORD	73	35
O[C@@H]1C[C@@H](Nc2nccc(N3CCCC3)n2)c2ccccc21	ZINC000853837144	CF	On-Demand	Anodyne	SORD	73	35
O[C@@H]1C[C@H](Nc2nccc(N3CCCC3)n2)c2ccccc21	ZINC000853837145	CF	On-Demand	Anodyne	SORD	73	35
CN(C)C(=O)OCCNC(=O)Nc1ccc(Br)cc1Cl	ZINC000853837163	FF	On-Demand	Anodyne	NCEH1	29	40
CN(C)C(=O)OCCNC(=O)Nc1nc2c(s1)CCCC2	ZINC000853837169	DD	On-Demand	Anodyne	SLC27A1	30	40
CN(C)C(=O)OCCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853837182	EC	On-Demand	Anodyne	EPHB4	49	31
CN(C)C(=O)OCCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853837182	EC	On-Demand	Anodyne	STAT6	56	36
CN(C)C(=O)OCCNC(=O)Nc1ccc(Br)cc1	ZINC000853837186	EE	On-Demand	Anodyne	P96878_MYCTU	20	42
CN(C)C(=O)OCCNC(=O)Nc1cccc2ccccc12	ZINC000853837190	DF	On-Demand	Anodyne	TRPV1	26	45
CN(C)C(=O)OCCNC(=O)Nc1cccc2ccccc12	ZINC000853837190	DF	On-Demand	Anodyne	MTNR1A	24	43
CN(C)C(=O)OCCNC(=O)Nc1cccc2ccccc12	ZINC000853837190	DF	On-Demand	Anodyne	NCEH1	38	42
CN(C)C(=O)OCCNC(=O)Nc1cccnc1	ZINC000853837194	CC	On-Demand	Anodyne	NAMPT	47	41
CN(C)C(=O)OCCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853837204	DF	On-Demand	Anodyne	RAF1	23	42
CN(C)C(=O)OCCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853837204	DF	On-Demand	Anodyne	EPHX2	36	53
CN(C)C(=O)OCCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853837204	DF	On-Demand	Anodyne	MTCA1	16	46
CN(C)C(=O)OCCNC(=O)Nc1cccc(C#N)c1	ZINC000853837214	CD	On-Demand	Mild	ADRB1	42	36
CN(C)C(=O)OCCNC(=O)Nc1cccc(C#N)c1	ZINC000853837214	CD	On-Demand	Mild	CCR3	24	48
CN(C)C(=O)OCCNC(=O)Nc1cccc(C#N)c1	ZINC000853837214	CD	On-Demand	Mild	MCHR1	20	45
CC(C)(C)OC(=O)[C@]1(NC(=O)Nc2cccnc2Cl)CCOC1	ZINC000853837215	EE	On-Demand	Anodyne	G2YM83_BOTF4	70	38
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](C3CCCCC3)C2)CC1	ZINC000853837219	FH	On-Demand	Anodyne	HTR1B	16	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](C3CCCCC3)C2)CC1	ZINC000853837219	FH	On-Demand	Anodyne	HTR7	15	42
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](C3CCCCC3)C2)CC1	ZINC000853837219	FH	On-Demand	Anodyne	KCNQ2	76	42
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](C3CCCCC3)C2)CC1	ZINC000853837219	FH	On-Demand	Anodyne	RBP4	53	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](C3CCCCC3)C2)CC1	ZINC000853837220	FH	On-Demand	Anodyne	HTR1B	16	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](C3CCCCC3)C2)CC1	ZINC000853837220	FH	On-Demand	Anodyne	HTR7	15	42
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](C3CCCCC3)C2)CC1	ZINC000853837220	FH	On-Demand	Anodyne	KCNQ2	76	42
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](C3CCCCC3)C2)CC1	ZINC000853837220	FH	On-Demand	Anodyne	RBP4	53	34
CC(=O)c1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837221	CD	On-Demand	Anodyne	CCR3	29	43
CC(=O)c1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837221	CD	On-Demand	Anodyne	KCNK3	84	36
CC(=O)c1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837221	CD	On-Demand	Anodyne	KCNK9	52	34
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA2	72	55
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA1	69	49
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA7	34	41
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA5B	57	32
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA4	70	52
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA5A	61	32
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA14	25	41
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA12	51	55
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	CA9	55	49
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	TTK	28	41
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	NCE103	23	44
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	MTCA1	45	40
CN(C)C(=O)OCCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853837232	EC	On-Demand	Anodyne	P96878_MYCTU	58	40
CN1CCN(c2ccccc2NC(=O)N(C)CC2CN(C)C2)CC1	ZINC000853837234	ED	On-Demand	Anodyne	KCNQ2	78	41
Cc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837237	CD	On-Demand	Anodyne	CCKAR	22	49
Cc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837237	CD	On-Demand	Anodyne	CCKBR	35	44
Cc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837237	CD	On-Demand	Anodyne	KCNK3	72	40
Cc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837237	CD	On-Demand	Anodyne	KCNK9	59	40
CN(C)C(=O)OCCNC(=O)Nc1ccccc1C(F)(F)F	ZINC000853837241	DF	On-Demand	Anodyne	RBP4	33	42
CN(C)C(=O)OCCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853837255	GC	On-Demand	Anodyne	HRH2	35	44
CN(C)C(=O)OCCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853837255	GC	On-Demand	Anodyne	NPY1R	40	34
CN(C)C(=O)OCCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853837255	GC	On-Demand	Anodyne	CCR3	50	40
CN(C)C(=O)OCCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853837256	GC	On-Demand	Anodyne	HRH2	35	44
CN(C)C(=O)OCCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853837256	GC	On-Demand	Anodyne	NPY1R	40	34
CN(C)C(=O)OCCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853837256	GC	On-Demand	Anodyne	CCR3	50	40
CN(C)C(=O)OCCNC(=O)Nc1ccc(C#N)cc1	ZINC000853837257	CD	On-Demand	Mild	ADRB1	44	36
Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)n1	ZINC000853837264	CE	On-Demand	Anodyne	GRM5	17	42
Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)n1	ZINC000853837265	CE	On-Demand	Anodyne	GRM5	17	42
O=C(Nc1ccc(F)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853837266	CF	On-Demand	Anodyne	EPHX2	42	44
O=C(Nc1ccc(F)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853837267	CF	On-Demand	Anodyne	EPHX2	42	44
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N[C@@H]1COC2(CCC2)C1	ZINC000853837293	GI	On-Demand	Anodyne	SCD1	35	46
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N[C@@H]1COC2(CCC2)C1	ZINC000853837293	GI	On-Demand	Anodyne	SCD	31	46
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N[C@H]1COC2(CCC2)C1	ZINC000853837294	GI	On-Demand	Anodyne	SCD1	35	46
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N[C@H]1COC2(CCC2)C1	ZINC000853837294	GI	On-Demand	Anodyne	SCD	31	46
CC(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837304	CF	On-Demand	Anodyne	EPHX2	42	49
CC(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837305	CF	On-Demand	Anodyne	EPHX2	42	49
O=C(Nc1nc2ccccc2s1)N[C@@H]1COC2(CCC2)C1	ZINC000853837310	DG	On-Demand	Anodyne	CSNK1D	18	44
O=C(Nc1nc2ccccc2s1)N[C@H]1COC2(CCC2)C1	ZINC000853837311	DG	On-Demand	Anodyne	CSNK1D	18	44
Cc1noc(C)c1CCCNC(=O)N(CCC1CC1)CC1CC1	ZINC000853837317	DG	On-Demand	Anodyne	ADAMTS4	28	40
COc1ccc([C@@H]2CCCN2c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1F	ZINC000853837335	FH	On-Demand	Bother	WDR5	25	40
O=[N+]([O-])c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837370	EI	On-Demand	Bother	RBP4	57	33
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837373	EI	On-Demand	Bother	RBP4	57	33
O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837374	EI	On-Demand	Bother	RBP4	57	33
O=[N+]([O-])c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837377	EI	On-Demand	Bother	RBP4	57	33
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	CA2	73	63
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	CA1	69	46
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	CA4	49	47
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	CA14	55	41
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	CA12	70	63
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	CA9	67	63
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	NCE103	23	46
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	MTCA1	58	63
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853837383	ED	On-Demand	Anodyne	P96878_MYCTU	72	63
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	CA2	73	63
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	CA1	69	46
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	CA4	49	47
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	CA14	55	41
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	CA12	70	63
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	CA9	67	63
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	NCE103	23	46
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	MTCA1	58	63
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853837387	ED	On-Demand	Anodyne	P96878_MYCTU	72	63
CC(C)c1ccccc1NC(=O)N[C@H]1COC2(CCC2)C1	ZINC000853837393	CH	On-Demand	Anodyne	NMBR	28	40
CC(C)c1ccccc1NC(=O)N[C@@H]1COC2(CCC2)C1	ZINC000853837395	CH	On-Demand	Anodyne	NMBR	28	40
CS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837400	FH	On-Demand	Anodyne	RBP4	72	48
CS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837400	FH	On-Demand	Anodyne	SFRP1	44	31
CS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837402	FH	On-Demand	Anodyne	RBP4	72	48
CS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837402	FH	On-Demand	Anodyne	SFRP1	44	31
CS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837405	FH	On-Demand	Anodyne	RBP4	72	48
CS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837405	FH	On-Demand	Anodyne	SFRP1	44	31
CS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837409	FH	On-Demand	Anodyne	RBP4	72	48
CS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853837409	FH	On-Demand	Anodyne	SFRP1	44	31
Cc1noc(C2CCC(NC(=O)N3CCC(N4CCOC4=O)CC3)CC2)n1	ZINC000853837410	GE	On-Demand	Anodyne	SMO	36	45
CN(C)C(=O)OCCNC(=O)Nc1ccc(C(N)=O)cc1	ZINC000853837419	CC	On-Demand	Anodyne	ACR	55	34
C#CCNC(=O)c1ccc(N2CC[C@H](N(C)CCc3ccccc3)C2)nc1	ZINC000853837426	FE	On-Demand	Mild	SCD1	15	47
C#CCNC(=O)c1ccc(N2CC[C@@H](N(C)CCc3ccccc3)C2)nc1	ZINC000853837429	FE	On-Demand	Mild	SCD1	15	47
Cc1nc(NC(=O)N(C)CC2CN(C)C2)sc1-c1ccccc1	ZINC000853837434	EG	On-Demand	Anodyne	PIK3CG	20	41
CN(C)C(=O)OCCNC(=O)c1nc(-c2ccc(Cl)cc2)nn1C	ZINC000853837511	FD	On-Demand	Anodyne	LIPE	29	41
CN(C)C(=O)OCCNC(=O)c1nc(-c2ccc(Cl)cc2)nn1C	ZINC000853837511	FD	On-Demand	Anodyne	UTS2	40	31
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)c(C(N)=O)c1	ZINC000853837523	ED	On-Demand	Anodyne	IMDH_CRYPV	23	43
CC(=O)c1cc(C(=O)NCCOC(=O)N(C)C)n(C)c1	ZINC000853837525	CC	On-Demand	Anodyne	HRAS	47	31
CN(C)C(=O)OCCNC(=O)Nc1ccccc1Cl	ZINC000853837533	CE	On-Demand	Anodyne	CXCL8	49	38
CN(C)C(=O)OCCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853837542	ED	On-Demand	Bother	CACNA1C	46	46
CN(C)C(=O)OCCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853837542	ED	On-Demand	Bother	CACNA1D	74	36
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853837557	DF	On-Demand	Anodyne	CA1	15	45
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853837557	DF	On-Demand	Anodyne	RAF1	22	44
CC(=O)c1ccc(NC(=O)NCCOC(=O)N(C)C)cc1	ZINC000853837562	CD	On-Demand	Anodyne	CA1	23	46
CC(=O)c1ccc(NC(=O)NCCOC(=O)N(C)C)cc1	ZINC000853837562	CD	On-Demand	Anodyne	ACR	44	32
CC(=O)c1ccc(NC(=O)NCCOC(=O)N(C)C)cc1	ZINC000853837562	CD	On-Demand	Anodyne	CA9	15	46
O=C(c1cnc(N[C@H]2C[C@@H](O)c3ccccc32)c(Cl)c1)N1CCOCC1	ZINC000853837577	FF	On-Demand	Anodyne	LRRK2	28	43
CN(C)C(=O)OCCNC(=O)Nc1cccc(Br)c1	ZINC000853837579	EE	On-Demand	Anodyne	EGFR	41	39
O=C(c1cnc(N[C@@H]2C[C@@H](O)c3ccccc32)c(Cl)c1)N1CCOCC1	ZINC000853837580	FF	On-Demand	Anodyne	LRRK2	28	43
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	DRD4	41	31
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	HRH2	19	50
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	PDGFRB	15	41
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	CCR3	24	48
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	MTNR1A	64	46
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	MTNR1B	61	47
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	EPHX2	18	45
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	TAAR1	32	43
COc1cccc(NC(=O)NCCOC(=O)N(C)C)c1	ZINC000853837581	CD	On-Demand	Anodyne	KCNK3	43	37
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@@H]12	ZINC000853837583	GD	On-Demand	Anodyne	CA2	54	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@@H]12	ZINC000853837583	GD	On-Demand	Anodyne	CA1	49	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@@H]12	ZINC000853837583	GD	On-Demand	Anodyne	CA4	37	44
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@@H]12	ZINC000853837583	GD	On-Demand	Anodyne	CA12	45	38
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@@H]12	ZINC000853837583	GD	On-Demand	Anodyne	CA9	46	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@@H]12	ZINC000853837583	GD	On-Demand	Anodyne	MTCA1	47	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@@H]12	ZINC000853837583	GD	On-Demand	Anodyne	P96878_MYCTU	58	45
O=C(c1cnc(N[C@H]2C[C@H](O)c3ccccc32)c(Cl)c1)N1CCOCC1	ZINC000853837584	FF	On-Demand	Anodyne	LRRK2	28	43
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@H]12	ZINC000853837586	GD	On-Demand	Anodyne	CA2	54	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@H]12	ZINC000853837586	GD	On-Demand	Anodyne	CA1	49	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@H]12	ZINC000853837586	GD	On-Demand	Anodyne	CA4	37	44
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@H]12	ZINC000853837586	GD	On-Demand	Anodyne	CA12	45	38
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@H]12	ZINC000853837586	GD	On-Demand	Anodyne	CA9	46	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@H]12	ZINC000853837586	GD	On-Demand	Anodyne	MTCA1	47	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@@H]2CCCC[C@H]12	ZINC000853837586	GD	On-Demand	Anodyne	P96878_MYCTU	58	45
O=C(c1cnc(N[C@@H]2C[C@H](O)c3ccccc32)c(Cl)c1)N1CCOCC1	ZINC000853837588	FF	On-Demand	Anodyne	LRRK2	28	43
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@@H]21	ZINC000853837590	GD	On-Demand	Anodyne	CA2	54	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@@H]21	ZINC000853837590	GD	On-Demand	Anodyne	CA1	49	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@@H]21	ZINC000853837590	GD	On-Demand	Anodyne	CA4	37	44
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@@H]21	ZINC000853837590	GD	On-Demand	Anodyne	CA12	45	38
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@@H]21	ZINC000853837590	GD	On-Demand	Anodyne	CA9	46	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@@H]21	ZINC000853837590	GD	On-Demand	Anodyne	MTCA1	47	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@@H]21	ZINC000853837590	GD	On-Demand	Anodyne	P96878_MYCTU	58	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@H]21	ZINC000853837593	GD	On-Demand	Anodyne	CA2	54	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@H]21	ZINC000853837593	GD	On-Demand	Anodyne	CA1	49	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@H]21	ZINC000853837593	GD	On-Demand	Anodyne	CA4	37	44
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@H]21	ZINC000853837593	GD	On-Demand	Anodyne	CA12	45	38
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@H]21	ZINC000853837593	GD	On-Demand	Anodyne	CA9	46	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@H]21	ZINC000853837593	GD	On-Demand	Anodyne	MTCA1	47	45
COC(=O)[C@@H]1CCN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)[C@H]2CCCC[C@H]21	ZINC000853837593	GD	On-Demand	Anodyne	P96878_MYCTU	58	45
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(C(N)=O)nc3)C2)cc1	ZINC000853837612	FD	On-Demand	Clean	MCHR1	15	47
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(C(N)=O)nc3)C2)cc1	ZINC000853837612	FD	On-Demand	Clean	PROKR1	54	33
CN(C)C(=O)OCCNC(=O)Nc1ccc(N2CCCC2)nc1	ZINC000853837619	DD	On-Demand	Anodyne	DGAT1	38	40
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837622	GE	On-Demand	Bother	COLA	51	33
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837622	GE	On-Demand	Bother	BCL2L1	79	34
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837622	GE	On-Demand	Bother	BCL2	61	34
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837622	GE	On-Demand	Bother	BCL2L2	43	30
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837624	GE	On-Demand	Bother	COLA	51	33
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837624	GE	On-Demand	Bother	BCL2L1	79	34
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837624	GE	On-Demand	Bother	BCL2	61	34
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837624	GE	On-Demand	Bother	BCL2L2	43	30
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837626	GE	On-Demand	Bother	COLA	51	33
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837626	GE	On-Demand	Bother	BCL2L1	79	34
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837626	GE	On-Demand	Bother	BCL2	61	34
CN(C)S(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837626	GE	On-Demand	Bother	BCL2L2	43	30
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837629	GE	On-Demand	Bother	COLA	51	33
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837629	GE	On-Demand	Bother	BCL2L1	79	34
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837629	GE	On-Demand	Bother	BCL2	61	34
CN(C)S(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c([N+](=O)[O-])c1	ZINC000853837629	GE	On-Demand	Bother	BCL2L2	43	30
O[C@@H]1C[C@@H](Nc2ncc(Br)cc2C(F)(F)F)c2ccccc21	ZINC000853837638	FI	On-Demand	Anodyne	RBP4	43	32
CN(C)C(=O)OCCNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853837643	FC	On-Demand	Anodyne	HRH2	31	40
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)cc1	ZINC000853837644	CE	On-Demand	Anodyne	CA12	17	43
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)cc1	ZINC000853837644	CE	On-Demand	Anodyne	CA9	16	43
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)cc1	ZINC000853837644	CE	On-Demand	Anodyne	NCE103	20	43
CN(C)C(=O)OCCNC(=O)Nc1ccc(Cl)cc1	ZINC000853837644	CE	On-Demand	Anodyne	P96878_MYCTU	20	42
O[C@H]1C[C@@H](Nc2ncc(Br)cc2C(F)(F)F)c2ccccc21	ZINC000853837646	FI	On-Demand	Anodyne	RBP4	43	32
O[C@@H]1C[C@H](Nc2ncc(Br)cc2C(F)(F)F)c2ccccc21	ZINC000853837648	FI	On-Demand	Anodyne	RBP4	43	32
CN(C)C(=O)OCCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853837649	EE	On-Demand	Anodyne	P2RY1	67	40
CN(C)C(=O)OCCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853837649	EE	On-Demand	Anodyne	EPHX2	59	46
CN(C)C(=O)OCCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853837649	EE	On-Demand	Anodyne	ACR	41	34
O[C@H]1C[C@H](Nc2ncc(Br)cc2C(F)(F)F)c2ccccc21	ZINC000853837650	FI	On-Demand	Anodyne	RBP4	43	32
CN(CC1=CCCOC1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853837652	CD	On-Demand	Bother	GSTM2	111	42
CN(CC1=CCCOC1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853837652	CD	On-Demand	Bother	GSTP1	69	42
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@H](C)C1O	ZINC000853837661	ED	On-Demand	Anodyne	HTR1B	16	44
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@H](C)C1O	ZINC000853837661	ED	On-Demand	Anodyne	KCNQ2	76	40
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@H](C)C1O	ZINC000853837661	ED	On-Demand	Anodyne	CSF1R	15	46
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@H](C)C1O	ZINC000853837661	ED	On-Demand	Anodyne	RBP4	52	34
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)C1O	ZINC000853837662	ED	On-Demand	Anodyne	HTR1B	16	44
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)C1O	ZINC000853837662	ED	On-Demand	Anodyne	KCNQ2	76	40
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)C1O	ZINC000853837662	ED	On-Demand	Anodyne	CSF1R	15	46
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)C1O	ZINC000853837662	ED	On-Demand	Anodyne	RBP4	52	34
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)[C@@H]1O	ZINC000853837663	ED	On-Demand	Anodyne	HTR1B	16	44
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)[C@@H]1O	ZINC000853837663	ED	On-Demand	Anodyne	KCNQ2	76	40
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)[C@@H]1O	ZINC000853837663	ED	On-Demand	Anodyne	CSF1R	15	46
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H](C)[C@@H]1O	ZINC000853837663	ED	On-Demand	Anodyne	RBP4	52	34
Cc1nc(NC(=O)N2CCC(O)(CO)CC2)sc1-c1ccccc1	ZINC000853837667	EE	On-Demand	Anodyne	NPY5R	33	43
Cc1nc(NC(=O)N2CCC(O)(CO)CC2)sc1-c1ccccc1	ZINC000853837667	EE	On-Demand	Anodyne	PIK3CG	21	49
Cc1nc(NC(=O)N2CCC(O)(CO)CC2)sc1-c1ccccc1	ZINC000853837667	EE	On-Demand	Anodyne	PI4KB	41	38
C[C@@H](NC(=O)N1CCC2(COC2)C1)c1cccc(OC(F)(F)F)c1	ZINC000853837669	EG	On-Demand	Anodyne	EPHX2	38	45
O=C(Nc1ccc(Cl)nc1)N1CCC(O)(CO)CC1	ZINC000853837680	CD	On-Demand	Anodyne	NPY5R	27	40
O=C(Nc1ccc(Cl)nc1)N1CCC(O)(CO)CC1	ZINC000853837680	CD	On-Demand	Anodyne	S1PR2	28	40
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853837686	DH	On-Demand	Anodyne	EPHX2	67	51
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853837686	DH	On-Demand	Anodyne	TRPM8	53	41
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853837688	DH	On-Demand	Anodyne	EPHX2	67	51
O=C(Nc1ccc(C(F)(F)F)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853837688	DH	On-Demand	Anodyne	TRPM8	53	41
C[C@@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1cccc(OC(F)(F)F)c1	ZINC000853837706	GH	On-Demand	Anodyne	NPY5R	32	42
C[C@@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1cccc(OC(F)(F)F)c1	ZINC000853837706	GH	On-Demand	Anodyne	PDS	45	35
C[C@@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1cccc(OC(F)(F)F)c1	ZINC000853837708	GH	On-Demand	Anodyne	NPY5R	32	42
C[C@@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1cccc(OC(F)(F)F)c1	ZINC000853837708	GH	On-Demand	Anodyne	PDS	45	35
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853837726	DI	On-Demand	Anodyne	DGAT1	16	43
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853837728	DI	On-Demand	Anodyne	DGAT1	16	43
O=C1CC[C@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000853837733	FD	On-Demand	Bother	CACNA1C	41	35
O=C1CC[C@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000853837733	FD	On-Demand	Bother	CACNA1D	66	34
O=C1CC[C@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000853837735	FD	On-Demand	Bother	CACNA1C	41	35
O=C1CC[C@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000853837735	FD	On-Demand	Bother	CACNA1D	66	34
O=C1CC[C@@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000853837738	FD	On-Demand	Bother	CACNA1C	41	35
O=C1CC[C@@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@@H]2N1	ZINC000853837738	FD	On-Demand	Bother	CACNA1D	66	34
O=C1CC[C@@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000853837740	FD	On-Demand	Bother	CACNA1C	41	35
O=C1CC[C@@H]2CN(C(=O)C(F)(F)Oc3cccc([N+](=O)[O-])c3)CC[C@H]2N1	ZINC000853837740	FD	On-Demand	Bother	CACNA1D	66	34
O=C(N1CCC[C@@](O)(C2CC2)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853837768	FE	On-Demand	Bother	CACNA1D	45	32
O=C(N1CCC[C@](O)(C2CC2)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853837770	FE	On-Demand	Bother	CACNA1D	45	32
O=C(Nc1ccc(Cl)c(Cl)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853837792	DH	On-Demand	Anodyne	EPHX2	24	50
O=C(Nc1ccc(Cl)c(Cl)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853837792	DH	On-Demand	Anodyne	ENV	45	40
O=C(Nc1ccc(Cl)c(Cl)c1)N[C@H]1COC2(CCC2)C1	ZINC000853837795	DH	On-Demand	Anodyne	EPHX2	24	50
O=C(Nc1ccc(Cl)c(Cl)c1)N[C@H]1COC2(CCC2)C1	ZINC000853837795	DH	On-Demand	Anodyne	ENV	45	40
O=C(Nc1nccs1)N[C@H]1COC2(CCC2)C1	ZINC000853837797	CD	On-Demand	Anodyne	MAP1	84	38
CC(C)(C)OC(=O)NC1(CNC(=O)c2ncn(-c3ccccc3)n2)CCCC1	ZINC000853837798	GF	On-Demand	Anodyne	HCN1	51	32
CC(C)(C)OC(=O)NC1(CNC(=O)c2ncn(-c3ccccc3)n2)CCCC1	ZINC000853837798	GF	On-Demand	Anodyne	HCN4	47	32
O=C(Nc1nccs1)N[C@@H]1COC2(CCC2)C1	ZINC000853837801	CD	On-Demand	Anodyne	MAP1	84	38
CN1CCN(c2ccccc2NC(=O)N2CCC(O)(CO)CC2)CC1	ZINC000853837836	EC	On-Demand	Anodyne	HTR1A	18	45
CN1CCN(c2ccccc2NC(=O)N2CCC(O)(CO)CC2)CC1	ZINC000853837836	EC	On-Demand	Anodyne	HTR1D	16	45
CN1CCN(c2ccccc2NC(=O)N2CCC(O)(CO)CC2)CC1	ZINC000853837836	EC	On-Demand	Anodyne	HTR1B	23	45
CN1CCN(c2ccccc2NC(=O)N2CCC(O)(CO)CC2)CC1	ZINC000853837836	EC	On-Demand	Anodyne	KCNQ2	78	43
CN1CCN(c2ccccc2NC(=O)N2CCC(O)(CO)CC2)CC1	ZINC000853837836	EC	On-Demand	Anodyne	RBP4	25	43
Cc1nc(NC(=O)N(CCN(C)C)CC(=O)N(C)C)sc1-c1ccccc1	ZINC000853837839	GF	On-Demand	Anodyne	PIK3CG	19	42
Cn1cnc2c(N[C@@H]3C[C@H](O)c4ccccc43)ncnc21	ZINC000853837856	CD	On-Demand	Anodyne	ADORA1	49	55
Cn1cnc2c(N[C@@H]3C[C@H](O)c4ccccc43)ncnc21	ZINC000853837856	CD	On-Demand	Anodyne	ADORA3	48	38
Cn1cnc2c(N[C@H]3C[C@@H](O)c4ccccc43)ncnc21	ZINC000853837858	CD	On-Demand	Anodyne	ADORA1	49	55
Cn1cnc2c(N[C@H]3C[C@@H](O)c4ccccc43)ncnc21	ZINC000853837858	CD	On-Demand	Anodyne	ADORA3	48	38
Cn1cnc2c(N[C@H]3C[C@H](O)c4ccccc43)ncnc21	ZINC000853837860	CD	On-Demand	Anodyne	ADORA1	49	55
Cn1cnc2c(N[C@H]3C[C@H](O)c4ccccc43)ncnc21	ZINC000853837860	CD	On-Demand	Anodyne	ADORA3	48	38
CC(=O)Nc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853837861	DE	On-Demand	Anodyne	EPHX2	31	45
Cn1cnc2c(N[C@@H]3C[C@@H](O)c4ccccc43)ncnc21	ZINC000853837862	CD	On-Demand	Anodyne	ADORA1	49	55
Cn1cnc2c(N[C@@H]3C[C@@H](O)c4ccccc43)ncnc21	ZINC000853837862	CD	On-Demand	Anodyne	ADORA3	48	38
CC(=O)Nc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853837864	DE	On-Demand	Anodyne	EPHX2	31	45
O[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)c(Cl)n2)c2ccccc21	ZINC000853837889	EI	On-Demand	Anodyne	RBP4	61	35
O[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)c(Cl)n2)c2ccccc21	ZINC000853837891	EI	On-Demand	Anodyne	RBP4	61	35
O[C@H]1C[C@H](Nc2ccc(C(F)(F)F)c(Cl)n2)c2ccccc21	ZINC000853837892	EI	On-Demand	Anodyne	RBP4	61	35
O[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)c(Cl)n2)c2ccccc21	ZINC000853837894	EI	On-Demand	Anodyne	RBP4	61	35
O=C(Nc1cccc(Cl)c1)N[C@H]1COC2(CCC2)C1	ZINC000853837897	CG	On-Demand	Anodyne	EPHX2	24	62
O=C(Nc1cccc(Cl)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853837899	CG	On-Demand	Anodyne	EPHX2	24	62
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@@H]1COC2(CCC2)C1	ZINC000853837901	EH	On-Demand	Anodyne	CDK5	48	43
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@@H]1COC2(CCC2)C1	ZINC000853837901	EH	On-Demand	Anodyne	MGEA5	33	40
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@H]1COC2(CCC2)C1	ZINC000853837904	EH	On-Demand	Anodyne	CDK5	48	43
O=C(Nc1ncc(Cc2ccccc2)s1)N[C@H]1COC2(CCC2)C1	ZINC000853837904	EH	On-Demand	Anodyne	MGEA5	33	40
O[C@@H]1C[C@@H](Nc2ncccc2C(F)(F)F)c2ccccc21	ZINC000853837930	CH	On-Demand	Anodyne	RBP4	63	35
O[C@H]1C[C@@H](Nc2ncccc2C(F)(F)F)c2ccccc21	ZINC000853837932	CH	On-Demand	Anodyne	RBP4	63	35
O[C@@H]1C[C@H](Nc2ncccc2C(F)(F)F)c2ccccc21	ZINC000853837934	CH	On-Demand	Anodyne	RBP4	63	35
O[C@H]1C[C@H](Nc2ncccc2C(F)(F)F)c2ccccc21	ZINC000853837936	CH	On-Demand	Anodyne	RBP4	63	35
O=[N+]([O-])c1cc(N[C@H]2C[C@@H](O)c3ccccc32)ccc1C(F)(F)F	ZINC000853837945	EI	On-Demand	Bother	RBP4	44	31
O=[N+]([O-])c1cc(N[C@@H]2C[C@H](O)c3ccccc32)ccc1C(F)(F)F	ZINC000853837946	EI	On-Demand	Bother	RBP4	44	31
O=[N+]([O-])c1cc(N[C@@H]2C[C@@H](O)c3ccccc32)ccc1C(F)(F)F	ZINC000853837948	EI	On-Demand	Bother	RBP4	44	31
O=[N+]([O-])c1cc(N[C@H]2C[C@H](O)c3ccccc32)ccc1C(F)(F)F	ZINC000853837950	EI	On-Demand	Bother	RBP4	44	31
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837985	FE	On-Demand	Anodyne	TGM2	77	52
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837985	FE	On-Demand	Anodyne	F13A1	75	40
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837985	FE	On-Demand	Anodyne	GCKR	49	33
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837985	FE	On-Demand	Anodyne	NAMPT	34	40
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837987	FE	On-Demand	Anodyne	TGM2	77	52
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837987	FE	On-Demand	Anodyne	F13A1	75	40
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837987	FE	On-Demand	Anodyne	GCKR	49	33
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837987	FE	On-Demand	Anodyne	NAMPT	34	40
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837990	FE	On-Demand	Anodyne	TGM2	77	52
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837990	FE	On-Demand	Anodyne	F13A1	75	40
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837990	FE	On-Demand	Anodyne	GCKR	49	33
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837990	FE	On-Demand	Anodyne	NAMPT	34	40
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837991	FE	On-Demand	Anodyne	TGM2	77	52
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837991	FE	On-Demand	Anodyne	F13A1	75	40
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837991	FE	On-Demand	Anodyne	GCKR	49	33
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCC1	ZINC000853837991	FE	On-Demand	Anodyne	NAMPT	34	40
CCn1c(=O)c(N[C@H]2C[C@@H](O)c3ccccc32)nc2ccccc21	ZINC000853838008	DG	On-Demand	Anodyne	PYGM	20	43
CCn1c(=O)c(N[C@@H]2C[C@@H](O)c3ccccc32)nc2ccccc21	ZINC000853838009	DG	On-Demand	Anodyne	PYGM	20	43
CCn1c(=O)c(N[C@H]2C[C@H](O)c3ccccc32)nc2ccccc21	ZINC000853838010	DG	On-Demand	Anodyne	PYGM	20	43
CCn1c(=O)c(N[C@@H]2C[C@H](O)c3ccccc32)nc2ccccc21	ZINC000853838011	DG	On-Demand	Anodyne	PYGM	20	43
CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)OC(=O)CSC(C)(C)C	ZINC000853838087	GI	On-Demand	Anodyne	FAS	15	40
CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)OC(=O)CSC(C)(C)C	ZINC000853838088	GI	On-Demand	Anodyne	FAS	15	40
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838150	FH	On-Demand	Anodyne	CCR5	61	48
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838150	FH	On-Demand	Anodyne	SLC6A9	24	41
CCN1CC[C@H](N(CC)C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838151	FH	On-Demand	Anodyne	CCR5	61	48
CCN1CC[C@H](N(CC)C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838151	FH	On-Demand	Anodyne	SLC6A9	24	41
CCN1CC[C@@H](N(CC)C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838153	FH	On-Demand	Anodyne	CCR5	61	48
CCN1CC[C@@H](N(CC)C(=O)N[C@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838153	FH	On-Demand	Anodyne	SLC6A9	24	41
CN1CCN(c2ccccc2NC(=O)N[C@@H]2COC3(CCC3)C2)CC1	ZINC000853838154	EE	On-Demand	Anodyne	KCNQ2	74	40
CCN1CC[C@H](N(CC)C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838155	FH	On-Demand	Anodyne	CCR5	61	48
CCN1CC[C@H](N(CC)C(=O)N[C@@H](C)c2cccc(OC(F)(F)F)c2)C1	ZINC000853838155	FH	On-Demand	Anodyne	SLC6A9	24	41
CN1CCN(c2ccccc2NC(=O)N[C@H]2COC3(CCC3)C2)CC1	ZINC000853838157	EE	On-Demand	Anodyne	KCNQ2	74	40
N#Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853838169	CE	On-Demand	Mild	CCR3	16	42
N#Cc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853838169	CE	On-Demand	Mild	MCHR1	29	41
N#Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853838171	CE	On-Demand	Mild	CCR3	16	42
N#Cc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853838171	CE	On-Demand	Mild	MCHR1	29	41
Cc1nc(NC(=O)N[C@@H]2COC3(CCC3)C2)sc1-c1ccccc1	ZINC000853838207	EH	On-Demand	Anodyne	PIK3CG	20	42
Cc1nc(NC(=O)N[C@H]2COC3(CCC3)C2)sc1-c1ccccc1	ZINC000853838208	EH	On-Demand	Anodyne	PIK3CG	20	42
COc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853838214	CF	On-Demand	Anodyne	CCR3	15	44
COc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853838214	CF	On-Demand	Anodyne	MTNR1A	33	43
COc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853838214	CF	On-Demand	Anodyne	MTNR1B	35	43
COc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853838214	CF	On-Demand	Anodyne	EPHX2	41	53
COc1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853838214	CF	On-Demand	Anodyne	TAAR1	32	40
COc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853838215	CF	On-Demand	Anodyne	CCR3	15	44
COc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853838215	CF	On-Demand	Anodyne	MTNR1A	33	43
COc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853838215	CF	On-Demand	Anodyne	MTNR1B	35	43
COc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853838215	CF	On-Demand	Anodyne	EPHX2	41	53
COc1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853838215	CF	On-Demand	Anodyne	TAAR1	32	40
O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853838216	CG	On-Demand	Anodyne	EPHX2	27	45
O=C(Nc1ccc(F)c(Cl)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853838216	CG	On-Demand	Anodyne	ENV	48	42
O=C(Nc1ccc(F)c(Cl)c1)N[C@H]1COC2(CCC2)C1	ZINC000853838217	CG	On-Demand	Anodyne	EPHX2	27	45
O=C(Nc1ccc(F)c(Cl)c1)N[C@H]1COC2(CCC2)C1	ZINC000853838217	CG	On-Demand	Anodyne	ENV	48	42
Cc1nc(NC(=O)N2CC[C@@H]3NC(=O)CC[C@@H]3C2)sc1-c1ccccc1	ZINC000853838237	FG	On-Demand	Anodyne	PIK3CG	15	44
Cc1nc(NC(=O)N2CC[C@@H]3NC(=O)CC[C@H]3C2)sc1-c1ccccc1	ZINC000853838240	FG	On-Demand	Anodyne	PIK3CG	15	44
Cc1nc(NC(=O)N2CC[C@H]3NC(=O)CC[C@@H]3C2)sc1-c1ccccc1	ZINC000853838241	FG	On-Demand	Anodyne	PIK3CG	15	44
Cc1nc(NC(=O)N2CC[C@H]3NC(=O)CC[C@H]3C2)sc1-c1ccccc1	ZINC000853838243	FG	On-Demand	Anodyne	PIK3CG	15	44
NS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838350	FF	On-Demand	Anodyne	CA2	24	40
NS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838350	FF	On-Demand	Anodyne	RBP4	70	38
NS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838351	FF	On-Demand	Anodyne	CA2	24	40
NS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838351	FF	On-Demand	Anodyne	RBP4	70	38
NS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838353	FF	On-Demand	Anodyne	CA2	24	40
NS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838353	FF	On-Demand	Anodyne	RBP4	70	38
NS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838355	FF	On-Demand	Anodyne	CA2	24	40
NS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838355	FF	On-Demand	Anodyne	RBP4	70	38
CN1CCN(c2ccccc2NC(=O)NNc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853838379	GF	On-Demand	Reactive	KCNQ2	72	39
CN1CCN(c2ccccc2NC(=O)NNc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853838379	GF	On-Demand	Reactive	WDR5	50	55
C[C@H]1CC[C@H](NC(=O)Nc2cccc(N3CCOC3=O)c2)CS1(=O)=O	ZINC000853838464	FD	On-Demand	Anodyne	EPHX2	17	40
C[C@H]1CC[C@@H](NC(=O)Nc2cccc(N3CCOC3=O)c2)CS1(=O)=O	ZINC000853838466	FD	On-Demand	Anodyne	EPHX2	17	40
C[C@@H]1CC[C@H](NC(=O)Nc2cccc(N3CCOC3=O)c2)CS1(=O)=O	ZINC000853838467	FD	On-Demand	Anodyne	EPHX2	17	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@](O)(C4CC4)C3)cc2F)C[C@@H](C)O1	ZINC000853838468	GG	On-Demand	Anodyne	NPY2R	46	34
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@@](O)(C4CC4)C3)cc2F)C[C@@H](C)O1	ZINC000853838471	GG	On-Demand	Anodyne	NPY2R	46	34
CC[C@@H](O)CNC(=O)N[C@@H](C)c1cccc(OC(F)(F)F)c1	ZINC000853838502	DF	On-Demand	Anodyne	PDS	56	39
CC[C@@H](O)CNC(=O)N[C@H](C)c1cccc(OC(F)(F)F)c1	ZINC000853838503	DF	On-Demand	Anodyne	PDS	56	39
C[C@@H](NC(=O)N1CCC(O)(CO)CC1)c1cccc(OC(F)(F)F)c1	ZINC000853838512	FE	On-Demand	Anodyne	CACNA1H	32	42
CN(C[C@@H]1COCCO1)C(=O)Nc1cccnc1Cl	ZINC000853838535	CD	On-Demand	Anodyne	G2YM83_BOTF4	70	35
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1COC2(CCC2)C1	ZINC000853838571	ED	On-Demand	Anodyne	STAT6	53	32
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@@H]1COC2(CCC2)C1	ZINC000853838572	ED	On-Demand	Anodyne	STAT6	53	32
CC(C)(C)OC(=O)NC1(CNC(=O)Nc2cccnc2Cl)CCCC1	ZINC000853838585	FH	On-Demand	Anodyne	G2YM83_BOTF4	69	36
COc1ccc([C@@H]2CCCN2c2ccnc(C(=O)N(C)C)c2)cc1F	ZINC000853838727	EG	On-Demand	Anodyne	ACKR3	50	31
O=[N+]([O-])c1cnc(N[C@@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838799	EH	On-Demand	Bother	RBP4	60	33
O=[N+]([O-])c1cnc(N[C@@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838800	EH	On-Demand	Bother	RBP4	60	33
O=[N+]([O-])c1cnc(N[C@H]2C[C@@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838801	EH	On-Demand	Bother	RBP4	60	33
O=[N+]([O-])c1cnc(N[C@H]2C[C@H](O)c3ccccc32)c(C(F)(F)F)c1	ZINC000853838802	EH	On-Demand	Bother	RBP4	60	33
C[C@@H]1CC[C@H](NC(=O)Nc2cccnc2Cl)CS1(=O)=O	ZINC000853838890	DD	On-Demand	Anodyne	G2YM83_BOTF4	76	44
C[C@H]1CC[C@@H](NC(=O)Nc2cccnc2Cl)CS1(=O)=O	ZINC000853838891	DD	On-Demand	Anodyne	G2YM83_BOTF4	76	44
C[C@H]1CC[C@H](NC(=O)Nc2cccnc2Cl)CS1(=O)=O	ZINC000853838892	DD	On-Demand	Anodyne	G2YM83_BOTF4	76	44
C[C@H]1CN(c2ccc(NC(=O)N(C)C[C@@H]3COCCO3)cc2F)C[C@@H](C)O1	ZINC000853838930	GE	On-Demand	Anodyne	NPY2R	58	39
C[C@H]1CN(c2ccc(NC(=O)N(C)C[C@H]3COCCO3)cc2F)C[C@@H](C)O1	ZINC000853838931	GE	On-Demand	Anodyne	NPY2R	58	39
CN(C[C@@H]1COCCO1)C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853838932	ED	On-Demand	Bother	CACNA1C	42	35
CN(C[C@@H]1COCCO1)C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853838932	ED	On-Demand	Bother	CACNA1D	63	35
Cc1nc(NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)sc1-c1ccccc1	ZINC000853838946	EH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)sc1-c1ccccc1	ZINC000853838946	EH	On-Demand	Anodyne	PI4KB	42	41
Cc1nc(NC(=O)N2C[C@H](C)C(O)[C@@H](C)C2)sc1-c1ccccc1	ZINC000853838947	EH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2C[C@H](C)C(O)[C@@H](C)C2)sc1-c1ccccc1	ZINC000853838947	EH	On-Demand	Anodyne	PI4KB	42	41
Cc1nc(NC(=O)N2C[C@@H](C)C(O)[C@H](C)C2)sc1-c1ccccc1	ZINC000853838948	EH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2C[C@@H](C)C(O)[C@H](C)C2)sc1-c1ccccc1	ZINC000853838948	EH	On-Demand	Anodyne	PI4KB	42	41
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@@H]1COC2(CCC2)C1	ZINC000853838972	FH	On-Demand	Anodyne	CDK5	42	35
O=C(Nc1ncc(Cc2cccc(F)c2)s1)N[C@H]1COC2(CCC2)C1	ZINC000853838973	FH	On-Demand	Anodyne	CDK5	42	35
COc1ccc([C@@H]2CCCN2c2ccnc(C(C)C)n2)cc1F	ZINC000853838997	DI	On-Demand	Anodyne	SORD	46	34
O=C(Nc1cccc(Br)c1)N[C@H]1COC2(CCC2)C1	ZINC000853839017	EG	On-Demand	Anodyne	EPHX2	19	43
O=C(Nc1cccc(Br)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853839019	EG	On-Demand	Anodyne	EPHX2	19	43
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853839031	FD	On-Demand	Anodyne	NPY1R	30	44
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@H]1COC2(CCC2)C1	ZINC000853839032	FD	On-Demand	Anodyne	NPY1R	30	44
CC(C)(C)OC(=O)NC1(CNC(=O)Nc2cccnc2)CCCC1	ZINC000853839063	EG	On-Demand	Anodyne	NAMPT	46	52
O=C(Nc1ccccc1C(F)(F)F)N[C@@H]1COC2(CCC2)C1	ZINC000853839095	DH	On-Demand	Anodyne	EPHX2	15	51
O=C(Nc1ccccc1C(F)(F)F)N[C@@H]1COC2(CCC2)C1	ZINC000853839095	DH	On-Demand	Anodyne	RBP4	42	35
O=C(Nc1ccccc1C(F)(F)F)N[C@H]1COC2(CCC2)C1	ZINC000853839098	DH	On-Demand	Anodyne	EPHX2	15	51
O=C(Nc1ccccc1C(F)(F)F)N[C@H]1COC2(CCC2)C1	ZINC000853839098	DH	On-Demand	Anodyne	RBP4	42	35
N#Cc1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853839103	CE	On-Demand	Mild	EPHX2	24	49
O=C(NC1CC1)c1cc(N[C@H]2C[C@H](O)c3ccccc32)nc2ccccc12	ZINC000853839104	FH	On-Demand	Anodyne	TNKS	56	33
N#Cc1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853839105	CE	On-Demand	Mild	EPHX2	24	49
O=C(NC1CC1)c1cc(N[C@@H]2C[C@H](O)c3ccccc32)nc2ccccc12	ZINC000853839109	FH	On-Demand	Anodyne	TNKS	56	33
O=C(NC1CC1)c1cc(N[C@H]2C[C@@H](O)c3ccccc32)nc2ccccc12	ZINC000853839112	FH	On-Demand	Anodyne	TNKS	56	33
O=C(NC1CC1)c1cc(N[C@@H]2C[C@@H](O)c3ccccc32)nc2ccccc12	ZINC000853839116	FH	On-Demand	Anodyne	TNKS	56	33
Cc1nc(C(=O)N[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2c2ccccc2)no1	ZINC000853839138	GF	On-Demand	Anodyne	EPHX2	17	41
O[C@H]1C[C@@H](Nc2ccnc(N3CCOCC3)n2)c2ccccc21	ZINC000853839198	DD	On-Demand	Anodyne	PIK3CA	28	44
O[C@H]1C[C@H](Nc2ccnc(N3CCOCC3)n2)c2ccccc21	ZINC000853839200	DD	On-Demand	Anodyne	PIK3CA	28	44
O[C@@H]1C[C@@H](Nc2ccnc(N3CCOCC3)n2)c2ccccc21	ZINC000853839202	DD	On-Demand	Anodyne	PIK3CA	28	44
O[C@@H]1C[C@H](Nc2ccnc(N3CCOCC3)n2)c2ccccc21	ZINC000853839204	DD	On-Demand	Anodyne	PIK3CA	28	44
COc1cccc(NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853839205	FH	On-Demand	Anodyne	CCR3	15	41
COc1cccc(NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853839205	FH	On-Demand	Anodyne	MTNR1B	39	42
COc1cccc(NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853839205	FH	On-Demand	Anodyne	EPHX2	22	48
COc1cccc(NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853839205	FH	On-Demand	Anodyne	TAAR1	39	40
Cc1noc(C2CCC(NC(=O)N3CC[C@@H](N4CCOC4=O)C3)CC2)n1	ZINC000853839223	FD	On-Demand	Anodyne	SMO	36	44
Cc1noc(C2CCC(NC(=O)N3CC[C@@H](N4CCOC4=O)C3)CC2)n1	ZINC000853839223	FD	On-Demand	Anodyne	ETHR	46	35
Cc1noc(C2CCC(NC(=O)N3CC[C@H](N4CCOC4=O)C3)CC2)n1	ZINC000853839224	FD	On-Demand	Anodyne	SMO	36	44
Cc1noc(C2CCC(NC(=O)N3CC[C@H](N4CCOC4=O)C3)CC2)n1	ZINC000853839224	FD	On-Demand	Anodyne	ETHR	46	35
O=C(NNc1ccc([N+](=O)[O-])cc1F)Nc1ccc(N2CCCC2)nc1	ZINC000853839243	FF	On-Demand	Reactive	DGAT1	35	40
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853839265	GD	On-Demand	Anodyne	EPHX2	29	49
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853839266	GD	On-Demand	Anodyne	EPHX2	29	49
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853839267	GD	On-Demand	Anodyne	EPHX2	29	49
O=C(NC1CCN(S(=O)(=O)C2CC2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853839268	GD	On-Demand	Anodyne	EPHX2	29	49
Cc1nc(NC(=O)N[C@@H]2CC[C@@H](C)S(=O)(=O)C2)sc1-c1ccccc1	ZINC000853839269	GG	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@H]2CC[C@H](C)S(=O)(=O)C2)sc1-c1ccccc1	ZINC000853839270	GG	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@H]2CC[C@@H](C)S(=O)(=O)C2)sc1-c1ccccc1	ZINC000853839271	GG	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2CC[C@H](C)S(=O)(=O)C2)sc1-c1ccccc1	ZINC000853839272	GG	On-Demand	Anodyne	PIK3CG	19	40
C[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](C)O)c1cccc(OC(F)(F)F)c1	ZINC000853839274	EG	On-Demand	Anodyne	WNT3	40	31
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000853839279	GE	On-Demand	Reactive	EPHX2	19	48
CN1CCN(c2ccccc2NC(=O)N(C)C[C@H]2COCCO2)CC1	ZINC000853839287	ED	On-Demand	Anodyne	KCNQ2	69	36
CN1CCN(c2ccccc2NC(=O)N(C)C[C@@H]2COCCO2)CC1	ZINC000853839288	ED	On-Demand	Anodyne	KCNQ2	69	36
C[C@@H](NC(=O)N1CC[C@@H](O)C(F)(F)C1)c1cccc(OC(F)(F)F)c1	ZINC000853839320	FG	On-Demand	Anodyne	EPHX2	41	39
C[C@@H](NC(=O)N1CC[C@H](O)C(F)(F)C1)c1cccc(OC(F)(F)F)c1	ZINC000853839323	FG	On-Demand	Anodyne	EPHX2	41	39
C[C@@H]1CC[C@H](NC(=O)Nc2ccc(Cl)nc2)CS1(=O)=O	ZINC000853839337	DD	On-Demand	Anodyne	EPHX2	33	41
C[C@H]1CC[C@@H](NC(=O)Nc2ccc(Cl)nc2)CS1(=O)=O	ZINC000853839338	DD	On-Demand	Anodyne	EPHX2	33	41
C[C@H]1CC[C@H](NC(=O)Nc2ccc(Cl)nc2)CS1(=O)=O	ZINC000853839339	DD	On-Demand	Anodyne	EPHX2	33	41
C[C@@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1cccc(OC(F)(F)F)c1	ZINC000853839340	GH	On-Demand	Anodyne	CPT1A	100	37
C[C@@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1cccc(OC(F)(F)F)c1	ZINC000853839342	GH	On-Demand	Anodyne	CPT1A	100	37
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@H](C)C1O	ZINC000853839344	CE	On-Demand	Anodyne	RBP4	50	31
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@H](C)C1O	ZINC000853839344	CE	On-Demand	Anodyne	G2YM83_BOTF4	77	43
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](C)[C@@H]1O	ZINC000853839345	CE	On-Demand	Anodyne	RBP4	50	31
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](C)[C@@H]1O	ZINC000853839345	CE	On-Demand	Anodyne	G2YM83_BOTF4	77	43
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](C)C1O	ZINC000853839346	CE	On-Demand	Anodyne	RBP4	50	31
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](C)C1O	ZINC000853839346	CE	On-Demand	Anodyne	G2YM83_BOTF4	77	43
O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1COC2(CCC2)C1	ZINC000853839385	CE	On-Demand	Bother	NMBR	56	34
O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853839386	CE	On-Demand	Bother	NMBR	56	34
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853839392	EG	On-Demand	Anodyne	P2RY1	65	47
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853839392	EG	On-Demand	Anodyne	EPHX2	96	63
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853839392	EG	On-Demand	Anodyne	TRPM8	15	41
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853839393	EG	On-Demand	Anodyne	P2RY1	65	47
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853839393	EG	On-Demand	Anodyne	EPHX2	96	63
O=C(Nc1ccc(OC(F)(F)F)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853839393	EG	On-Demand	Anodyne	TRPM8	15	41
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853839394	DD	On-Demand	Anodyne	EPHX2	35	40
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853839394	DD	On-Demand	Anodyne	MTCA1	37	47
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2COC3(CCC3)C2)cc1	ZINC000853839394	DD	On-Demand	Anodyne	P96878_MYCTU	45	47
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853839395	DD	On-Demand	Anodyne	EPHX2	35	40
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853839395	DD	On-Demand	Anodyne	MTCA1	37	47
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2COC3(CCC3)C2)cc1	ZINC000853839395	DD	On-Demand	Anodyne	P96878_MYCTU	45	47
CC(C)(C)OC(=O)NC1(CNC(=O)c2cc([N+](=O)[O-])c[nH]2)CCCC1	ZINC000853839406	FE	On-Demand	Bother	NMBR	59	31
CS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853839426	DF	On-Demand	Anodyne	PTGS2	24	49
CS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853839426	DF	On-Demand	Anodyne	BRD2	19	43
CS(=O)(=O)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853839426	DF	On-Demand	Anodyne	BRD3	20	43
CS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853839428	DF	On-Demand	Anodyne	PTGS2	24	49
CS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853839428	DF	On-Demand	Anodyne	BRD2	19	43
CS(=O)(=O)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853839428	DF	On-Demand	Anodyne	BRD3	20	43
CS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853839430	DF	On-Demand	Anodyne	PTGS2	24	49
CS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853839430	DF	On-Demand	Anodyne	BRD2	19	43
CS(=O)(=O)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853839430	DF	On-Demand	Anodyne	BRD3	20	43
CS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853839432	DF	On-Demand	Anodyne	PTGS2	24	49
CS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853839432	DF	On-Demand	Anodyne	BRD2	19	43
CS(=O)(=O)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853839432	DF	On-Demand	Anodyne	BRD3	20	43
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839434	FF	On-Demand	Anodyne	TGM2	76	51
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839434	FF	On-Demand	Anodyne	F13A1	74	40
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839434	FF	On-Demand	Anodyne	GCKR	44	33
O=S(=O)(c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839434	FF	On-Demand	Anodyne	NAMPT	31	41
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839437	FF	On-Demand	Anodyne	TGM2	76	51
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839437	FF	On-Demand	Anodyne	F13A1	74	40
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839437	FF	On-Demand	Anodyne	GCKR	44	33
O=S(=O)(c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839437	FF	On-Demand	Anodyne	NAMPT	31	41
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839439	FF	On-Demand	Anodyne	TGM2	76	51
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839439	FF	On-Demand	Anodyne	F13A1	74	40
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839439	FF	On-Demand	Anodyne	GCKR	44	33
O=S(=O)(c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839439	FF	On-Demand	Anodyne	NAMPT	31	41
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839441	FF	On-Demand	Anodyne	TGM2	76	51
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839441	FF	On-Demand	Anodyne	F13A1	74	40
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839441	FF	On-Demand	Anodyne	GCKR	44	33
O=S(=O)(c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1)N1CCCCC1	ZINC000853839441	FF	On-Demand	Anodyne	NAMPT	31	41
COc1cccc(C2(NC(=O)NCCCc3c(C)noc3C)CCC2)c1	ZINC000853839459	FH	On-Demand	Anodyne	MTNR1A	33	40
COc1cccc(C2(NC(=O)NCCCc3c(C)noc3C)CCC2)c1	ZINC000853839459	FH	On-Demand	Anodyne	MTNR1B	30	40
O=C(Nc1ncc(-c2ccccc2)s1)N[C@H]1COC2(CCC2)C1	ZINC000853839461	EH	On-Demand	Anodyne	CDK5	40	35
O=C(Nc1ncc(-c2ccccc2)s1)N[C@@H]1COC2(CCC2)C1	ZINC000853839463	EH	On-Demand	Anodyne	CDK5	40	35
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	CA2	27	52
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	CA1	22	42
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	CA4	22	47
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	EPHX2	15	40
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	CA12	28	52
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	CA9	26	52
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	MTCA1	43	46
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2COC3(CCC3)C2)c1	ZINC000853839465	ED	On-Demand	Anodyne	P96878_MYCTU	51	46
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	CA2	27	52
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	CA1	22	42
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	CA4	22	47
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	EPHX2	15	40
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	CA12	28	52
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	CA9	26	52
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	MTCA1	43	46
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2COC3(CCC3)C2)c1	ZINC000853839467	ED	On-Demand	Anodyne	P96878_MYCTU	51	46
Cc1noc(C)c1CCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853839482	EE	On-Demand	Anodyne	CPT1A	61	38
Cc1noc(C)c1CCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853839484	EE	On-Demand	Anodyne	CPT1A	61	38
O=C(Nc1ccc(Br)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853839486	EG	On-Demand	Anodyne	EPHX2	33	45
O=C(Nc1ccc(Br)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853839488	EG	On-Demand	Anodyne	EPHX2	33	45
Cc1cc(N2CC[C@H](N(C)CCc3ccccc3)C2)nc(N)n1	ZINC000853839522	DE	On-Demand	Anodyne	HRH4	46	52
COc1ccc([C@@H]2CCCN2c2ccc(-c3nc(C)no3)cn2)cc1F	ZINC000853839531	FH	On-Demand	Anodyne	SCARB1	41	34
COCc1cc([N+](=O)[O-])ccc1N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853839585	DG	On-Demand	Bother	CACNA1C	43	35
COCc1cc([N+](=O)[O-])ccc1N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853839585	DG	On-Demand	Bother	CACNA1D	69	34
COCc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853839586	DG	On-Demand	Bother	CACNA1C	43	35
COCc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853839586	DG	On-Demand	Bother	CACNA1D	69	34
COCc1cc([N+](=O)[O-])ccc1N[C@H]1C[C@H](O)c2ccccc21	ZINC000853839588	DG	On-Demand	Bother	CACNA1C	43	35
COCc1cc([N+](=O)[O-])ccc1N[C@H]1C[C@H](O)c2ccccc21	ZINC000853839588	DG	On-Demand	Bother	CACNA1D	69	34
COCc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853839589	DG	On-Demand	Bother	CACNA1C	43	35
COCc1cc([N+](=O)[O-])ccc1N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853839589	DG	On-Demand	Bother	CACNA1D	69	34
C[C@@H]1CC[C@H](NC(=O)Nc2ccccc2N2CCN(C)CC2)CS1(=O)=O	ZINC000853839685	GD	On-Demand	Anodyne	KCNQ2	73	39
C[C@H]1CC[C@H](NC(=O)Nc2ccccc2N2CCN(C)CC2)CS1(=O)=O	ZINC000853839686	GD	On-Demand	Anodyne	KCNQ2	73	39
C[C@H]1CC[C@@H](NC(=O)Nc2ccccc2N2CCN(C)CC2)CS1(=O)=O	ZINC000853839688	GD	On-Demand	Anodyne	KCNQ2	73	39
O=C(N1CCC(O)(CO)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853839732	EC	On-Demand	Bother	CACNA1C	47	35
O=C(N1CCC(O)(CO)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853839732	EC	On-Demand	Bother	CACNA1D	76	35
O=S(=O)(NCC1CC1)c1ccc(N[C@H]2C[C@@H](O)c3ccccc32)nc1	ZINC000853839768	FE	On-Demand	Anodyne	NPY5R	20	41
O=S(=O)(NCC1CC1)c1ccc(N[C@@H]2C[C@@H](O)c3ccccc32)nc1	ZINC000853839769	FE	On-Demand	Anodyne	NPY5R	20	41
O=S(=O)(NCC1CC1)c1ccc(N[C@H]2C[C@H](O)c3ccccc32)nc1	ZINC000853839770	FE	On-Demand	Anodyne	NPY5R	20	41
O=S(=O)(NCC1CC1)c1ccc(N[C@@H]2C[C@H](O)c3ccccc32)nc1	ZINC000853839771	FE	On-Demand	Anodyne	NPY5R	20	41
O=C(N1CCCC1)N1CCN(c2ccc(Br)cc2)CC1	ZINC000853839828	EF	On-Demand	Anodyne	AKR1C3	21	76
O=C(N1CCCC1)N1CCN(c2ccc(Br)cc2)CC1	ZINC000853839828	EF	On-Demand	Anodyne	Q9FYV8_MAIZE	26	43
CC(C)(C)OC(=O)NC1(CNC(=O)Nc2nccs2)CCCC1	ZINC000853839867	EG	On-Demand	Anodyne	MAP1	113	36
CC(C)(C)OC(=O)NC1(CNC(=O)Nc2cccc(C#N)c2)CCCC1	ZINC000853839911	FH	On-Demand	Mild	CCR3	17	42
CC(C)(C)OC(=O)NC1(CNC(=O)Nc2cccc(C#N)c2)CCCC1	ZINC000853839911	FH	On-Demand	Mild	MCHR1	30	48
Cc1noc(C2CCC(NC(=O)NNc3ccc(C)c(F)c3)CC2)n1	ZINC000853839927	EG	On-Demand	Reactive	MAPK13	42	32
CC(=O)c1cccc(NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853839999	GH	On-Demand	Anodyne	CCR3	20	41
CC(=O)c1cccc(NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853839999	GH	On-Demand	Anodyne	EPHX2	19	46
CC(=O)c1cccc(NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)c1	ZINC000853839999	GH	On-Demand	Anodyne	IMDH_CRYPV	56	36
Cc1nsc(C(=O)N2CCC[C@@]2(C)Cc2ccc(OC(F)(F)F)cc2)n1	ZINC000853840005	GH	On-Demand	Anodyne	SLC12A5	48	34
Cc1nsc(C(=O)N2CCC[C@]2(C)Cc2ccc(OC(F)(F)F)cc2)n1	ZINC000853840006	GH	On-Demand	Anodyne	SLC12A5	48	34
C[C@H]1CC[C@@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)CS1(=O)=O	ZINC000853840040	FG	On-Demand	Anodyne	EPHX2	44	42
C[C@H]1CC[C@@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)CS1(=O)=O	ZINC000853840040	FG	On-Demand	Anodyne	DGAT1	18	43
C[C@@H]1CC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)CS1(=O)=O	ZINC000853840041	FG	On-Demand	Anodyne	EPHX2	44	42
C[C@@H]1CC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)CS1(=O)=O	ZINC000853840041	FG	On-Demand	Anodyne	DGAT1	18	43
C[C@H]1CC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)CS1(=O)=O	ZINC000853840042	FG	On-Demand	Anodyne	EPHX2	44	42
C[C@H]1CC[C@H](NC(=O)Nc2ccc(-c3ccccc3)cc2)CS1(=O)=O	ZINC000853840042	FG	On-Demand	Anodyne	DGAT1	18	43
O=C(NNc1cc(F)cc(Cl)c1)Nc1ccc(N2CCCC2)nc1	ZINC000853840097	EH	On-Demand	Reactive	DGAT1	37	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	ADA	48	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	ADORA1	180	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	SLC29A1	145	64
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	ADORA2A	63	70
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	ADORA2B	20	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	ADK	83	55
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	AHCY	55	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	P2RX4	36	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	P2RX1	47	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	P2RY1	34	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	AMD1	19	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	GAPDH	29	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	P2RY2	15	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	ADORA3	151	69
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	OXGR1	119	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	RNASE1	56	37
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	DNMT3B	82	45
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	Q4VQ11_PIG	94	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	GPR17	48	48
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840185	GC	On-Demand	Anodyne	DOT1L	90	43
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	ADA	48	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	ADORA1	180	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	SLC29A1	145	64
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	ADORA2A	63	70
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	ADORA2B	20	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	ADK	83	55
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	AHCY	55	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	P2RX4	36	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	P2RX1	47	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	P2RY1	34	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	AMD1	19	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	GAPDH	29	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	P2RY2	15	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	ADORA3	151	69
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	OXGR1	119	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	RNASE1	56	37
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	DNMT3B	82	45
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	Q4VQ11_PIG	94	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	GPR17	48	48
OC[C@H]1O[C@@H](n2cnc3c(N[C@@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840188	GC	On-Demand	Anodyne	DOT1L	90	43
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	ADA	48	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	ADORA1	180	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	SLC29A1	145	64
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	ADORA2A	63	70
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	ADORA2B	20	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	ADK	83	55
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	AHCY	55	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	P2RX4	36	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	P2RX1	47	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	P2RY1	34	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	AMD1	19	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	GAPDH	29	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	P2RY2	15	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	ADORA3	151	69
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	OXGR1	119	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	RNASE1	56	37
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	DNMT3B	82	45
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	Q4VQ11_PIG	94	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	GPR17	48	48
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840190	GC	On-Demand	Anodyne	DOT1L	90	43
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	ADA	48	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	ADORA1	180	75
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	SLC29A1	145	64
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	ADORA2A	63	70
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	ADORA2B	20	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	ADK	83	55
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	AHCY	55	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	P2RX4	36	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	P2RX1	47	39
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	P2RY1	34	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	AMD1	19	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	GAPDH	29	40
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	P2RY2	15	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	ADORA3	151	69
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	OXGR1	119	41
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	RNASE1	56	37
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	DNMT3B	82	45
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	Q4VQ11_PIG	94	68
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	GPR17	48	48
OC[C@H]1O[C@@H](n2cnc3c(N[C@H]4C[C@@H](O)c5ccccc54)ncnc32)[C@H](O)[C@@H]1O	ZINC000853840192	GC	On-Demand	Anodyne	DOT1L	90	43
O[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cn2)c2ccccc21	ZINC000853840194	CH	On-Demand	Anodyne	RBP4	42	34
O[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cn2)c2ccccc21	ZINC000853840196	CH	On-Demand	Anodyne	RBP4	42	34
O[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cn2)c2ccccc21	ZINC000853840198	CH	On-Demand	Anodyne	RBP4	42	34
O[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cn2)c2ccccc21	ZINC000853840200	CH	On-Demand	Anodyne	RBP4	42	34
C[C@H]1CN(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@H](C)C1O	ZINC000853840201	GF	On-Demand	Anodyne	NPY2R	64	37
C[C@H]1CN(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C[C@@H](C)[C@@H]1O	ZINC000853840203	GF	On-Demand	Anodyne	NPY2R	64	37
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H](C)[C@@H](O)[C@H](C)C3)cc2F)C[C@@H](C)O1	ZINC000853840205	GF	On-Demand	Anodyne	NPY2R	64	37
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H](C)C(O)[C@@H](C)C3)cc2F)C[C@@H](C)O1	ZINC000853840208	GF	On-Demand	Anodyne	NPY2R	64	37
C[C@H]1CN(c2ccc(NC(=O)N3CCC(O)(CO)CC3)cc2F)C[C@H](C)O1	ZINC000853840210	GD	On-Demand	Anodyne	CACNA1H	40	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC(O)(CO)CC3)cc2F)C[C@H](C)O1	ZINC000853840210	GD	On-Demand	Anodyne	NPY2R	77	38
C[C@H]1CN(c2ccc(NC(=O)N3CCC(O)(CO)CC3)cc2F)C[C@@H](C)O1	ZINC000853840211	GD	On-Demand	Anodyne	CACNA1H	40	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC(O)(CO)CC3)cc2F)C[C@@H](C)O1	ZINC000853840211	GD	On-Demand	Anodyne	NPY2R	77	38
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N1c2ccccc2Sc2ccccc21	ZINC000853840217	HK	On-Demand	Anodyne	BCHE	15	51
C[C@@H](NC(=O)N1CCC(CO)(CO)C1)c1cccc(OC(F)(F)F)c1	ZINC000853840245	FE	On-Demand	Anodyne	EPHX2	36	41
O=C(NNc1cc(F)cc(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853840314	EH	On-Demand	Reactive	KCNQ2	60	35
O=C(NNc1cc(F)cc(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853840314	EH	On-Demand	Reactive	TRPV1	16	45
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)C2CC2)CC1	ZINC000853840320	EB	On-Demand	Anodyne	EPHX2	18	44
CC[C@H](NC(=O)COC(=O)CSC(C)(C)C)c1ccc(Cl)cc1	ZINC000853840359	FH	On-Demand	Anodyne	UTS2	41	33
CC[C@@H](NC(=O)COC(=O)CSC(C)(C)C)c1ccc(Cl)cc1	ZINC000853840361	FH	On-Demand	Anodyne	UTS2	41	33
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@](O)(C3CC3)C2)CC1	ZINC000853840389	FE	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CCC[C@](O)(C3CC3)C2)CC1	ZINC000853840392	FE	On-Demand	Anodyne	KCNQ2	72	40
Cc1nc(NC(=O)N2CCC[C@@](O)(C3CC3)C2)sc1-c1ccccc1	ZINC000853840412	FH	On-Demand	Anodyne	EPHX2	15	42
Cc1nc(NC(=O)N2CCC[C@@](O)(C3CC3)C2)sc1-c1ccccc1	ZINC000853840412	FH	On-Demand	Anodyne	PIK3CG	18	46
Cc1nc(NC(=O)N2CCC[C@](O)(C3CC3)C2)sc1-c1ccccc1	ZINC000853840414	FH	On-Demand	Anodyne	EPHX2	15	42
Cc1nc(NC(=O)N2CCC[C@](O)(C3CC3)C2)sc1-c1ccccc1	ZINC000853840414	FH	On-Demand	Anodyne	PIK3CG	18	46
Cc1nc(NC(=O)N(C)C[C@H]2COCCO2)sc1-c1ccccc1	ZINC000853840426	EF	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)N(C)C[C@@H]2COCCO2)sc1-c1ccccc1	ZINC000853840428	EF	On-Demand	Anodyne	PIK3CG	20	41
O=C(Nc1ccc(Cl)nc1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853840444	CF	On-Demand	Anodyne	EPHX2	28	43
O=C(Nc1ccc(Cl)nc1)N1CCC[C@](O)(C2CC2)C1	ZINC000853840445	CF	On-Demand	Anodyne	EPHX2	28	43
CC(=O)c1ccc(C(F)(F)F)nc1N[C@H]1C[C@H](O)c2ccccc21	ZINC000853840498	EH	On-Demand	Anodyne	RBP4	55	32
CC(=O)c1ccc(C(F)(F)F)nc1N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853840499	EH	On-Demand	Anodyne	RBP4	55	32
CC(=O)c1ccc(C(F)(F)F)nc1N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853840500	EH	On-Demand	Anodyne	RBP4	55	32
CC(=O)c1ccc(C(F)(F)F)nc1N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853840501	EH	On-Demand	Anodyne	RBP4	55	32
COc1cccc([N+](=O)[O-])c1N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853840520	DG	On-Demand	Bother	CACNA1D	17	40
COc1cccc([N+](=O)[O-])c1N[C@H]1C[C@H](O)c2ccccc21	ZINC000853840521	DG	On-Demand	Bother	CACNA1D	17	40
COc1cccc([N+](=O)[O-])c1N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853840522	DG	On-Demand	Bother	CACNA1D	17	40
COc1cccc([N+](=O)[O-])c1N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853840523	DG	On-Demand	Bother	CACNA1D	17	40
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	HTR1A	17	42
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	DRD2	23	40
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	DRD1	55	40
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	HTR1D	21	42
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	HTR1B	30	40
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	KCNQ2	80	41
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	NPY2R	42	39
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	P2RY1	44	34
CN1CCN(c2ccccc2NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853840630	GG	On-Demand	Reactive	WDR5	35	40
C#CCCN(CCOC)C(=O)NC[C@H](CC)Oc1cccc(F)c1	ZINC000853840640	EF	On-Demand	Mild	PDS	36	40
C#CCCN(CCOC)C(=O)NC[C@@H](CC)Oc1cccc(F)c1	ZINC000853840641	EF	On-Demand	Mild	PDS	36	40
O[C@H]1C[C@@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840713	DD	On-Demand	Anodyne	SORD	54	33
O[C@H]1C[C@@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840713	DD	On-Demand	Anodyne	MAPK8	33	44
O[C@H]1C[C@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840714	DD	On-Demand	Anodyne	SORD	54	33
O[C@H]1C[C@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840714	DD	On-Demand	Anodyne	MAPK8	33	44
O[C@@H]1C[C@@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840715	DD	On-Demand	Anodyne	SORD	54	33
O[C@@H]1C[C@@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840715	DD	On-Demand	Anodyne	MAPK8	33	44
O[C@@H]1C[C@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840716	DD	On-Demand	Anodyne	SORD	54	33
O[C@@H]1C[C@H](Nc2nccc(N3CCOCC3)n2)c2ccccc21	ZINC000853840716	DD	On-Demand	Anodyne	MAPK8	33	44
O=S(=O)(c1ccnc(N[C@H]2C[C@@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840725	FE	On-Demand	Anodyne	TGM2	63	38
O=S(=O)(c1ccnc(N[C@H]2C[C@@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840725	FE	On-Demand	Anodyne	F13A1	60	36
O=S(=O)(c1ccnc(N[C@@H]2C[C@@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840726	FE	On-Demand	Anodyne	TGM2	63	38
O=S(=O)(c1ccnc(N[C@@H]2C[C@@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840726	FE	On-Demand	Anodyne	F13A1	60	36
O=S(=O)(c1ccnc(N[C@H]2C[C@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840727	FE	On-Demand	Anodyne	TGM2	63	38
O=S(=O)(c1ccnc(N[C@H]2C[C@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840727	FE	On-Demand	Anodyne	F13A1	60	36
O=S(=O)(c1ccnc(N[C@@H]2C[C@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840728	FE	On-Demand	Anodyne	TGM2	63	38
O=S(=O)(c1ccnc(N[C@@H]2C[C@H](O)c3ccccc32)c1)N1CCCC1	ZINC000853840728	FE	On-Demand	Anodyne	F13A1	60	36
O[C@H]1C[C@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840755	DF	On-Demand	Anodyne	ADORA1	75	51
O[C@H]1C[C@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840755	DF	On-Demand	Anodyne	ADORA3	85	43
O[C@H]1C[C@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840755	DF	On-Demand	Anodyne	Q4VQ11_PIG	62	43
O[C@H]1C[C@@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840756	DF	On-Demand	Anodyne	ADORA1	75	51
O[C@H]1C[C@@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840756	DF	On-Demand	Anodyne	ADORA3	85	43
O[C@H]1C[C@@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840756	DF	On-Demand	Anodyne	Q4VQ11_PIG	62	43
O[C@@H]1C[C@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840757	DF	On-Demand	Anodyne	ADORA1	75	51
O[C@@H]1C[C@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840757	DF	On-Demand	Anodyne	ADORA3	85	43
O[C@@H]1C[C@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840757	DF	On-Demand	Anodyne	Q4VQ11_PIG	62	43
O[C@@H]1C[C@@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840758	DF	On-Demand	Anodyne	ADORA1	75	51
O[C@@H]1C[C@@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840758	DF	On-Demand	Anodyne	ADORA3	85	43
O[C@@H]1C[C@@H](Nc2ncnc3c2ncn3C2CC2)c2ccccc21	ZINC000853840758	DF	On-Demand	Anodyne	Q4VQ11_PIG	62	43
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2C[C@@H](O)c3ccccc32)n1	ZINC000853840806	EE	On-Demand	Bother	CACNA1D	24	41
COC(=O)c1ccc([N+](=O)[O-])c(N[C@H]2C[C@H](O)c3ccccc32)n1	ZINC000853840807	EE	On-Demand	Bother	CACNA1D	24	41
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@H](O)c3ccccc32)n1	ZINC000853840808	EE	On-Demand	Bother	CACNA1D	24	41
COC(=O)c1ccc([N+](=O)[O-])c(N[C@@H]2C[C@@H](O)c3ccccc32)n1	ZINC000853840809	EE	On-Demand	Bother	CACNA1D	24	41
O=C(NNc1ccc([N+](=O)[O-])cc1F)Nc1ccc(N2CCOCC2)cn1	ZINC000853840810	GE	On-Demand	Reactive	STAT6	46	34
Cc1csc2c(N[C@@H]3C[C@@H](O)c4ccccc43)ncnc12	ZINC000853840871	CH	On-Demand	Anodyne	LPAR2	17	42
Cc1csc2c(N[C@@H]3C[C@H](O)c4ccccc43)ncnc12	ZINC000853840872	CH	On-Demand	Anodyne	LPAR2	17	42
Cc1csc2c(N[C@H]3C[C@@H](O)c4ccccc43)ncnc12	ZINC000853840873	CH	On-Demand	Anodyne	LPAR2	17	42
Cc1csc2c(N[C@H]3C[C@H](O)c4ccccc43)ncnc12	ZINC000853840874	CH	On-Demand	Anodyne	LPAR2	17	42
CC[C@@H](CNC(=O)NCCN(C)OC)Oc1cccc(F)c1	ZINC000853840909	DD	On-Demand	Anodyne	PDS	63	44
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853840946	FG	On-Demand	Bother	MCHR2	42	33
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@H]1C[C@H](O)c2ccccc21	ZINC000853840947	FG	On-Demand	Bother	MCHR2	42	33
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853840948	FG	On-Demand	Bother	MCHR2	42	33
O=[N+]([O-])c1ccc(CN2CCOCC2)cc1N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853840949	FG	On-Demand	Bother	MCHR2	42	33
O=C(N[C@@H]1C[C@H](O)c2ccccc21)C(F)(F)C(=O)N1CCOCC1	ZINC000853840962	EC	On-Demand	Anodyne	RBP4	58	33
O=C(N[C@H]1C[C@@H](O)c2ccccc21)C(F)(F)C(=O)N1CCOCC1	ZINC000853840963	EC	On-Demand	Anodyne	RBP4	58	33
O=C(N[C@H]1C[C@H](O)c2ccccc21)C(F)(F)C(=O)N1CCOCC1	ZINC000853840964	EC	On-Demand	Anodyne	RBP4	58	33
CN1CCN(c2ccccc2NC(=O)NCCCOC(C)(C)C)CC1	ZINC000853840975	EF	On-Demand	Anodyne	HTR1A	44	43
CN1CCN(c2ccccc2NC(=O)NCCCOC(C)(C)C)CC1	ZINC000853840975	EF	On-Demand	Anodyne	DRD2	45	45
CN1CCN(c2ccccc2NC(=O)NCCCOC(C)(C)C)CC1	ZINC000853840975	EF	On-Demand	Anodyne	DRD3	66	40
CN1CCN(c2ccccc2NC(=O)NCCCOC(C)(C)C)CC1	ZINC000853840975	EF	On-Demand	Anodyne	KCNQ2	77	39
O=C(Nc1nc2c(s1)CCCCC2)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853840976	EH	On-Demand	Anodyne	SLC27A1	33	44
O=C(Nc1nc2c(s1)CCCCC2)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853840977	EH	On-Demand	Anodyne	SLC27A1	33	44
O=C(Nc1nc2c(s1)CCCCC2)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853840978	EH	On-Demand	Anodyne	SLC27A1	33	44
O=C(Nc1nc2c(s1)CCCCC2)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853840979	EH	On-Demand	Anodyne	SLC27A1	33	44
COCCn1cc(NC(=O)NN2CCc3ccccc3C2)cn1	ZINC000853840997	DD	On-Demand	Anodyne	PANC	50	33
COCCn1cc(NC(=O)NN2CCc3ccccc3C2)cn1	ZINC000853840997	DD	On-Demand	Anodyne	NOD2	44	39
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841028	GE	On-Demand	Anodyne	NPY1R	35	49
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841028	GE	On-Demand	Anodyne	CCKBR	50	37
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841029	GE	On-Demand	Anodyne	NPY1R	35	49
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841029	GE	On-Demand	Anodyne	CCKBR	50	37
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841030	GE	On-Demand	Anodyne	NPY1R	35	49
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841030	GE	On-Demand	Anodyne	CCKBR	50	37
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841031	GE	On-Demand	Anodyne	NPY1R	35	49
O=C(Nc1cccc(CN2C(=O)CNC2=O)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841031	GE	On-Demand	Anodyne	CCKBR	50	37
O=C(Nc1nncs1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841042	CD	On-Demand	Anodyne	NR3C1	19	46
O=C(Nc1nncs1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841043	CD	On-Demand	Anodyne	NR3C1	19	46
O=C(Nc1nncs1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841044	CD	On-Demand	Anodyne	NR3C1	19	46
O=C(Nc1nncs1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841045	CD	On-Demand	Anodyne	NR3C1	19	46
Cc1cccc(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)n1	ZINC000853841067	CF	On-Demand	Anodyne	GRM5	18	46
Cc1cccc(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)n1	ZINC000853841068	CF	On-Demand	Anodyne	GRM5	18	46
Cc1cccc(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)n1	ZINC000853841069	CF	On-Demand	Anodyne	GRM5	18	46
Cc1cccc(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)n1	ZINC000853841070	CF	On-Demand	Anodyne	GRM5	18	46
COc1ncccc1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841104	CE	On-Demand	Anodyne	P2RY1	49	42
COc1ncccc1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841105	CE	On-Demand	Anodyne	P2RY1	49	42
COc1ncccc1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841106	CE	On-Demand	Anodyne	P2RY1	49	42
COc1ncccc1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841107	CE	On-Demand	Anodyne	P2RY1	49	42
CON(C)CCNC(=O)NCc1cc(O)nc2ccccc12	ZINC000853841108	DD	On-Demand	Anodyne	TACR3	40	37
CON(C)CCNC(=O)NCc1cc(O)nc2ccccc12	ZINC000853841108	DD	On-Demand	Anodyne	METG	61	32
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3C[C@H](O)c4ccccc43)cc2F)C[C@@H](C)O1	ZINC000853841132	GH	On-Demand	Anodyne	NPY2R	71	39
C[C@H]1CN(c2ccc(NC(=O)N[C@@H]3C[C@@H](O)c4ccccc43)cc2F)C[C@@H](C)O1	ZINC000853841134	GH	On-Demand	Anodyne	NPY2R	71	39
Cc1cccc(NC(=O)NN2CCc3ccccc3C2)n1	ZINC000853841149	CE	On-Demand	Anodyne	GRM5	17	44
Cc1cccc(NC(=O)NN2CCc3ccccc3C2)n1	ZINC000853841149	CE	On-Demand	Anodyne	SORT1	16	40
O=C(NN1CCc2ccccc2C1)OCC(F)(F)F	ZINC000853841169	CE	On-Demand	Anodyne	NOD2	41	38
O=C(Nc1nc2c(s1)CCCCC2)NN1CCc2ccccc2C1	ZINC000853841170	EH	On-Demand	Anodyne	SLC27A1	38	42
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841176	GG	On-Demand	Anodyne	CCKAR	49	44
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841176	GG	On-Demand	Anodyne	CCKBR	84	44
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841177	GG	On-Demand	Anodyne	CCKAR	49	44
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841177	GG	On-Demand	Anodyne	CCKBR	84	44
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841178	GG	On-Demand	Anodyne	CCKAR	49	44
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841178	GG	On-Demand	Anodyne	CCKBR	84	44
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841179	GG	On-Demand	Anodyne	CCKAR	49	44
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841179	GG	On-Demand	Anodyne	CCKBR	84	44
O=C(NN1CCc2ccccc2C1)N1CCCCC1	ZINC000853841240	CE	On-Demand	Anodyne	LIPE	16	51
COC(=O)c1ccc(C)c(NC(=O)NN2CCc3ccccc3C2)c1	ZINC000853841267	EF	On-Demand	Anodyne	NOD2	43	38
Cc1cccc(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1C	ZINC000853841272	CH	On-Demand	Anodyne	TRPV1	17	43
Cc1cccc(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1C	ZINC000853841273	CH	On-Demand	Anodyne	TRPV1	17	43
Cc1cccc(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1C	ZINC000853841274	CH	On-Demand	Anodyne	TRPV1	17	43
Cc1cccc(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1C	ZINC000853841275	CH	On-Demand	Anodyne	TRPV1	17	43
O=C(Nc1ccc2c(c1)OCCO2)NN1CCc2ccccc2C1	ZINC000853841287	EF	On-Demand	Anodyne	TRPC6	22	43
O=C(Nc1ccc2c(c1)OCCO2)NN1CCc2ccccc2C1	ZINC000853841287	EF	On-Demand	Anodyne	TRPC3	19	43
O=C(NN1CCc2ccccc2C1)C(F)(F)C(=O)N1CCOCC1	ZINC000853841322	EC	On-Demand	Anodyne	AKR1C3	17	43
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841346	FF	On-Demand	Anodyne	CCKAR	32	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841346	FF	On-Demand	Anodyne	CCKBR	48	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841347	FF	On-Demand	Anodyne	CCKAR	32	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841347	FF	On-Demand	Anodyne	CCKBR	48	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841348	FF	On-Demand	Anodyne	CCKAR	32	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841348	FF	On-Demand	Anodyne	CCKBR	48	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841349	FF	On-Demand	Anodyne	CCKAR	32	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841349	FF	On-Demand	Anodyne	CCKBR	48	40
Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)CSC(C)(C)C	ZINC000853841351	DG	On-Demand	Anodyne	AMP1_PLAFQ	15	43
Cc1ccccc1CNC(=O)[C@H](C)OC(=O)CSC(C)(C)C	ZINC000853841352	DG	On-Demand	Anodyne	AMP1_PLAFQ	15	43
CC(C)(C)OC(=O)C(=O)NN1CCc2ccccc2C1	ZINC000853841374	CD	On-Demand	Anodyne	AKR1C3	45	40
CC(C)(C)OC(=O)C(=O)NN1CCc2ccccc2C1	ZINC000853841374	CD	On-Demand	Anodyne	NOD2	41	34
CC(=O)c1c[nH]c(C(=O)NN2CCc3ccccc3C2)c1	ZINC000853841386	CD	On-Demand	Anodyne	AKR1C3	22	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCOc2ccccc21	ZINC000853841409	FG	On-Demand	Anodyne	BIRC3	53	39
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCOc2ccccc21	ZINC000853841410	FG	On-Demand	Anodyne	BIRC3	53	39
CN1CCN(c2ccccc2NC(=O)NN2CCc3ccccc3C2)CC1	ZINC000853841415	FF	On-Demand	Anodyne	HTR7	23	40
CN1CCN(c2ccccc2NC(=O)NN2CCc3ccccc3C2)CC1	ZINC000853841415	FF	On-Demand	Anodyne	KCNQ2	78	44
COCCOc1ccc(NC(=O)NN2CCc3ccccc3C2)cn1	ZINC000853841418	EE	On-Demand	Anodyne	NOD1	17	40
COCCOc1ccc(NC(=O)NN2CCc3ccccc3C2)cn1	ZINC000853841418	EE	On-Demand	Anodyne	NOD2	45	40
c1ccc(O[C@@H]2C[C@@H](Nc3nccc(N4CCCC4)n3)C2)cc1	ZINC000853841420	DG	On-Demand	Anodyne	MAPK9	35	45
c1ccc(O[C@@H]2C[C@@H](Nc3nccc(N4CCCC4)n3)C2)cc1	ZINC000853841420	DG	On-Demand	Anodyne	MAPK8	37	45
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N1CCCC1	ZINC000853841426	BD	On-Demand	Anodyne	EPHX2	22	54
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N1CCCC1	ZINC000853841426	BD	On-Demand	Anodyne	RBP4	63	37
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N1CCCC1	ZINC000853841427	BD	On-Demand	Anodyne	EPHX2	22	54
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N1CCCC1	ZINC000853841427	BD	On-Demand	Anodyne	RBP4	63	37
O=C(N[C@H]1C[C@H](O)c2ccccc21)N1CCCC1	ZINC000853841428	BD	On-Demand	Anodyne	EPHX2	22	54
O=C(N[C@H]1C[C@H](O)c2ccccc21)N1CCCC1	ZINC000853841428	BD	On-Demand	Anodyne	RBP4	63	37
O=C(NN1CCc2ccccc2C1)N1CCCC1	ZINC000853841430	BD	On-Demand	Anodyne	LIPE	15	57
Cc1nnc(NC(=O)NN2CCc3ccccc3C2)s1	ZINC000853841448	CD	On-Demand	Anodyne	NOD2	40	34
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841453	FE	On-Demand	Anodyne	STAT6	54	35
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841454	FE	On-Demand	Anodyne	STAT6	54	35
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841455	FE	On-Demand	Anodyne	STAT6	54	35
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841456	FE	On-Demand	Anodyne	STAT6	54	35
Cc1nc(NC(=O)NN2CCc3ccccc3C2)oc1C	ZINC000853841459	CE	On-Demand	Anodyne	NOD2	40	35
COC(=O)N(C)CCNC(=O)NCc1cc(O)nc2ccccc12	ZINC000853841482	ED	On-Demand	Anodyne	METG	53	32
O=C(Nc1ccc(CN2C(=O)CNC2=O)cc1)NN1CCc2ccccc2C1	ZINC000853841490	GD	On-Demand	Anodyne	NOD1	21	48
O=C(Nc1ccc(CN2C(=O)CNC2=O)cc1)NN1CCc2ccccc2C1	ZINC000853841490	GD	On-Demand	Anodyne	NOD2	54	45
COc1ncccc1NC(=O)NN1CCc2ccccc2C1	ZINC000853841498	CE	On-Demand	Anodyne	P2RY1	49	40
O=C(Nc1nc(C(F)(F)F)cs1)NN1CCc2ccccc2C1	ZINC000853841501	EG	On-Demand	Anodyne	TRPM8	28	48
COc1ccc(N2CC[C@H](NC(=O)NCCc3nnc4n3CCC4)C2)cc1	ZINC000853841516	FD	On-Demand	Clean	MTNR1A	22	41
COc1ccc(N2CC[C@H](NC(=O)NCCc3nnc4n3CCC4)C2)cc1	ZINC000853841516	FD	On-Demand	Clean	MTNR1B	17	41
O=C(Nc1nc2c(s1)CCCC2)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841544	EG	On-Demand	Anodyne	SLC27A1	34	45
O=C(Nc1nc2c(s1)CCCC2)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841545	EG	On-Demand	Anodyne	SLC27A1	34	45
O=C(Nc1nc2c(s1)CCCC2)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841546	EG	On-Demand	Anodyne	SLC27A1	34	45
O=C(Nc1nc2c(s1)CCCC2)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841547	EG	On-Demand	Anodyne	SLC27A1	34	45
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)CSC(C)(C)C)cc1	ZINC000853841580	FH	On-Demand	Anodyne	LTA4H	15	42
CCn1cc(NC(=O)NN2CCc3ccccc3C2)cn1	ZINC000853841585	CD	On-Demand	Anodyne	NOD2	43	37
Cn1ccnc1C(=O)NN1CCc2ccccc2C1	ZINC000853841596	CD	On-Demand	Anodyne	NOD2	40	34
CCCCCNC(=O)[C@@H](C)OC(=O)CSC(C)(C)C	ZINC000853841616	CF	On-Demand	Anodyne	ASAH1	65	30
CCCCCNC(=O)[C@H](C)OC(=O)CSC(C)(C)C	ZINC000853841617	CF	On-Demand	Anodyne	ASAH1	65	30
O=C(Nc1ccc(N2CCOCC2)cn1)NN1CCc2ccccc2C1	ZINC000853841624	FE	On-Demand	Anodyne	STAT6	53	35
NC(=O)c1cc(=N[C@@H]2C[C@@H](Oc3ccccc3)C2)cc[nH]1	ZINC000853841631	CD	On-Demand	Anodyne	KCNH2	41	39
Cc1cc(C)cc(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853841637	CH	On-Demand	Anodyne	CCKAR	27	43
Cc1cc(C)cc(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853841637	CH	On-Demand	Anodyne	CCKBR	39	43
Cc1cc(C)cc(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853841638	CH	On-Demand	Anodyne	CCKAR	27	43
Cc1cc(C)cc(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853841638	CH	On-Demand	Anodyne	CCKBR	39	43
Cc1cc(C)cc(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853841639	CH	On-Demand	Anodyne	CCKAR	27	43
Cc1cc(C)cc(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853841639	CH	On-Demand	Anodyne	CCKBR	39	43
Cc1cc(C)cc(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853841640	CH	On-Demand	Anodyne	CCKAR	27	43
Cc1cc(C)cc(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853841640	CH	On-Demand	Anodyne	CCKBR	39	43
CCCn1nccc1NC(=O)NN1CCc2ccccc2C1	ZINC000853841680	CE	On-Demand	Anodyne	NOD2	41	36
O=C(Nc1nc2c(s1)CCC2)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841704	DF	On-Demand	Anodyne	SLC27A1	32	43
O=C(Nc1nc2c(s1)CCC2)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841705	DF	On-Demand	Anodyne	SLC27A1	32	43
O=C(Nc1nc2c(s1)CCC2)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841706	DF	On-Demand	Anodyne	SLC27A1	32	43
O=C(Nc1nc2c(s1)CCC2)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841707	DF	On-Demand	Anodyne	SLC27A1	32	43
CS(=O)(=O)c1ccc(NC(=O)NN2CCc3ccccc3C2)cn1	ZINC000853841710	ED	On-Demand	Anodyne	NOD2	40	34
C[C@H]1CN(c2ccc(NC(=O)NCCCOC(C)(C)C)cc2F)C[C@@H](C)O1	ZINC000853841722	GH	On-Demand	Anodyne	NPY2R	59	36
C[C@H]1CN(c2ccc(NC(=O)NCCCOC(C)(C)C)cc2F)C[C@H](C)O1	ZINC000853841723	GH	On-Demand	Anodyne	NPY2R	59	36
CCn1cc(C(=O)C(=O)NN2CCc3ccccc3C2)cn1	ZINC000853841727	CD	On-Demand	Anodyne	NOD2	41	35
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N1CCOCC1	ZINC000853841764	CD	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N1CCOCC1	ZINC000853841764	CD	On-Demand	Anodyne	RBP4	49	34
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N1CCOCC1	ZINC000853841765	CD	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N1CCOCC1	ZINC000853841765	CD	On-Demand	Anodyne	RBP4	49	34
O=C(N[C@H]1C[C@H](O)c2ccccc21)N1CCOCC1	ZINC000853841766	CD	On-Demand	Anodyne	EPHX2	25	41
O=C(N[C@H]1C[C@H](O)c2ccccc21)N1CCOCC1	ZINC000853841766	CD	On-Demand	Anodyne	RBP4	49	34
O=C(Nc1ccc2c(c1)OCCO2)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841769	EF	On-Demand	Anodyne	NPY1R	16	45
O=C(Nc1ccc2c(c1)OCCO2)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841770	EF	On-Demand	Anodyne	NPY1R	16	45
O=C(Nc1ccc2c(c1)OCCO2)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841771	EF	On-Demand	Anodyne	NPY1R	16	45
O=C(Nc1ccc2c(c1)OCCO2)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841772	EF	On-Demand	Anodyne	NPY1R	16	45
O=C(Nc1ccc(N2CCCC2)nc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841775	EF	On-Demand	Anodyne	DGAT1	44	41
O=C(Nc1ccc(N2CCCC2)nc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841776	EF	On-Demand	Anodyne	DGAT1	44	41
O=C(Nc1ccc(N2CCCC2)nc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841777	EF	On-Demand	Anodyne	DGAT1	44	41
O=C(Nc1ccc(N2CCCC2)nc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841778	EF	On-Demand	Anodyne	DGAT1	44	41
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)NN1CCc2ccccc2C1	ZINC000853841779	FF	On-Demand	Anodyne	CCKBR	45	37
O=C(Nc1nc(C(F)(F)F)cs1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853841808	EG	On-Demand	Anodyne	RBP4	44	31
O=C(Nc1nc(C(F)(F)F)cs1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853841809	EG	On-Demand	Anodyne	RBP4	44	31
O=C(Nc1nc(C(F)(F)F)cs1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853841810	EG	On-Demand	Anodyne	RBP4	44	31
O=C(Nc1nc(C(F)(F)F)cs1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853841811	EG	On-Demand	Anodyne	RBP4	44	31
O=C(NCc1cc(O)nc2ccccc12)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853841812	FD	On-Demand	Anodyne	PDE11A	46	31
O=C(NCc1cc(O)nc2ccccc12)N1CC[C@H](N2CCOC2=O)C1	ZINC000853841813	FD	On-Demand	Anodyne	PDE11A	46	31
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853841826	GE	On-Demand	Anodyne	NPY1R	32	42
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853841827	GE	On-Demand	Anodyne	NPY1R	32	42
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853841828	GE	On-Demand	Anodyne	NPY1R	32	42
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853841829	GE	On-Demand	Anodyne	NPY1R	32	42
CC(=O)c1cc(C(=O)NN2CCc3ccccc3C2)n(C)c1	ZINC000853841841	CD	On-Demand	Anodyne	AKR1C3	28	41
CC(=O)c1cc(C(=O)NN2CCc3ccccc3C2)n(C)c1	ZINC000853841841	CD	On-Demand	Anodyne	NOD2	41	34
O=C(Nc1nc2c(s1)CCCC2)NN1CCc2ccccc2C1	ZINC000853841848	EG	On-Demand	Anodyne	SLC27A1	41	49
Cc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)CSC(C)(C)C	ZINC000853841853	EH	On-Demand	Anodyne	CTSA	48	34
Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)CSC(C)(C)C	ZINC000853841854	EH	On-Demand	Anodyne	CTSA	48	34
Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)CSC(C)(C)C	ZINC000853841855	EH	On-Demand	Anodyne	CTSA	48	34
Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)CSC(C)(C)C	ZINC000853841856	EH	On-Demand	Anodyne	CTSA	48	34
O=C(N[C@H]1C[C@H](O)c2ccccc21)N1CCCCC1	ZINC000853841862	CE	On-Demand	Anodyne	EPHX2	22	56
O=C(N[C@H]1C[C@H](O)c2ccccc21)N1CCCCC1	ZINC000853841862	CE	On-Demand	Anodyne	RBP4	61	36
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N1CCCCC1	ZINC000853841863	CE	On-Demand	Anodyne	EPHX2	22	56
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N1CCCCC1	ZINC000853841863	CE	On-Demand	Anodyne	RBP4	61	36
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N1CCCCC1	ZINC000853841864	CE	On-Demand	Anodyne	EPHX2	22	56
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N1CCCCC1	ZINC000853841864	CE	On-Demand	Anodyne	RBP4	61	36
CN1CCN(c2ccccc2NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853841870	FF	On-Demand	Anodyne	KCNQ2	76	43
CN1CCN(c2ccccc2NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853841871	FF	On-Demand	Anodyne	KCNQ2	76	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853841872	FF	On-Demand	Anodyne	KCNQ2	76	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853841873	FF	On-Demand	Anodyne	KCNQ2	76	43
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(O)nc4ccccc34)C2)cc1	ZINC000853841879	GG	On-Demand	Clean	ADAM17	71	41
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(O)nc4ccccc34)C2)cc1	ZINC000853841879	GG	On-Demand	Clean	MTNR1A	30	49
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(O)nc4ccccc34)C2)cc1	ZINC000853841879	GG	On-Demand	Clean	MTNR1B	24	49
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(O)nc4ccccc34)C2)cc1	ZINC000853841879	GG	On-Demand	Clean	MCHR1	20	44
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(O)nc4ccccc34)C2)cc1	ZINC000853841879	GG	On-Demand	Clean	TNKS	45	31
COc1ccc(N2CC[C@H](NC(=O)NCc3cc(O)nc4ccccc34)C2)cc1	ZINC000853841879	GG	On-Demand	Clean	NPBWR1	42	32
O=C(NN1CCc2ccccc2C1)N1CCOCC1	ZINC000853841881	CD	On-Demand	Anodyne	AKR1C3	26	48
CS(=O)(=O)C1(CNC(=O)Nc2ccc(Cl)nc2)CCCCC1	ZINC000853841939	EF	On-Demand	Anodyne	NAMPT	37	46
Cc1cc(C)c2c(O)nc(SCC(=O)Nc3ccc(N4CCOCC4)cc3)nc2n1	ZINC000853841948	IF	On-Demand	Anodyne	MTOR	47	37
Cc1cc(C)c2c(O)nc(SCC(=O)Nc3ccc(N4CCOCC4)cc3)nc2n1	ZINC000853841948	IF	On-Demand	Anodyne	STAT6	51	31
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)c1	ZINC000853841950	GE	On-Demand	Reactive	DRD4	24	43
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)c1	ZINC000853841950	GE	On-Demand	Reactive	SIGMAR1	18	42
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)c1	ZINC000853841950	GE	On-Demand	Reactive	CCKAR	39	44
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)c1	ZINC000853841950	GE	On-Demand	Reactive	CCKBR	65	43
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)c1	ZINC000853841950	GE	On-Demand	Reactive	KCNK3	47	35
O=C(NC[C@@H]1C[C@H](c2ccccc2)CO1)N1CCCCC1	ZINC000853841965	CF	On-Demand	Anodyne	EPHX2	27	47
Cn1ccnc1C(=O)NCC1(S(C)(=O)=O)CCCCC1	ZINC000853841968	CC	On-Demand	Anodyne	HCN1	51	32
Cn1ccnc1C(=O)NCC1(S(C)(=O)=O)CCCCC1	ZINC000853841968	CC	On-Demand	Anodyne	HCN4	49	32
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1ccc(C(F)(F)F)cc1	ZINC000853841970	GE	On-Demand	Reactive	EPHX2	32	40
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1ccc(C(F)(F)F)cc1	ZINC000853841970	GE	On-Demand	Reactive	TRPM8	40	38
O=C(NCc1ccc(Cl)c(Cl)c1)C(F)(F)C(=O)N1CCOCC1	ZINC000853841972	FE	On-Demand	Anodyne	RPA1	54	32
C=CCOCCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853841976	FG	On-Demand	Mild	NPY2R	47	36
C=CCOCCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853841976	FG	On-Demand	Mild	CCR3	30	40
C=CCOCCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853841977	FG	On-Demand	Mild	NPY2R	47	36
C=CCOCCCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853841977	FG	On-Demand	Mild	CCR3	30	40
C=CCOCCCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853841978	FG	On-Demand	Mild	NPY2R	47	36
C=CCOCCCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853841978	FG	On-Demand	Mild	CCR3	30	40
CC(C)(C)OC(=O)C(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853841985	DD	On-Demand	Anodyne	SLC6A3	17	43
O=C(NCc1ccc(Cl)c(Cl)c1)C(=O)C1CCSCC1	ZINC000853841986	EG	On-Demand	Anodyne	SSTR3	15	44
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1ccccc1Cl	ZINC000853841993	FD	On-Demand	Reactive	EPHB3	44	36
COCc1csc(CNC(=O)Nc2ccccc2N2CCN(C)CC2)c1	ZINC000853842000	FF	On-Demand	Anodyne	KCNQ2	73	38
C=CCOCCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853842003	FG	On-Demand	Mild	HRH2	26	43
C=CCOCCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853842003	FG	On-Demand	Mild	MTNR1A	21	40
C=CCOCCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853842003	FG	On-Demand	Mild	SCD1	39	43
C=CCOCCCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853842003	FG	On-Demand	Mild	SCD	38	47
N#Cc1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853842006	FD	On-Demand	Reactive	CCR3	17	44
Cc1cc(C)cc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)c1	ZINC000853842012	GF	On-Demand	Reactive	DRD4	23	42
Cc1cc(C)cc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)c1	ZINC000853842012	GF	On-Demand	Reactive	SIGMAR1	18	41
O=C(NC[C@@H]1CCC[C@H]2C[C@H]21)Nc1cccnc1Cl	ZINC000853842015	CG	On-Demand	Anodyne	G2YM83_BOTF4	67	35
Cc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842027	CF	On-Demand	Anodyne	CCKAR	23	43
Cc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842027	CF	On-Demand	Anodyne	EPHX2	19	44
Cc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842027	CF	On-Demand	Anodyne	KCNK3	50	35
Cc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842027	CF	On-Demand	Anodyne	KCNK9	40	35
C=CCOCCCNC(=O)Nc1ccc(N(CC)C(C)C)cc1	ZINC000853842032	DH	On-Demand	Mild	DOT1L	40	30
Cc1nc(O)cc(-c2ccc(NC(=O)NC[C@]34OCCC[C@H]3C4(F)F)cc2)n1	ZINC000853842050	GG	On-Demand	Anodyne	MTOR	51	35
CN1CCN(c2ccccc2NC(=O)NCCc2ccoc2)CC1	ZINC000853842056	EE	On-Demand	Anodyne	KCNQ2	77	41
C=CCOCCCNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853842084	EH	On-Demand	Mild	PIK3CG	19	46
C=CCOCCCNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853842084	EH	On-Demand	Mild	PI4KB	39	43
CC(C)(C)OC(=O)C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000853842094	DF	On-Demand	Anodyne	DNAE	87	36
CC(C)(C)OC(=O)C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000853842094	DF	On-Demand	Anodyne	PTGES	18	40
CC(C)(C)OC(=O)C(=O)NCc1ccc(Cl)c(Cl)c1	ZINC000853842094	DF	On-Demand	Anodyne	RPA1	45	32
Cc1nc(NC(=O)NNC(=O)[C@H]2CN(Cc3ccccc3)C[C@@H](C)O2)oc1C	ZINC000853842099	GD	On-Demand	Reactive	PDE8B	50	30
C=CCOCCCNC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853842106	DE	On-Demand	Mild	HRH2	22	42
O=C(NCc1cn(-c2ccccc2)nn1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853842116	DC	On-Demand	Anodyne	AROQ	27	41
O=C(NCc1cn(-c2ccccc2)nn1)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853842117	ED	On-Demand	Anodyne	AROQ	27	40
O=C(NCc1cn(-c2ccccc2)nn1)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853842118	ED	On-Demand	Anodyne	AROQ	27	40
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1nccs1	ZINC000853842138	EC	On-Demand	Reactive	MAP1	73	34
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853842165	GE	On-Demand	Reactive	CCR3	31	52
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853842165	GE	On-Demand	Reactive	ITGA4	50	32
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853842165	GE	On-Demand	Reactive	MLNR	21	41
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853842165	GE	On-Demand	Reactive	CCKBR	21	41
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853842165	GE	On-Demand	Reactive	MCHR1	35	41
Cc1cc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)nc(N)n1	ZINC000853842186	CD	On-Demand	Anodyne	HRH4	46	52
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2nccs2)O1	ZINC000853842189	GD	On-Demand	Reactive	MAP1	91	39
O=C(Nc1ccc(Cl)nc1)N[C@@H]1C[C@@H](Oc2ccccc2)C1	ZINC000853842202	DG	On-Demand	Anodyne	EPHX2	58	49
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1ccc(-c2ncon2)cc1	ZINC000853842213	GD	On-Demand	Reactive	MTOR	74	34
COc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842225	DF	On-Demand	Anodyne	CCR3	39	45
COc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842225	DF	On-Demand	Anodyne	MTNR1A	44	43
COc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842225	DF	On-Demand	Anodyne	MTNR1B	41	43
COc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842225	DF	On-Demand	Anodyne	EPHX2	32	47
COc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842225	DF	On-Demand	Anodyne	TAAR1	33	42
O=C(NC[C@@H]1CCC[C@H]2C[C@H]21)Nc1ccc(Cl)nc1	ZINC000853842238	CG	On-Demand	Anodyne	PRMT3	48	35
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)N2CCOCC2)O1	ZINC000853842252	FC	On-Demand	Reactive	SIGMAR1	33	40
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)CC1	ZINC000853842253	GG	On-Demand	Anodyne	HTR7	19	40
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)CC1	ZINC000853842253	GG	On-Demand	Anodyne	KCNQ2	76	45
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@@H](Oc3ccccc3)C2)CC1	ZINC000853842253	GG	On-Demand	Anodyne	EPHX2	31	40
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2ccc(F)cc2)O1	ZINC000853842254	GE	On-Demand	Reactive	DRD4	18	42
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2ccc(F)cc2)O1	ZINC000853842254	GE	On-Demand	Reactive	SIGMAR1	25	43
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2ccc(F)cc2)O1	ZINC000853842254	GE	On-Demand	Reactive	CCR3	51	41
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2ccc(F)cc2)O1	ZINC000853842254	GE	On-Demand	Reactive	MLNR	55	39
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2ccc(F)cc2)O1	ZINC000853842254	GE	On-Demand	Reactive	CACNA1G	28	40
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1nc2c(s1)CCCC2	ZINC000853842258	GD	On-Demand	Reactive	SLC27A1	30	40
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCC[C@@H]3C[C@H]23)CC1	ZINC000853842271	EF	On-Demand	Anodyne	KCNQ2	78	41
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCC[C@@H]3C[C@@H]23)CC1	ZINC000853842273	EF	On-Demand	Anodyne	KCNQ2	78	41
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCC[C@H]3C[C@@H]32)CC1	ZINC000853842275	EF	On-Demand	Anodyne	KCNQ2	78	41
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCC[C@H]3C[C@H]32)CC1	ZINC000853842277	EF	On-Demand	Anodyne	KCNQ2	78	41
N#Cc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842278	DE	On-Demand	Mild	CCR3	28	46
N#Cc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842278	DE	On-Demand	Mild	MCHR1	34	43
O=C(NC[C@@H]1CCC[C@H]2C[C@H]21)Nc1ccc2oc(=O)ccc2c1	ZINC000853842284	DG	On-Demand	Anodyne	PRMT3	40	35
CC(=O)Nc1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853842289	GD	On-Demand	Reactive	CCKBR	43	33
O=C(N1CC[C@H](c2ccccc2)[C@H](CO)C1)C(F)(F)c1ccccc1F	ZINC000853842306	FH	On-Demand	Anodyne	RBP4	41	36
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853842314	FH	On-Demand	Mild	VIPR1	28	44
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1cccnc1Cl	ZINC000853842322	FD	On-Demand	Reactive	G2YM83_BOTF4	57	32
CN1CCN(c2ccccc2NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)CC1	ZINC000853842382	GE	On-Demand	Anodyne	KCNQ2	75	39
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H]2CS(C)(=O)=O)CC1	ZINC000853842388	GD	On-Demand	Anodyne	KCNQ2	77	40
Cn1ncc(C2CC2)c1CNC(=O)Nc1ccc(Cl)nc1	ZINC000853842389	DF	On-Demand	Anodyne	NAMPT	27	41
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	CA1	27	41
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	PRNP	34	41
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	ROCK2	22	49
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	EPHX2	34	43
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	SLC1A2	18	40
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	NCE103	18	43
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	DGAT1	19	40
C[C@@]1(CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1(F)F	ZINC000853842427	DJ	On-Demand	Anodyne	P96878_MYCTU	16	40
CCCCCCCCCCNC(=O)N1CCn2c(O)nnc2C1	ZINC000853842450	DF	On-Demand	Mild	ASAH1	99	39
Cn1cc(CCNC(=O)C(=O)C2CCSCC2)c2ccccc21	ZINC000853842456	EF	On-Demand	Anodyne	MTNR1A	17	41
Cc1nsc(C(=O)NCCc2cn(C)c3ccccc23)n1	ZINC000853842471	DE	On-Demand	Anodyne	NQO2	24	42
Cn1cc(CCNC(=O)N2CCCCC2)c2ccccc21	ZINC000853842490	CF	On-Demand	Anodyne	MTNR1A	26	45
Cn1cc(CCNC(=O)N2CCCCC2)c2ccccc21	ZINC000853842490	CF	On-Demand	Anodyne	MTNR1B	22	45
NS(=O)(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842522	FD	On-Demand	Anodyne	CA2	26	48
NS(=O)(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842522	FD	On-Demand	Anodyne	CA1	20	41
NS(=O)(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842522	FD	On-Demand	Anodyne	CA4	26	47
NS(=O)(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842522	FD	On-Demand	Anodyne	CA12	20	48
NS(=O)(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842522	FD	On-Demand	Anodyne	CA9	21	48
NS(=O)(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842522	FD	On-Demand	Anodyne	P96878_MYCTU	43	38
CC(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842544	DF	On-Demand	Anodyne	CCR3	21	40
CC(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842544	DF	On-Demand	Anodyne	EPHX2	22	42
C=CCOCCCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853842558	EE	On-Demand	Mild	DRD2	40	38
C=CCOCCCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853842558	EE	On-Demand	Mild	DRD3	60	38
C=CCOCCCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853842558	EE	On-Demand	Mild	KCNQ2	74	38
O=[N+]([O-])c1ccc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)c2nonc12	ZINC000853842559	FF	On-Demand	Bother	GSTM2	110	40
O=[N+]([O-])c1ccc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)c2nonc12	ZINC000853842559	FF	On-Demand	Bother	GSTP1	68	40
COCc1csc(CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)c1	ZINC000853842562	FG	On-Demand	Bother	CACNA1C	53	40
COCc1csc(CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)c1	ZINC000853842562	FG	On-Demand	Bother	CACNA1D	83	38
COC(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842571	EE	On-Demand	Anodyne	CCR3	35	41
COC(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842571	EE	On-Demand	Anodyne	EPHX2	25	48
OC[C@@H]1CN(c2nccc(N3CCCC3)n2)CC[C@@H]1c1ccccc1	ZINC000853842575	EF	On-Demand	Anodyne	SORD	69	37
COc1ccc2c(N3CC[C@H](c4ccccc4)[C@H](CO)C3)ccnc2c1	ZINC000853842578	EH	On-Demand	Anodyne	PDE3B	42	35
N#Cc1ncc(C(F)(F)F)cc1N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853842590	FH	On-Demand	Mild	LIPG	47	38
CC[C@@H](O)CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853842608	DD	On-Demand	Anodyne	KCNQ2	95	50
CC[C@@H](O)CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853842608	DD	On-Demand	Anodyne	NPY2R	54	38
O=C(NCc1cn(-c2ccccc2)nn1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853842612	FD	On-Demand	Anodyne	CPT1A	114	46
O=C(NCc1cn(-c2ccccc2)nn1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853842614	FD	On-Demand	Anodyne	CPT1A	114	46
O=C(NC[C@@H]1C[C@H](c2ccccc2)CO1)Nc1ccc(Cl)nc1	ZINC000853842618	EG	On-Demand	Anodyne	NAMPT	19	45
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2C[C@H](c3ccccc3)CO2)CC1	ZINC000853842627	GG	On-Demand	Anodyne	KCNQ2	72	38
C[C@H]1CN(c2ccc(NC(=O)NCCC(C)(C)F)cc2F)C[C@@H](C)O1	ZINC000853842632	FH	On-Demand	Anodyne	NPY2R	70	37
C[C@H]1CN(c2ccc(NC(=O)NCCC(C)(C)F)cc2F)C[C@H](C)O1	ZINC000853842635	FH	On-Demand	Anodyne	NPY2R	70	37
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1ccc2c(c1)OCO2	ZINC000853842636	FC	On-Demand	Reactive	NOS2	50	32
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)CSC(C)(C)C)CC2)cc1	ZINC000853842644	IE	On-Demand	Anodyne	TGM2	49	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)CSC(C)(C)C)CC2)cc1	ZINC000853842644	IE	On-Demand	Anodyne	F13A1	55	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)CSC(C)(C)C)CC2)cc1	ZINC000853842646	IE	On-Demand	Anodyne	TGM2	49	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)CSC(C)(C)C)CC2)cc1	ZINC000853842646	IE	On-Demand	Anodyne	F13A1	55	38
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2ccc(C#N)cc2)O1	ZINC000853842651	GE	On-Demand	Reactive	CCR3	16	40
C[C@@]1(CNC(=O)NNc2nc3ccc(Cl)cc3s2)CCCO1	ZINC000853842669	EG	On-Demand	Reactive	CSNK1D	36	42
O=C(N1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853842678	CE	On-Demand	Anodyne	SLC6A1	49	33
O=C(N1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853842678	CE	On-Demand	Anodyne	SLC6A3	18	46
O=C(N1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853842678	CE	On-Demand	Anodyne	CCR5	36	45
O=C(N1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853842678	CE	On-Demand	Anodyne	PREP	37	42
O=C(N1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853842678	CE	On-Demand	Anodyne	L3MBTL3	42	35
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@@H]1C[C@@H](Oc2ccccc2)C1	ZINC000853842693	FG	On-Demand	Anodyne	EPHX2	50	42
C[C@@H](CCNC(=O)NCCC1CCC1)N(C)C	ZINC000853842739	BD	On-Demand	Anodyne	CHRNA4	21	43
CCCCCCCCCCNC(=O)N1CCC2(COC2)C1	ZINC000853842752	CH	On-Demand	Mild	ASAH1	99	41
C[C@H]1CN(c2ccc(NC(=O)NCC[C@]3(C)CC3(F)F)cc2F)C[C@@H](C)O1	ZINC000853842787	GH	On-Demand	Anodyne	NPY2R	60	38
C[C@H]1CN(c2ccc(NC(=O)NCC[C@@]3(C)CC3(F)F)cc2F)C[C@@H](C)O1	ZINC000853842790	GH	On-Demand	Anodyne	NPY2R	60	38
CN1CCN(c2ccccc2NC(=O)NCC[C@@]2(C)CC2(F)F)CC1	ZINC000853842802	FF	On-Demand	Anodyne	DRD3	54	37
CN1CCN(c2ccccc2NC(=O)NCC[C@@]2(C)CC2(F)F)CC1	ZINC000853842802	FF	On-Demand	Anodyne	KCNQ2	78	39
CN1CCN(c2ccccc2NC(=O)NCC[C@]2(C)CC2(F)F)CC1	ZINC000853842806	FF	On-Demand	Anodyne	DRD3	54	37
CN1CCN(c2ccccc2NC(=O)NCC[C@]2(C)CC2(F)F)CC1	ZINC000853842806	FF	On-Demand	Anodyne	KCNQ2	78	39
Cc1nc(C(=O)NCCc2cn(C)c3ccccc23)no1	ZINC000853842835	CD	On-Demand	Anodyne	NQO2	19	41
C[C@@]1(CNC(=O)Nc2cccnc2Cl)CC1(F)F	ZINC000853842874	CF	On-Demand	Anodyne	G2YM83_BOTF4	79	40
CCCCCCCCCCNC(=O)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853842876	FG	On-Demand	Mild	ASAH1	92	37
CCCCCCCCCCNC(=O)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853842877	FG	On-Demand	Mild	ASAH1	92	37
CC(=O)Nc1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853842888	EF	On-Demand	Anodyne	EPHX2	23	42
CCCCCCCCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853842897	EI	On-Demand	Mild	CPT1A	70	36
CCCCCCCCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853842897	EI	On-Demand	Mild	ASAH1	102	39
CCCCCCCCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853842898	EI	On-Demand	Mild	CPT1A	70	36
CCCCCCCCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853842898	EI	On-Demand	Mild	ASAH1	102	39
CCCCCCCCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853842901	CG	On-Demand	Mild	EPHX2	15	40
CCCCCCCCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853842901	CG	On-Demand	Mild	ASAH1	99	38
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2ccccc2F)O1	ZINC000853842912	GE	On-Demand	Reactive	SIGMAR1	18	41
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	CA2	70	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	CA1	64	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	CA4	56	47
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	CA12	54	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	CA9	56	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	NCE103	23	43
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	MTCA1	53	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)cc1	ZINC000853842918	FD	On-Demand	Anodyne	P96878_MYCTU	67	48
C=CCOCCCNC(=O)Nc1cccnc1Cl	ZINC000853842923	CE	On-Demand	Mild	G2YM83_BOTF4	64	32
COc1ccccc1NC(=O)NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H](C)O1	ZINC000853842935	GE	On-Demand	Reactive	DRD4	25	42
COc1ccccc1NC(=O)NNC(=O)[C@@H]1CN(Cc2ccccc2)C[C@H](C)O1	ZINC000853842935	GE	On-Demand	Reactive	SIGMAR1	17	45
Cc1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853842946	ED	On-Demand	Reactive	CCKBR	58	40
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	DRD4	30	40
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	HRH2	38	45
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	SIGMAR1	21	46
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	CCKAR	24	41
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	CCR3	38	49
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	CCKBR	42	41
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	EPHX2	21	40
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(Cc3ccccc3)C[C@H](C)O2)c1	ZINC000853842947	GE	On-Demand	Reactive	NPFFR1	15	45
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1ccc(Cl)cn1	ZINC000853842950	FD	On-Demand	Reactive	F10	36	40
C[C@H]1CN(c2ccc(NC(=O)NCCc3ccoc3)cc2F)C[C@H](C)O1	ZINC000853842951	FG	On-Demand	Anodyne	NPY2R	59	35
C[C@H]1CN(c2ccc(NC(=O)NCCc3ccoc3)cc2F)C[C@@H](C)O1	ZINC000853842952	FG	On-Demand	Anodyne	NPY2R	59	35
O=C(NNC(=O)[C@@H]1OCC[C@@H]1Cn1cccn1)Nc1ccccc1C(F)(F)F	ZINC000853842954	GE	On-Demand	Reactive	RBP4	49	36
C=CCOCCCNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853842956	EE	On-Demand	Mild	CACNA1D	43	36
Cn1ccnc1C(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853842996	CD	On-Demand	Anodyne	CCR5	19	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853843047	FH	On-Demand	Anodyne	KCNQ2	17	48
CN1CCN(c2ccccc2NC(=O)NCCC(C)(C)F)CC1	ZINC000853843052	DF	On-Demand	Anodyne	DRD2	32	41
CN1CCN(c2ccccc2NC(=O)NCCC(C)(C)F)CC1	ZINC000853843052	DF	On-Demand	Anodyne	DRD3	50	41
CN1CCN(c2ccccc2NC(=O)NCCC(C)(C)F)CC1	ZINC000853843052	DF	On-Demand	Anodyne	KCNQ2	82	42
CN1CCN(c2ccccc2NC(=O)NCCC(C)(C)F)CC1	ZINC000853843052	DF	On-Demand	Anodyne	P2RY1	45	39
Cc1nc(NC(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)sc1-c1ccccc1	ZINC000853843077	FH	On-Demand	Anodyne	PIK3CG	18	40
Cc1nc(NC(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)sc1-c1ccccc1	ZINC000853843078	FH	On-Demand	Anodyne	PIK3CG	18	40
CC[C@@H](O)CNC(=O)Nc1cc2oc3ccccc3c2cc1OC	ZINC000853843086	EG	On-Demand	Anodyne	ECE1	17	41
CCCCCCCCCCNC(=O)N1CCC(O)(CO)CC1	ZINC000853843180	DF	On-Demand	Mild	ASAH1	100	38
CCCCCCCCCCNC(=O)N1C[C@@H](C)O[C@@H](c2nnc(C)o2)C1	ZINC000853843202	FH	On-Demand	Mild	ASAH1	87	34
Cc1nc(C(=O)NCCCC2CCC2)no1	ZINC000853843211	BD	On-Demand	Anodyne	BMP1	75	49
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	CHRM2	18	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	CHRM1	18	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	DRD2	18	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	DRD4	45	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	ACHE	41	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	CHRM3	25	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	LTA4H	23	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	SIGMAR1	42	47
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	CACNA1B	15	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	CCR3	34	44
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	UTS2R	22	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	CCR2	18	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	MCHR1	35	48
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	CACNA1G	29	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853843252	GF	On-Demand	Anodyne	BIRC2	46	46
CS(=O)(=O)C1(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCCC1	ZINC000853843258	FF	On-Demand	Bother	NMBR	46	30
O=C(NCCCC1CCC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853843262	DG	On-Demand	Anodyne	CCR3	53	41
O=C(NCCCC1CCC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853843262	DG	On-Demand	Anodyne	EPHX2	20	40
O=C(NCCC1CCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853843268	CG	On-Demand	Anodyne	CHRM3	24	43
O=C(NCCC1CCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853843268	CG	On-Demand	Anodyne	GRIN2B	31	41
O=C(NCCC1CCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853843268	CG	On-Demand	Anodyne	EPHX2	35	52
O=C(NCCC1CCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853843268	CG	On-Demand	Anodyne	SCD1	24	44
Cc1nc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)sc1-c1ccccc1	ZINC000853843298	GI	On-Demand	Anodyne	PIK3CG	20	40
CC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853843312	FD	On-Demand	Reactive	CCR3	23	41
CC(=O)c1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853843312	FD	On-Demand	Reactive	CCKBR	44	37
COc1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853843359	FD	On-Demand	Reactive	CCR3	22	42
COc1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853843359	FD	On-Demand	Reactive	CCKBR	36	40
COc1cccc(NC(=O)NNC(=O)[C@@H]2OCC[C@@H]2Cn2cccn2)c1	ZINC000853843359	FD	On-Demand	Reactive	LIMK2	20	40
O=C(NC[C@@H]1C[C@H](c2ccccc2)CO1)Nc1cccnc1Cl	ZINC000853843377	EG	On-Demand	Anodyne	G2YM83_BOTF4	65	33
Cc1nc(NC(=O)N(C)CC2=CCCOC2)sc1-c1ccccc1	ZINC000853843382	EH	On-Demand	Anodyne	PIK3CG	19	40
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	ROCK1	32	42
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	MTNR1A	29	40
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	MTNR1B	31	40
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	CDK5	16	40
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	LIMK1	16	40
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	SCD1	41	44
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	SCD	40	52
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	LIMK2	16	40
CC[C@@H](O)CNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853843394	EF	On-Demand	Anodyne	PDS	41	38
C[C@H]1CN(c2ccc(NC(=O)NC[C@]3(O)C[C@H]4C=C[C@H]3C4)cc2F)C[C@@H](C)O1	ZINC000853843397	GF	On-Demand	Anodyne	NPY2R	42	35
C[C@H]1CN(c2ccc(NC(=O)NC[C@@]3(O)C[C@H]4C=C[C@H]3C4)cc2F)C[C@@H](C)O1	ZINC000853843398	GF	On-Demand	Anodyne	NPY2R	42	35
CC[C@@H](O)CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853843399	DD	On-Demand	Bother	CACNA1C	49	37
CC[C@@H](O)CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853843399	DD	On-Demand	Bother	CACNA1D	80	37
CC[C@@H](O)CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853843399	DD	On-Demand	Bother	PDS	38	45
CCCCCC(C)(C)CNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853843405	DH	On-Demand	Anodyne	CPT1A	77	35
CCCCCC(C)(C)CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853843406	DH	On-Demand	Anodyne	CPT1A	77	35
CCN1CC[C@H](N(CC)C(=O)NCc2cn(-c3ccccc3)nn2)C1	ZINC000853843430	ED	On-Demand	Anodyne	CCR5	29	50
CCN1CC[C@@H](N(CC)C(=O)NCc2cn(-c3ccccc3)nn2)C1	ZINC000853843431	ED	On-Demand	Anodyne	CCR5	29	50
O=C(NC[C@@]1(O)C[C@H]2C=C[C@H]1C2)Nc1ccc(Cl)nc1	ZINC000853843432	CE	On-Demand	Anodyne	EPHX2	20	44
O=C(NC[C@]1(O)C[C@H]2C=C[C@H]1C2)Nc1ccc(Cl)nc1	ZINC000853843433	CE	On-Demand	Anodyne	EPHX2	20	44
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	CHRM2	18	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	CHRM1	18	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	DRD2	18	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	DRD4	45	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	ACHE	41	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	CHRM3	25	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	LTA4H	23	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	SIGMAR1	42	47
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	CACNA1B	15	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	CCR3	34	44
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	UTS2R	22	41
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	CCR2	18	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	MCHR1	35	48
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	CACNA1G	29	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853843437	GF	On-Demand	Anodyne	BIRC2	46	46
O=C(NCc1cn(-c2ccccc2)nn1)N[C@H]1C[C@H](O)C1	ZINC000853843456	CC	On-Demand	Anodyne	AROQ	35	45
CCCCCC(C)(C)CNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1	ZINC000853843506	FH	On-Demand	Anodyne	CPT1A	58	34
CCCCCC(C)(C)CNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1	ZINC000853843508	FH	On-Demand	Anodyne	CPT1A	58	34
CCc1noc(CC)c1CNC(=O)NNc1cc(F)ccc1C	ZINC000853843515	DG	On-Demand	Reactive	P2RX7	16	54
O=C(NC[C@@H]1CSCCS1)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853843517	GF	On-Demand	Anodyne	SSTR3	30	43
O=C(NC[C@H]1CSCCS1)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853843519	GF	On-Demand	Anodyne	SSTR3	30	43
c1cc(N2CCCC2)nc(NCCc2ccoc2)n1	ZINC000853843545	CE	On-Demand	Anodyne	MRGPRX1	47	41
C[C@H]1CCC[C@@H](CNC(=O)Nc2cccnc2Cl)O1	ZINC000853843576	CF	On-Demand	Anodyne	G2YM83_BOTF4	74	39
O=C(NCCC1CCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853843586	CE	On-Demand	Anodyne	CPT1A	75	35
O=C(NCCC1CCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853843588	CE	On-Demand	Anodyne	CPT1A	75	35
C[C@H]1CN(c2ccc(NC(=O)NC[C@@]3(C)CC3(F)F)cc2F)C[C@@H](C)O1	ZINC000853843616	FH	On-Demand	Anodyne	NPY2R	65	38
C[C@H]1CN(c2ccc(NC(=O)NC[C@]3(C)CC3(F)F)cc2F)C[C@@H](C)O1	ZINC000853843618	FH	On-Demand	Anodyne	NPY2R	65	38
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843642	GD	On-Demand	Mild	DRD4	21	43
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843642	GD	On-Demand	Mild	CCR3	18	40
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843642	GD	On-Demand	Mild	UTS2R	17	42
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843642	GD	On-Demand	Mild	MCHR1	19	49
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843643	GD	On-Demand	Mild	DRD4	21	43
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843643	GD	On-Demand	Mild	CCR3	18	40
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843643	GD	On-Demand	Mild	UTS2R	17	42
C#CCCN(CCOC)C(=O)N[C@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853843643	GD	On-Demand	Mild	MCHR1	19	49
CN1CCN(c2ccccc2NC(=O)NC[C@]2(C)CC2(F)F)CC1	ZINC000853843646	EF	On-Demand	Anodyne	KCNQ2	82	41
CN1CCN(c2ccccc2NC(=O)NC[C@@]2(C)CC2(F)F)CC1	ZINC000853843647	EF	On-Demand	Anodyne	KCNQ2	82	41
C[C@@]1(CNC(=O)Nc2ccc(Cl)nc2)CC1(F)F	ZINC000853843669	CF	On-Demand	Anodyne	NAMPT	22	44
CN1CCN(c2ccccc2NC(=O)NCCCC2CCC2)CC1	ZINC000853843677	EG	On-Demand	Anodyne	HTR1A	44	42
CN1CCN(c2ccccc2NC(=O)NCCCC2CCC2)CC1	ZINC000853843677	EG	On-Demand	Anodyne	DRD2	48	43
CN1CCN(c2ccccc2NC(=O)NCCCC2CCC2)CC1	ZINC000853843677	EG	On-Demand	Anodyne	DRD3	69	39
CN1CCN(c2ccccc2NC(=O)NCCCC2CCC2)CC1	ZINC000853843677	EG	On-Demand	Anodyne	HTR7	34	42
CN1CCN(c2ccccc2NC(=O)NCCCC2CCC2)CC1	ZINC000853843677	EG	On-Demand	Anodyne	KCNQ2	83	42
CN1CCN(c2ccccc2NC(=O)NCCCC2CCC2)CC1	ZINC000853843677	EG	On-Demand	Anodyne	CCR3	46	45
O=C(N1CCCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843682	DF	On-Demand	Anodyne	SLC6A1	46	33
O=C(N1CCCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843682	DF	On-Demand	Anodyne	SLC6A3	17	45
O=C(N1CCCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843682	DF	On-Demand	Anodyne	CCR5	40	46
O=C(N1CCCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843682	DF	On-Demand	Anodyne	PREP	34	41
O=C(N1CCCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843682	DF	On-Demand	Anodyne	EPHX2	16	41
O=C(NCc1cn(-c2ccccc2)nn1)NCC1CCC(O)CC1	ZINC000853843687	ED	On-Demand	Anodyne	AROQ	27	41
CC[C@@H](O)CNC(=O)Nc1cccnc1Cl	ZINC000853843705	BD	On-Demand	Anodyne	G2YM83_BOTF4	76	39
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853843710	GF	On-Demand	Anodyne	MC4R	43	38
O=C(NCc1cccnc1N1CCCC1)NC[C@H]1CSCCS1	ZINC000853843729	FE	On-Demand	Anodyne	SCN2A	17	43
O=C(NCc1cccnc1N1CCCC1)NC[C@H]1CSCCS1	ZINC000853843729	FE	On-Demand	Anodyne	SCN10A	19	43
O=C(NCc1cccnc1N1CCCC1)NC[C@@H]1CSCCS1	ZINC000853843731	FE	On-Demand	Anodyne	SCN2A	17	43
O=C(NCc1cccnc1N1CCCC1)NC[C@@H]1CSCCS1	ZINC000853843731	FE	On-Demand	Anodyne	SCN10A	19	43
COCc1cc([N+](=O)[O-])ccc1N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843762	FG	On-Demand	Bother	CACNA1C	48	35
COCc1cc([N+](=O)[O-])ccc1N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843762	FG	On-Demand	Bother	CACNA1D	72	35
COCc1cc([N+](=O)[O-])ccc1N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853843762	FG	On-Demand	Bother	F2RL3	47	38
O=C(NC[C@H]1CSCCS1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853843776	GG	On-Demand	Anodyne	SCD1	15	41
O=C(NC[C@H]1CSCCS1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853843776	GG	On-Demand	Anodyne	SCD	29	41
O=C(NC[C@H]1CSCCS1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853843776	GG	On-Demand	Anodyne	TRPM8	20	49
O=C(NC[C@@H]1CSCCS1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853843780	GG	On-Demand	Anodyne	SCD1	15	41
O=C(NC[C@@H]1CSCCS1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853843780	GG	On-Demand	Anodyne	SCD	29	41
O=C(NC[C@@H]1CSCCS1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853843780	GG	On-Demand	Anodyne	TRPM8	20	49
CN1CCN(c2ccccc2NC(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)CC1	ZINC000853843801	FD	On-Demand	Anodyne	KCNQ2	72	37
CN1CCN(c2ccccc2NC(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)CC1	ZINC000853843803	FD	On-Demand	Anodyne	KCNQ2	72	37
O=C(NCCCC1CCC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853843827	DG	On-Demand	Anodyne	PRMT3	25	43
Cn1ncc(C2CC2)c1CNC(=O)Nc1cccnc1Cl	ZINC000853843845	DF	On-Demand	Anodyne	G2YM83_BOTF4	71	35
CC[C@@H](O)CNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853843850	DG	On-Demand	Anodyne	PIK3CG	21	46
CC[C@@H](O)CNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853843850	DG	On-Demand	Anodyne	PI4KB	42	43
COc1cc(CN2CC[C@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843881	FD	On-Demand	Anodyne	DRD4	26	46
COc1cc(CN2CC[C@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843881	FD	On-Demand	Anodyne	HRH2	19	41
COc1cc(CN2CC[C@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843881	FD	On-Demand	Anodyne	SIGMAR1	18	43
COc1cc(CN2CC[C@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843881	FD	On-Demand	Anodyne	SSTR5	48	36
COc1cc(CN2CC[C@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843881	FD	On-Demand	Anodyne	CCR3	29	43
COc1cc(CN2CC[C@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843881	FD	On-Demand	Anodyne	UTS2R	20	46
COc1cc(CN2CC[C@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843881	FD	On-Demand	Anodyne	MCHR1	33	53
COc1cc(CN2CC[C@@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843884	FD	On-Demand	Anodyne	DRD4	26	46
COc1cc(CN2CC[C@@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843884	FD	On-Demand	Anodyne	HRH2	19	41
COc1cc(CN2CC[C@@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843884	FD	On-Demand	Anodyne	SIGMAR1	18	43
COc1cc(CN2CC[C@@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843884	FD	On-Demand	Anodyne	SSTR5	48	36
COc1cc(CN2CC[C@@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843884	FD	On-Demand	Anodyne	CCR3	29	43
COc1cc(CN2CC[C@@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843884	FD	On-Demand	Anodyne	UTS2R	20	46
COc1cc(CN2CC[C@@H](NC(=O)NCCN(C)OC)C2)cc(OC)c1	ZINC000853843884	FD	On-Demand	Anodyne	MCHR1	33	53
O=C(NCCCC1CCC1)Nc1cccnc1Cl	ZINC000853843906	CG	On-Demand	Anodyne	G2YM83_BOTF4	71	37
Cc1nc(NC(=O)NCc2c(C3CC3)cnn2C)sc1-c1ccccc1	ZINC000853843925	FI	On-Demand	Anodyne	PI4KB	40	41
C[C@H]1CCC[C@@H](CNC(=O)Nc2ccccc2N2CCN(C)CC2)O1	ZINC000853843933	EF	On-Demand	Anodyne	KCNQ2	78	40
O=[N+]([O-])c1ccc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000853844027	DG	On-Demand	Bother	SSTR1	39	41
C[C@H]1CN(c2ccc(NC(=O)N(C)CC3=CCCOC3)cc2F)C[C@@H](C)O1	ZINC000853844044	GG	On-Demand	Anodyne	NPY2R	57	35
C[C@H]1CN(c2ccc(NC(=O)N(C)CC3=CCCOC3)cc2F)C[C@H](C)O1	ZINC000853844047	GG	On-Demand	Anodyne	NPY2R	57	35
O=C(NC[C@H]1CSCCS1)NC[C@H]1CCN1Cc1ccccc1	ZINC000853844063	FE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NC[C@H]1CSCCS1)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853844065	FE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NC[C@@H]1CSCCS1)NC[C@H]1CCN1Cc1ccccc1	ZINC000853844066	FE	On-Demand	Anodyne	SIGMAR1	19	40
O=C(NC[C@@H]1CCN1Cc1ccccc1)NC[C@@H]1CSCCS1	ZINC000853844068	FE	On-Demand	Anodyne	SIGMAR1	19	40
COC(=O)c1sc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)nc1Cl	ZINC000853844071	FG	On-Demand	Anodyne	SLC6A3	20	44
COC(=O)c1sc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)nc1Cl	ZINC000853844071	FG	On-Demand	Anodyne	PARE	110	38
Cc1nc(NC(=O)NC[C@]2(C)CC2(F)F)sc1-c1ccccc1	ZINC000853844106	EI	On-Demand	Anodyne	PIK3CG	22	44
Cc1nc(NC(=O)NC[C@]2(C)CC2(F)F)sc1-c1ccccc1	ZINC000853844106	EI	On-Demand	Anodyne	PI4KB	42	41
Cc1nc(NC(=O)NC[C@@]2(C)CC2(F)F)sc1-c1ccccc1	ZINC000853844114	EI	On-Demand	Anodyne	PIK3CG	22	44
Cc1nc(NC(=O)NC[C@@]2(C)CC2(F)F)sc1-c1ccccc1	ZINC000853844114	EI	On-Demand	Anodyne	PI4KB	42	41
O=C(NCc1cn(-c2ccccc2)nn1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853844125	FF	On-Demand	Anodyne	EPHX2	24	49
CCCCCCCCCCNC(=O)N1CC(S(C)(=O)=O)C1	ZINC000853844126	DF	On-Demand	Mild	EPHX2	17	41
CCCCCCCCCCNC(=O)N1CC(S(C)(=O)=O)C1	ZINC000853844126	DF	On-Demand	Mild	ASAH1	102	39
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853844171	FE	On-Demand	Anodyne	STAT6	41	30
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853844174	FE	On-Demand	Anodyne	STAT6	41	30
COC(=O)c1cccc(N2CC[C@H](c3ccccc3)[C@H](CO)C2)n1	ZINC000853844179	EE	On-Demand	Anodyne	SLC6A3	20	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	SSTR2	77	34
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	MME	21	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	EDNRB	20	44
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	EDNRA	31	44
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	TACR1	30	53
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	NQO2	27	42
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	CCKAR	107	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	BRS3	29	45
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	NMBR	85	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	MTNR1A	30	42
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	MTNR1B	18	42
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	MMP2	24	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	MMP8	33	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	GRPR	93	33
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	ECE1	47	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	MMP11	77	36
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	CCKBR	91	45
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	GHSR	61	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	MMP9	22	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	NPR	26	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	AANAT	56	33
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853844181	FG	On-Demand	Anodyne	KISS1R	51	31
Cn1cc(CCNC(=O)C(F)(F)C(=O)N2CCOCC2)c2ccccc21	ZINC000853844188	FD	On-Demand	Anodyne	PTGDS	42	37
Cc1cc(C(=O)NCCc2cn(C)c3ccccc23)n2nc(C)cc2n1	ZINC000853844190	EF	On-Demand	Anodyne	NQO2	21	42
Cc1cc(C(=O)NCCc2cn(C)c3ccccc23)n2nc(C)cc2n1	ZINC000853844190	EF	On-Demand	Anodyne	MTNR1A	15	42
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853844218	GD	On-Demand	Anodyne	DRD4	24	45
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853844218	GD	On-Demand	Anodyne	SSTR5	44	34
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853844218	GD	On-Demand	Anodyne	CCR3	25	43
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853844218	GD	On-Demand	Anodyne	UTS2R	20	45
COCCN(CCF)C(=O)N[C@@H]1CCN(Cc2cc(OC)cc(OC)c2)C1	ZINC000853844218	GD	On-Demand	Anodyne	MCHR1	27	52
COc1ccc([C@@H]2CCCN2C(=O)Nc2cccnc2Cl)cc1F	ZINC000853844219	EI	On-Demand	Anodyne	RBP4	19	44
O=C(NCCC1CCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853844223	DF	On-Demand	Anodyne	SLC6A3	17	45
O=C(NCCC1CCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853844223	DF	On-Demand	Anodyne	CCR5	28	40
O=C(NCCC1CCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853844223	DF	On-Demand	Anodyne	EPHX2	29	40
O=C(NCCC1CCC1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853844224	DE	On-Demand	Anodyne	L3MBTL3	47	38
O=C(NCCC1CCC1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853844225	DE	On-Demand	Anodyne	L3MBTL3	47	38
CCCCCCCCCCNC(=O)N1CCC(n2cnnc2O)CC1	ZINC000853844228	FG	On-Demand	Mild	ASAH1	101	40
CCCCCCCCCCNC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1	ZINC000853844242	GI	On-Demand	Mild	ASAH1	88	36
Cn1ccnc1C(=O)NCCc1cn(C)c2ccccc12	ZINC000853844244	CD	On-Demand	Anodyne	NQO2	18	43
COC(=O)c1cnc([C@@H]2CCCN(C(=O)NCCC3CCC3)C2)s1	ZINC000853844275	FG	On-Demand	Anodyne	SIRT3	51	32
COC(=O)c1cnc([C@@H]2CCCN(C(=O)NCCC3CCC3)C2)s1	ZINC000853844275	FG	On-Demand	Anodyne	SIRT2	53	33
COC(=O)c1cnc([C@@H]2CCCN(C(=O)NCCC3CCC3)C2)s1	ZINC000853844275	FG	On-Demand	Anodyne	SIRT1	51	34
COC(=O)c1cnc([C@H]2CCCN(C(=O)NCCC3CCC3)C2)s1	ZINC000853844276	FG	On-Demand	Anodyne	SIRT3	51	32
COC(=O)c1cnc([C@H]2CCCN(C(=O)NCCC3CCC3)C2)s1	ZINC000853844276	FG	On-Demand	Anodyne	SIRT2	53	33
COC(=O)c1cnc([C@H]2CCCN(C(=O)NCCC3CCC3)C2)s1	ZINC000853844276	FG	On-Demand	Anodyne	SIRT1	51	34
O=C(NC[C@]1(O)C[C@H]2C=C[C@H]1C2)Nc1ccc(-c2ccccc2)cc1	ZINC000853844367	EH	On-Demand	Anodyne	EPHX2	31	48
O=C(NC[C@@]1(O)C[C@H]2C=C[C@H]1C2)Nc1ccc(-c2ccccc2)cc1	ZINC000853844369	EH	On-Demand	Anodyne	EPHX2	31	48
CN1CCN(c2ccccc2NC(=O)N(C)CC2=CCCOC2)CC1	ZINC000853844374	EE	On-Demand	Anodyne	KCNQ2	70	37
CC[C@@H](O)CNC(=O)Nc1ccc(Cl)nc1	ZINC000853844376	BD	On-Demand	Anodyne	ADRB1	45	36
CN1CCN(c2ccccc2NC(=O)N[C@@H]2COc3cc(F)ccc3C2)CC1	ZINC000853844383	GF	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N[C@H]2COc3cc(F)ccc3C2)CC1	ZINC000853844386	GF	On-Demand	Anodyne	KCNQ2	72	40
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853844388	EE	On-Demand	Anodyne	ACHE	32	51
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853844388	EE	On-Demand	Anodyne	HRH2	15	40
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853844388	EE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853844388	EE	On-Demand	Anodyne	CCR3	37	43
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853844388	EE	On-Demand	Anodyne	MCHR1	22	41
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853844390	EE	On-Demand	Anodyne	ACHE	32	51
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853844390	EE	On-Demand	Anodyne	HRH2	15	40
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853844390	EE	On-Demand	Anodyne	SIGMAR1	23	42
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853844390	EE	On-Demand	Anodyne	CCR3	37	43
O=C(NCCC1CCC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853844390	EE	On-Demand	Anodyne	MCHR1	22	41
O=C(NC[C@@]1(O)C[C@H]2C=C[C@H]1C2)Nc1cccnc1Cl	ZINC000853844392	CE	On-Demand	Anodyne	G2YM83_BOTF4	69	35
O=C(NC[C@]1(O)C[C@H]2C=C[C@H]1C2)Nc1cccnc1Cl	ZINC000853844395	CE	On-Demand	Anodyne	G2YM83_BOTF4	69	35
CCCCCCCCCCNC(=O)N1CCN(S(=O)(=O)NC)CC1	ZINC000853844404	FD	On-Demand	Mild	ASAH1	99	39
CN1CCN(c2ccccc2NC(=O)NCCc2cn(C)c3ccccc23)CC1	ZINC000853844422	GG	On-Demand	Anodyne	HTR1A	17	40
CN1CCN(c2ccccc2NC(=O)NCCc2cn(C)c3ccccc23)CC1	ZINC000853844422	GG	On-Demand	Anodyne	KCNQ2	74	39
CCCCCCCCCCNC(=O)N1CCC(=O)N(C)CC1	ZINC000853844456	DG	On-Demand	Mild	ASAH1	110	45
Cn1ncc(C2CC2)c1CNC(=O)C(F)(F)c1ccccc1F	ZINC000853844458	DF	On-Demand	Anodyne	P2RX7	21	42
CC[C@@H](O)CNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853844463	EE	On-Demand	Anodyne	NPY2R	78	41
CC[C@@H](O)CNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853844464	EE	On-Demand	Anodyne	NPY2R	78	41
CC[C@@H](O)CNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853844465	EE	On-Demand	Anodyne	NPY2R	78	41
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853844485	GD	On-Demand	Anodyne	L3MBTL3	56	37
O=C(NCc1cn(-c2ccccc2)nn1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853844486	GD	On-Demand	Anodyne	L3MBTL3	56	37
O=C(NCc1cn(-c2ccccc2)nn1)N(CCN1CCOCC1)CC1CC1	ZINC000853844507	GD	On-Demand	Anodyne	CASR	58	42
CN1CCN(c2ccccc2NC(=O)NCc2c(C3CC3)cnn2C)CC1	ZINC000853844508	FE	On-Demand	Anodyne	KCNQ2	73	39
Cn1cc(CCNC(=O)C(=O)OC(C)(C)C)c2ccccc21	ZINC000853844514	DE	On-Demand	Anodyne	MTNR1A	22	46
Cn1cc(CCNC(=O)C(=O)OC(C)(C)C)c2ccccc21	ZINC000853844514	DE	On-Demand	Anodyne	MTNR1B	17	46
Cn1ncc(C2CC2)c1CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853844530	FE	On-Demand	Bother	CACNA1C	53	37
Cn1ncc(C2CC2)c1CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853844530	FE	On-Demand	Bother	CACNA1D	78	37
Cn1cc(CCNC(=O)C(C)(F)F)c2ccccc21	ZINC000853844538	CE	On-Demand	Anodyne	NQO2	23	46
Cn1cc(CCNC(=O)C(C)(F)F)c2ccccc21	ZINC000853844538	CE	On-Demand	Anodyne	MTNR1A	18	46
Cn1cc(CCNC(=O)C(C)(F)F)c2ccccc21	ZINC000853844538	CE	On-Demand	Anodyne	MTNR1B	15	46
COCCOc1cc(C)ccc1CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853844541	GF	On-Demand	Reactive	CACNA1C	41	36
COCCOc1cc(C)ccc1CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853844541	GF	On-Demand	Reactive	CACNA1D	69	36
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H]3CCC[C@@H](C)O3)cc2F)C[C@@H](C)O1	ZINC000853844562	GH	On-Demand	Anodyne	NPY2R	69	38
C[C@H]1CCC[C@@H](CNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)O1	ZINC000853844566	GH	On-Demand	Anodyne	NPY2R	69	38
C[C@H]1CCC[C@@H](CNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)O1	ZINC000853844568	GH	On-Demand	Anodyne	NPY2R	69	38
CC(C)c1ccccc1NC(=O)NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853844595	DH	On-Demand	Anodyne	SOAT1	20	40
CC(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853844596	DF	On-Demand	Anodyne	CCR3	41	43
CC(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853844596	DF	On-Demand	Anodyne	EPHX2	23	46
CC(=O)c1cccc(NC(=O)NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853844596	DF	On-Demand	Anodyne	IMDH_CRYPV	49	38
COC[C@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844603	DF	On-Demand	Anodyne	DRD4	43	32
COC[C@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844603	DF	On-Demand	Anodyne	CTSL	17	41
COC[C@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844603	DF	On-Demand	Anodyne	MTNR1A	52	39
COC[C@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844603	DF	On-Demand	Anodyne	MTNR1B	48	39
COC[C@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844603	DF	On-Demand	Anodyne	CTSS	19	41
COC[C@@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844604	DF	On-Demand	Anodyne	DRD4	43	32
COC[C@@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844604	DF	On-Demand	Anodyne	CTSL	17	41
COC[C@@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844604	DF	On-Demand	Anodyne	MTNR1A	52	39
COC[C@@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844604	DF	On-Demand	Anodyne	MTNR1B	48	39
COC[C@@H](NC(=O)NCCC1CCC1)c1cccc(OC)c1	ZINC000853844604	DF	On-Demand	Anodyne	CTSS	19	41
O=C(NCC1CCN(Cc2ccncc2)CC1)NC[C@H]1CSCCS1	ZINC000853844702	GE	On-Demand	Anodyne	ACHE	25	47
O=C(NCC1CCN(Cc2ccncc2)CC1)NC[C@H]1CSCCS1	ZINC000853844702	GE	On-Demand	Anodyne	SIGMAR1	21	41
O=C(NCC1CCN(Cc2ccncc2)CC1)NC[C@H]1CSCCS1	ZINC000853844702	GE	On-Demand	Anodyne	CACNA1I	60	40
O=C(NCC1CCN(Cc2ccncc2)CC1)NC[C@@H]1CSCCS1	ZINC000853844703	GE	On-Demand	Anodyne	ACHE	25	47
O=C(NCC1CCN(Cc2ccncc2)CC1)NC[C@@H]1CSCCS1	ZINC000853844703	GE	On-Demand	Anodyne	SIGMAR1	21	41
O=C(NCC1CCN(Cc2ccncc2)CC1)NC[C@@H]1CSCCS1	ZINC000853844703	GE	On-Demand	Anodyne	CACNA1I	60	40
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	CHRM2	22	47
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	CHRM1	20	47
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	DRD2	25	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	DRD4	49	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	ACHE	49	45
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	DRD3	17	50
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	KCNH2	15	44
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	HTR4	17	44
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	CHRM3	28	47
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	LTA4H	27	42
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	SIGMAR1	55	54
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	SSTR5	55	37
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	CACNA1B	21	46
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	CCR3	34	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	SLC6A5	24	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	MCHR1	53	49
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	CACNA1G	36	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853844705	GG	On-Demand	Anodyne	CCR8	17	43
Cc1nc(NC(=O)N2CCC[C@@H]2CS(C)(=O)=O)sc1-c1ccccc1	ZINC000853844855	GG	On-Demand	Anodyne	HCRTR1	44	37
Cc1nc(NC(=O)N2CCC[C@@H]2CS(C)(=O)=O)sc1-c1ccccc1	ZINC000853844855	GG	On-Demand	Anodyne	PIK3CG	20	53
O=C(NC[C@@H]1CSCCS1)NNc1nc2ccc(Cl)cc2s1	ZINC000853844982	FG	On-Demand	Reactive	CSNK1D	30	41
O=C(NC[C@H]1CSCCS1)NNc1nc2ccc(Cl)cc2s1	ZINC000853844983	FG	On-Demand	Reactive	CSNK1D	30	41
O=C(NC[C@@H]1CSCCS1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853845023	ED	On-Demand	Anodyne	CPT1A	42	32
O=C(NC[C@@H]1CSCCS1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853845024	ED	On-Demand	Anodyne	CPT1A	42	32
O=C(NC[C@H]1CSCCS1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853845025	ED	On-Demand	Anodyne	CPT1A	42	32
O=C(NC[C@H]1CSCCS1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853845026	ED	On-Demand	Anodyne	CPT1A	42	32
O=C(NC[C@H]1CSCCS1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853845043	GH	On-Demand	Anodyne	KCNH2	40	38
O=C(NC[C@@H]1CSCCS1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853845044	GH	On-Demand	Anodyne	KCNH2	40	38
C[C@H](NC(=O)[C@@H](C)OC(=O)CSC(C)(C)C)c1ccc(S(N)(=O)=O)cc1	ZINC000853845046	HD	On-Demand	Anodyne	CA2	57	43
C[C@H](NC(=O)[C@@H](C)OC(=O)CSC(C)(C)C)c1ccc(S(N)(=O)=O)cc1	ZINC000853845046	HD	On-Demand	Anodyne	CA7	31	43
C[C@H](NC(=O)[C@@H](C)OC(=O)CSC(C)(C)C)c1ccc(S(N)(=O)=O)cc1	ZINC000853845046	HD	On-Demand	Anodyne	CA14	34	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853845048	HD	On-Demand	Anodyne	CA2	57	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853845048	HD	On-Demand	Anodyne	CA7	31	43
C[C@@H](OC(=O)CSC(C)(C)C)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853845048	HD	On-Demand	Anodyne	CA14	34	43
CN(CC1=CCCOC1)C(=O)Nc1cccnc1Cl	ZINC000853845140	CF	On-Demand	Anodyne	G2YM83_BOTF4	69	34
CS(=O)(=O)C1(CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CCCCC1	ZINC000853845192	GF	On-Demand	Bother	TBXA2R	23	41
O=C(Nc1ccc2c(c1)OCO2)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845207	EF	On-Demand	Anodyne	CHRM2	33	41
O=C(Nc1ccc2c(c1)OCO2)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845207	EF	On-Demand	Anodyne	EPHX2	36	44
O=C(Nc1ccc2c(c1)OCO2)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845207	EF	On-Demand	Anodyne	MCHR1	17	46
O=C(Nc1ccc2c(c1)OCO2)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845208	EF	On-Demand	Anodyne	CHRM2	33	41
O=C(Nc1ccc2c(c1)OCO2)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845208	EF	On-Demand	Anodyne	EPHX2	36	44
O=C(Nc1ccc2c(c1)OCO2)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845208	EF	On-Demand	Anodyne	MCHR1	17	46
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)c1nc(=O)c3ccccc3[nH]1)C2	ZINC000853845221	GE	On-Demand	Anodyne	SSTR2	44	32
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)c1nc(=O)c3ccccc3[nH]1)C2	ZINC000853845221	GE	On-Demand	Anodyne	SSTR4	43	32
O=C(N=c1cc[nH]cc1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845222	CE	On-Demand	Anodyne	SLC6A5	17	41
O=C(N=c1cc[nH]cc1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845223	CE	On-Demand	Anodyne	SLC6A5	17	41
O=C(Nc1ccc(Cl)nc1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845245	DG	On-Demand	Anodyne	EPHX2	45	47
O=C(Nc1ccc(Cl)nc1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845246	DG	On-Demand	Anodyne	EPHX2	45	47
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)CCN1S(C)(=O)=O	ZINC000853845267	ED	On-Demand	Anodyne	G2YM83_BOTF4	70	39
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853845292	EG	On-Demand	Anodyne	HTR1A	32	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853845292	EG	On-Demand	Anodyne	HTR1D	15	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853845292	EG	On-Demand	Anodyne	HTR1B	18	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853845292	EG	On-Demand	Anodyne	HTR7	22	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853845292	EG	On-Demand	Anodyne	KCNQ2	80	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](CCF)C2)CC1	ZINC000853845292	EG	On-Demand	Anodyne	RBP4	53	35
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853845293	EG	On-Demand	Anodyne	HTR1A	32	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853845293	EG	On-Demand	Anodyne	HTR1D	15	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853845293	EG	On-Demand	Anodyne	HTR1B	18	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853845293	EG	On-Demand	Anodyne	HTR7	22	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853845293	EG	On-Demand	Anodyne	KCNQ2	80	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](CCF)C2)CC1	ZINC000853845293	EG	On-Demand	Anodyne	RBP4	53	35
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	CA2	24	50
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	CA1	17	50
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	CA4	19	46
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	EPHX2	41	46
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	CA12	22	50
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	ST14	36	41
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	CA9	21	50
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	MTCA1	38	50
NS(=O)(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845295	FD	On-Demand	Anodyne	P96878_MYCTU	44	50
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	CA2	24	50
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	CA1	17	50
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	CA4	19	46
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	EPHX2	41	46
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	CA12	22	50
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	ST14	36	41
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	CA9	21	50
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	MTCA1	38	50
NS(=O)(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845296	FD	On-Demand	Anodyne	P96878_MYCTU	44	50
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	DRD4	15	52
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	ADRA1D	20	58
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	ADRA1A	15	58
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	ADRA1B	16	58
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	HTR4	17	45
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	CCR3	26	46
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	SLC6A5	17	42
COc1ccccc1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845310	DG	On-Demand	Anodyne	EPHX2	34	42
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	DRD4	15	52
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	ADRA1D	20	58
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	ADRA1A	15	58
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	ADRA1B	16	58
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	HTR4	17	45
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	CCR3	26	46
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	SLC6A5	17	42
COc1ccccc1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845311	DG	On-Demand	Anodyne	EPHX2	34	42
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845314	EG	On-Demand	Anodyne	CCKAR	20	42
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845314	EG	On-Demand	Anodyne	CCR3	45	40
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845314	EG	On-Demand	Anodyne	CCKBR	41	42
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845314	EG	On-Demand	Anodyne	SLC6A5	17	41
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845314	EG	On-Demand	Anodyne	EPHX2	56	52
COC(=O)c1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845314	EG	On-Demand	Anodyne	CXCR3	15	58
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845315	EG	On-Demand	Anodyne	CCKAR	20	42
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845315	EG	On-Demand	Anodyne	CCR3	45	40
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845315	EG	On-Demand	Anodyne	CCKBR	41	42
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845315	EG	On-Demand	Anodyne	SLC6A5	17	41
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845315	EG	On-Demand	Anodyne	EPHX2	56	52
COC(=O)c1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845315	EG	On-Demand	Anodyne	CXCR3	15	58
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1cccc([N+](=O)[O-])c1)C2	ZINC000853845323	GG	On-Demand	Bother	CACNA1C	56	36
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1cccc([N+](=O)[O-])c1)C2	ZINC000853845323	GG	On-Demand	Bother	CACNA1D	88	35
Cc1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)n1	ZINC000853845328	DF	On-Demand	Anodyne	GRM5	16	45
Cc1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)n1	ZINC000853845329	DF	On-Demand	Anodyne	GRM5	16	45
O=C(Nc1ccc2oc(=O)ccc2c1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845334	FG	On-Demand	Anodyne	EPHX2	31	41
O=C(Nc1ccc2oc(=O)ccc2c1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845335	FG	On-Demand	Anodyne	EPHX2	31	41
Cc1cccc(NC(=O)N2CC3CC2(CNC(=O)OC(C)(C)C)C3)c1	ZINC000853845343	EH	On-Demand	Anodyne	CCKAR	22	40
Cc1cccc(NC(=O)N2CC3CC2(CNC(=O)OC(C)(C)C)C3)c1	ZINC000853845343	EH	On-Demand	Anodyne	CCKBR	28	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@H](CCF)C3)cc2F)C[C@@H](C)O1	ZINC000853845351	GI	On-Demand	Anodyne	NPY2R	75	38
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@H](CCF)C3)cc2F)C[C@@H](C)O1	ZINC000853845351	GI	On-Demand	Anodyne	CCR3	18	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@@H](CCF)C3)cc2F)C[C@@H](C)O1	ZINC000853845352	GI	On-Demand	Anodyne	NPY2R	75	38
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@@H](CCF)C3)cc2F)C[C@@H](C)O1	ZINC000853845352	GI	On-Demand	Anodyne	CCR3	18	40
Cc1cccc(NC(=O)N[C@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)n1	ZINC000853845367	GJ	On-Demand	Anodyne	TRPV1	16	48
Cc1cccc(NC(=O)N[C@@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)n1	ZINC000853845368	GJ	On-Demand	Anodyne	TRPV1	16	48
CCC1(CC)CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853845387	CI	On-Demand	Anodyne	EPHX2	16	41
CCC1(CC)CCCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853845387	CI	On-Demand	Anodyne	G2YM83_BOTF4	76	40
O=C(Nc1ccc(Cl)nc1)N1CCC[C@@H](CCF)C1	ZINC000853845414	CG	On-Demand	Anodyne	EPHX2	16	47
O=C(Nc1ccc(Cl)nc1)N1CCC[C@H](CCF)C1	ZINC000853845415	CG	On-Demand	Anodyne	EPHX2	16	47
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845416	GF	On-Demand	Anodyne	ADRA1D	22	49
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845416	GF	On-Demand	Anodyne	ADRA1A	16	49
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845416	GF	On-Demand	Anodyne	ADRA1B	17	49
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845416	GF	On-Demand	Anodyne	KCNQ2	76	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845416	GF	On-Demand	Anodyne	SLC6A5	18	45
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845416	GF	On-Demand	Anodyne	EPHX2	21	40
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845417	GF	On-Demand	Anodyne	ADRA1D	22	49
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845417	GF	On-Demand	Anodyne	ADRA1A	16	49
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845417	GF	On-Demand	Anodyne	ADRA1B	17	49
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845417	GF	On-Demand	Anodyne	KCNQ2	76	43
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845417	GF	On-Demand	Anodyne	SLC6A5	18	45
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCN(C3CCCCC3)C2)CC1	ZINC000853845417	GF	On-Demand	Anodyne	EPHX2	21	40
O=C(Nc1cc(F)ccc1F)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845419	DG	On-Demand	Anodyne	CCR3	41	46
O=C(Nc1cc(F)ccc1F)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845419	DG	On-Demand	Anodyne	EPHX2	33	48
O=C(Nc1cc(F)ccc1F)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845420	DG	On-Demand	Anodyne	CCR3	41	46
O=C(Nc1cc(F)ccc1F)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845420	DG	On-Demand	Anodyne	EPHX2	33	48
COC(=O)c1ccc(C)c(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845429	FG	On-Demand	Anodyne	SLC6A5	20	41
COC(=O)c1ccc(C)c(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845429	FG	On-Demand	Anodyne	EPHX2	28	42
COC(=O)c1ccc(C)c(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845430	FG	On-Demand	Anodyne	SLC6A5	20	41
COC(=O)c1ccc(C)c(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845430	FG	On-Demand	Anodyne	EPHX2	28	42
C[C@@H](CNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccn1	ZINC000853845432	GD	On-Demand	Anodyne	EPHX2	39	42
C[C@@H](CNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccn1	ZINC000853845432	GD	On-Demand	Anodyne	SFRP1	112	38
C[C@@H](CNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)c1ccccn1	ZINC000853845432	GD	On-Demand	Anodyne	WNT3	67	35
COC(=O)c1sccc1NC(=O)N1CC2CC1(CNC(=O)OC(C)(C)C)C2	ZINC000853845433	GG	On-Demand	Anodyne	FAS	33	40
c1ccc([C@@H]2CO[C@H](CNc3ncnc4c3CCC4)C2)cc1	ZINC000853845462	CF	On-Demand	Anodyne	TNK2	49	38
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1cccnc1)C2	ZINC000853845468	EF	On-Demand	Anodyne	NAMPT	36	48
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000853845469	GG	On-Demand	Bother	NMBR	57	33
CC[C@@H](O)CNC(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000853845474	FF	On-Demand	Anodyne	ADRB1	36	40
CC[C@@H](O)CNC(=O)NCCc1ccc(NC(=O)OC(C)(C)C)cc1	ZINC000853845474	FF	On-Demand	Anodyne	ADRB3	31	40
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1(S(C)(=O)=O)CCCCC1	ZINC000853845477	FF	On-Demand	Bother	NMBR	46	31
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845482	EG	On-Demand	Anodyne	CCR3	43	40
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845482	EG	On-Demand	Anodyne	CCKBR	44	36
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845482	EG	On-Demand	Anodyne	EPHX2	53	49
CC(=O)Nc1cccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845482	EG	On-Demand	Anodyne	CXCR3	18	46
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845483	EG	On-Demand	Anodyne	CCR3	43	40
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845483	EG	On-Demand	Anodyne	CCKBR	44	36
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845483	EG	On-Demand	Anodyne	EPHX2	53	49
CC(=O)Nc1cccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)c1	ZINC000853845483	EG	On-Demand	Anodyne	CXCR3	18	46
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1ccc(C(F)(F)F)cc1)C2	ZINC000853845494	GI	On-Demand	Anodyne	TRPM8	42	34
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1nc3ccccc3s1)C2	ZINC000853845506	GH	On-Demand	Anodyne	ST14	41	32
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1nc3ccccc3s1)C2	ZINC000853845506	GH	On-Demand	Anodyne	TMPRSS6	62	32
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1ccccc1C(F)(F)F)C2	ZINC000853845509	GI	On-Demand	Anodyne	RBP4	68	37
CS(=O)(=O)C1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853845518	FE	On-Demand	Bother	GSTM2	110	43
CS(=O)(=O)C1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853845518	FE	On-Demand	Bother	GSTP1	69	43
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	CA2	64	67
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	CA1	59	67
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	CA7	40	38
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	CA4	46	45
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	CA14	50	38
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	EPHX2	48	40
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	CA12	55	67
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	CA9	56	67
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	F13A1	40	39
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	NCE103	20	53
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	MTCA1	58	67
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845527	FD	On-Demand	Anodyne	P96878_MYCTU	70	67
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	CA2	64	67
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	CA1	59	67
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	CA7	40	38
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	CA4	46	45
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	CA14	50	38
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	EPHX2	48	40
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	CA12	55	67
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	CA9	56	67
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	F13A1	40	39
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	NCE103	20	53
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	MTCA1	58	67
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000853845528	FD	On-Demand	Anodyne	P96878_MYCTU	70	67
O=C(Nc1ccc(Cl)cn1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845534	DG	On-Demand	Anodyne	SLC6A5	17	43
O=C(Nc1ccc(Cl)cn1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845534	DG	On-Demand	Anodyne	EPHX2	26	40
O=C(Nc1ccc(Cl)cn1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845535	DG	On-Demand	Anodyne	SLC6A5	17	43
O=C(Nc1ccc(Cl)cn1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845535	DG	On-Demand	Anodyne	EPHX2	26	40
O=C(Nc1ccc(CN2C(=O)CNC2=O)cc1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845564	GE	On-Demand	Anodyne	EPHX2	35	40
O=C(Nc1ccc(CN2C(=O)CNC2=O)cc1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845565	GE	On-Demand	Anodyne	EPHX2	35	40
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845584	FF	On-Demand	Anodyne	EPHX2	35	43
O=C(Nc1cccc(N2CCNC2=O)c1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845585	FF	On-Demand	Anodyne	EPHX2	35	43
CS(=O)(=O)c1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845591	FE	On-Demand	Anodyne	EPHX2	42	44
CS(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845592	FE	On-Demand	Anodyne	EPHX2	42	44
Cc1cc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)n(-c2ccccn2)n1	ZINC000853845602	FG	On-Demand	Anodyne	EPHX2	16	41
CC(=O)c1cccc(NC(=O)N2CC3CC2(CNC(=O)OC(C)(C)C)C3)c1	ZINC000853845604	FG	On-Demand	Anodyne	CCR3	18	40
CC(=O)c1cccc(NC(=O)N2CC3CC2(CNC(=O)OC(C)(C)C)C3)c1	ZINC000853845604	FG	On-Demand	Anodyne	EPHX2	15	42
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845611	GI	On-Demand	Anodyne	FPR1	15	40
Cc1nn(-c2ccccc2)c(C)c1NC(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845612	GI	On-Demand	Anodyne	FPR1	15	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2ccc(NC(=O)OC(C)(C)C)cc2)C1	ZINC000853845635	GF	On-Demand	Anodyne	EPHX2	15	43
CCC1(CC)CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853845637	FH	On-Demand	Anodyne	HTR1B	16	41
CCC1(CC)CCCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853845637	FH	On-Demand	Anodyne	KCNQ2	90	47
Cc1nc(NC(=O)N2CCC[C@@H](CCF)C2)sc1-c1ccccc1	ZINC000853845652	EJ	On-Demand	Anodyne	CCR3	50	37
Cc1nc(NC(=O)N2CCC[C@@H](CCF)C2)sc1-c1ccccc1	ZINC000853845652	EJ	On-Demand	Anodyne	PIK3CG	20	47
Cc1nc(NC(=O)N2CCC[C@H](CCF)C2)sc1-c1ccccc1	ZINC000853845653	EJ	On-Demand	Anodyne	CCR3	50	37
Cc1nc(NC(=O)N2CCC[C@H](CCF)C2)sc1-c1ccccc1	ZINC000853845653	EJ	On-Demand	Anodyne	PIK3CG	20	47
Cn1nc(Br)c2c(NC[C@@H]3C[C@H](c4ccccc4)CO3)ncnc21	ZINC000853845659	GG	On-Demand	Anodyne	TNK2	48	34
CCn1cc(C(=O)C(=O)N[C@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)cn1	ZINC000853845661	GG	On-Demand	Anodyne	PANC	41	32
CCn1cc(C(=O)C(=O)N[C@@H]2CCc3cc(NC(=O)OC(C)(C)C)ccc32)cn1	ZINC000853845662	GG	On-Demand	Anodyne	PANC	41	32
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1cccnc1Cl)C2	ZINC000853845672	FG	On-Demand	Anodyne	G2YM83_BOTF4	66	34
COc1ccc2c(NCC3(S(C)(=O)=O)CCCCC3)ccnc2c1	ZINC000853845673	EG	On-Demand	Anodyne	HRP1_PLAFA	102	44
COc1ccc2c(NCC3(S(C)(=O)=O)CCCCC3)ccnc2c1	ZINC000853845673	EG	On-Demand	Anodyne	HNMT	63	39
Cc1nc(NC(=O)N2CCN(S(C)(=O)=O)[C@H](C)C2)sc1-c1ccccc1	ZINC000853845708	GF	On-Demand	Anodyne	PIK3CG	19	45
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1nccs1)C2	ZINC000853845712	EF	On-Demand	Anodyne	MAP1	87	34
COCC1(NC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)CCCC1	ZINC000853845714	GD	On-Demand	Anodyne	EPHX2	30	43
COC(=O)c1cccc(NC(=O)N2CC3CC2(CNC(=O)OC(C)(C)C)C3)c1	ZINC000853845737	GF	On-Demand	Anodyne	HIF1A	15	42
COCCOc1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845743	FF	On-Demand	Anodyne	CCR3	15	41
COCCOc1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845743	FF	On-Demand	Anodyne	SLC6A5	17	40
COCCOc1ccc(NC(=O)N[C@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845743	FF	On-Demand	Anodyne	EPHX2	41	40
COCCOc1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845744	FF	On-Demand	Anodyne	CCR3	15	41
COCCOc1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845744	FF	On-Demand	Anodyne	SLC6A5	17	40
COCCOc1ccc(NC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cn1	ZINC000853845744	FF	On-Demand	Anodyne	EPHX2	41	40
CN(C(=O)NCCC1CCC1)[C@H](CO)Cc1ccccc1	ZINC000853845751	CE	On-Demand	Anodyne	ACHE	15	40
CN(C(=O)NCCC1CCC1)[C@H](CO)Cc1ccccc1	ZINC000853845751	CE	On-Demand	Anodyne	MME	56	38
CN(C(=O)NCCC1CCC1)[C@H](CO)Cc1ccccc1	ZINC000853845751	CE	On-Demand	Anodyne	NPY5R	16	41
CN(C(=O)NCCC1CCC1)[C@@H](CO)Cc1ccccc1	ZINC000853845752	CE	On-Demand	Anodyne	ACHE	15	40
CN(C(=O)NCCC1CCC1)[C@@H](CO)Cc1ccccc1	ZINC000853845752	CE	On-Demand	Anodyne	MME	56	38
CN(C(=O)NCCC1CCC1)[C@@H](CO)Cc1ccccc1	ZINC000853845752	CE	On-Demand	Anodyne	NPY5R	16	41
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)CCN1S(C)(=O)=O	ZINC000853845753	GC	On-Demand	Anodyne	KCNQ2	70	37
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)CCN1S(C)(=O)=O	ZINC000853845753	GC	On-Demand	Anodyne	NPY5R	15	41
Cn1ccnc1C(=O)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853845780	CD	On-Demand	Anodyne	SLC6A5	18	42
Cn1ccnc1C(=O)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853845781	CD	On-Demand	Anodyne	SLC6A5	18	42
CC(C)(C)OC(=O)NCC12CC(CN1C(=O)Nc1ccc(Cl)cn1)C2	ZINC000853845810	FG	On-Demand	Anodyne	F10	48	32
COc1ccc(-c2ccnc(NC[C@]34OCCC[C@H]3C4(F)F)n2)cc1	ZINC000853845862	EG	On-Demand	Anodyne	CLK4	27	48
COc1ccc(-c2ccnc(NC[C@]34OCCC[C@H]3C4(F)F)n2)cc1	ZINC000853845862	EG	On-Demand	Anodyne	DYRK1B	15	48
FC1(F)[C@@H]2CCCO[C@@]21CNc1ncnc2c1ncn2C1CC1	ZINC000853845868	DE	On-Demand	Anodyne	ADORA1	43	41
Cc1nc(NC(=O)N(C)Cc2cn(C)nn2)sc1-c1ccccc1	ZINC000853845869	EF	On-Demand	Anodyne	PIK3CG	19	40
CN1CCN(c2ccccc2NC(=O)N(C)Cc2cn(C)nn2)CC1	ZINC000853845877	ED	On-Demand	Anodyne	KCNQ2	71	37
FC1(F)[C@@H]2CCCO[C@@]21CNc1ncnc2[nH]c3ccccc3c12	ZINC000853845879	EG	On-Demand	Anodyne	UTS2R	19	43
Cc1ccc([C@H](C)NC(=O)N2CCc3nnc(-c4cnn(C)c4)cc3C2)cc1F	ZINC000853845917	GG	On-Demand	Anodyne	MAPK1	51	44
COCc1csc(CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)c1	ZINC000853845923	FG	On-Demand	Bother	CACNA1D	45	33
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(C#N)c1	ZINC000853845938	ED	On-Demand	Reactive	CCR3	26	46
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(C#N)c1	ZINC000853845938	ED	On-Demand	Reactive	MCHR1	15	40
COc1cccc([C@]2(C)CCN(C(=O)Nc3ccc(Cl)nc3)C2)c1	ZINC000853845961	EH	On-Demand	Anodyne	NPY5R	28	42
COc1cccc([C@]2(C)CCN(C(=O)Nc3ccc(Cl)nc3)C2)c1	ZINC000853845961	EH	On-Demand	Anodyne	EPHX2	41	48
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCN(S(=O)(=O)C(F)(F)F)CC2)C1	ZINC000853845981	GC	On-Demand	Anodyne	EPHX2	36	44
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccnc1Cl	ZINC000853845984	FD	On-Demand	Reactive	G2YM83_BOTF4	65	32
O=C(N1CCCCC1)N1CCC(n2nncc2I)CC1	ZINC000853846001	GE	On-Demand	Anodyne	L3MBTL3	59	38
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc2ccccc12	ZINC000853846026	FF	On-Demand	Reactive	TRPV1	24	41
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N[C@H]1C[C@H](O)C1	ZINC000853846027	EC	On-Demand	Anodyne	EPHX2	31	42
C[C@@]12COC[C@H]1CN(C(=O)Nc1cccnc1Cl)C2	ZINC000853846031	CE	On-Demand	Anodyne	G2YM83_BOTF4	74	37
C[C@@]12COC[C@@H]1CN(C(=O)Nc1cccnc1Cl)C2	ZINC000853846033	CE	On-Demand	Anodyne	G2YM83_BOTF4	74	37
C[C@@H](CCNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)N(C)C	ZINC000853846040	FC	On-Demand	Anodyne	EPHX2	25	40
O=C(N1CC[C@@]2(O)C[C@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853846076	ED	On-Demand	Bother	CACNA1C	42	34
O=C(N1CC[C@@]2(O)C[C@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853846076	ED	On-Demand	Bother	CACNA1D	65	34
O=C(c1cnns1)N1CCC(n2nncc2I)CC1	ZINC000853846085	GD	On-Demand	Anodyne	L3MBTL3	44	38
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccnc1N1CCCC1	ZINC000853846108	GD	On-Demand	Reactive	KCNQ2	41	32
CC(=O)c1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846116	FD	On-Demand	Reactive	CCR3	29	43
CC(=O)c1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846116	FD	On-Demand	Reactive	IMDH_CRYPV	49	35
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccnc1	ZINC000853846118	DD	On-Demand	Reactive	TBXAS1	33	41
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccnc1	ZINC000853846118	DD	On-Demand	Reactive	NAMPT	36	42
Cc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)n1	ZINC000853846121	ED	On-Demand	Reactive	GRM5	15	41
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853846136	FD	On-Demand	Reactive	TBXA2R	16	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000853846142	GG	On-Demand	Mild	KCNQ2	35	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000853846144	GG	On-Demand	Mild	KCNQ2	35	40
N#Cc1cc(C(=O)N2CCC(n3nncc3I)CC2)c[nH]1	ZINC000853846162	GD	On-Demand	Mild	L3MBTL3	68	37
C[C@H]1CN(c2ccc(NC(=O)N(C)Cc3cn(C)nn3)cc2F)C[C@@H](C)O1	ZINC000853846186	GE	On-Demand	Anodyne	NPY2R	64	34
C[C@@]12COC[C@@H]1CN(C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C2	ZINC000853846187	EE	On-Demand	Bother	CACNA1C	45	34
C[C@@]12COC[C@@H]1CN(C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C2	ZINC000853846187	EE	On-Demand	Bother	CACNA1D	74	34
C[C@@]12COC[C@H]1CN(C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C2	ZINC000853846189	EE	On-Demand	Bother	CACNA1C	45	34
C[C@@]12COC[C@H]1CN(C(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1)C2	ZINC000853846189	EE	On-Demand	Bother	CACNA1D	74	34
C[C@H]1CN(c2ccc(NC(=O)N(C)Cc3cn(C)nn3)cc2F)C[C@H](C)O1	ZINC000853846190	GE	On-Demand	Anodyne	NPY2R	64	34
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000853846197	JH	On-Demand	Anodyne	LIMK2	18	42
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000853846197	JH	On-Demand	Anodyne	KCNK3	111	43
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000853846197	JH	On-Demand	Anodyne	KCNK9	73	37
COc1cccc([C@]2(C)CCN(C(=O)c3nccn3C)C2)c1	ZINC000853846266	CE	On-Demand	Anodyne	TACR2	16	40
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA2	128	60
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA1	117	60
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA7	54	53
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA5B	59	42
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA4	91	54
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA5A	63	42
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA14	48	57
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA12	92	52
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CA9	101	48
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	CYNT	45	43
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	NCE103	41	45
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	MTCA1	58	47
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853846267	GC	On-Demand	Reactive	P96878_MYCTU	73	47
COCc1csc(CNc2ccc([N+](=O)[O-])cc2C(C)=O)c1	ZINC000853846276	DH	On-Demand	Bother	CACNA1D	54	35
O=C(NC1CCN(S(=O)(=O)C(F)(F)F)CC1)NC1CC(CO)C1	ZINC000853846285	FC	On-Demand	Anodyne	EPHX2	27	40
COc1cccc([C@]2(C)CCN(C(=O)Nc3ccc4oc(=O)ccc4c3)C2)c1	ZINC000853846297	GH	On-Demand	Anodyne	EPHX2	32	41
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1nccs1	ZINC000853846307	ED	On-Demand	Reactive	MAP1	110	43
C[C@@H](CCCO)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853846332	FF	On-Demand	Anodyne	FPR1	45	33
O=[N+]([O-])c1ccc(-c2csc(NC[C@]34OCCC[C@H]3C4(F)F)n2)cc1	ZINC000853846412	FH	On-Demand	Bother	MAOB	15	48
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(Br)c1	ZINC000853846436	GF	On-Demand	Reactive	HDAC10	29	41
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(Br)c1	ZINC000853846436	GF	On-Demand	Reactive	HDAC2	15	41
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(Br)c1	ZINC000853846436	GF	On-Demand	Reactive	HDAC3	22	42
Cn1ncc2c(N3CCN(C(=O)COC(=O)c4ccc(S(C)(=O)=O)cc4)CC3)ncnc21	ZINC000853846439	JC	On-Demand	Anodyne	PDGFRB	45	39
Cn1ncc2c(N3CCN(C(=O)COC(=O)c4ccc(S(C)(=O)=O)cc4)CC3)ncnc21	ZINC000853846439	JC	On-Demand	Anodyne	GPR119	27	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@]3(O)C[C@H]3C2)CC1	ZINC000853846455	ED	On-Demand	Anodyne	KCNQ2	71	37
COCc1csc(CNc2cc([N+](=O)[O-])ccc2C(C)=O)c1	ZINC000853846471	DH	On-Demand	Bother	CACNA1D	52	35
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846472	HE	On-Demand	Anodyne	LOX1.1	42	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846472	HE	On-Demand	Anodyne	O49150_SOLTU	44	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846472	HE	On-Demand	Anodyne	KCNK3	76	33
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846472	HE	On-Demand	Anodyne	KCNK9	44	33
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846473	HE	On-Demand	Anodyne	LOX1.1	42	34
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846473	HE	On-Demand	Anodyne	O49150_SOLTU	44	34
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846473	HE	On-Demand	Anodyne	KCNK3	76	33
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853846473	HE	On-Demand	Anodyne	KCNK9	44	33
C=CCOCCCNc1ccnc2c(F)cccc12	ZINC000853846478	CG	On-Demand	Mild	HNMT	48	34
C=CCOCCCNc1ccnc2cc(OC)ccc12	ZINC000853846506	CG	On-Demand	Mild	HRP1_PLAFA	121	46
C=CCOCCCNc1ccnc2cc(OC)ccc12	ZINC000853846506	CG	On-Demand	Mild	HNMT	67	39
C=CCOCCCNc1ccnc2cc(OC)ccc12	ZINC000853846506	CG	On-Demand	Mild	BOTA	33	45
CN1CCN(c2ccccc2NC(=O)N2C[C@@H]3COC[C@]3(C)C2)CC1	ZINC000853846508	ED	On-Demand	Anodyne	KCNQ2	67	35
CN1CCN(c2ccccc2NC(=O)N2C[C@@H]3COC[C@@]3(C)C2)CC1	ZINC000853846509	ED	On-Demand	Anodyne	KCNQ2	67	35
CN1CCN(c2ccccc2NC(=O)N2C[C@H]3COC[C@@]3(C)C2)CC1	ZINC000853846510	ED	On-Demand	Anodyne	KCNQ2	67	35
CN1CCN(c2ccccc2NC(=O)N2C[C@H]3COC[C@]3(C)C2)CC1	ZINC000853846511	ED	On-Demand	Anodyne	KCNQ2	67	35
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000853846531	GD	On-Demand	Reactive	TBXA2R	19	40
CN(C[C@@H]1OCCN(C)[C@H]1c1cnn(C)c1)C(=O)Nc1cccnc1Cl	ZINC000853846535	GE	On-Demand	Anodyne	G2YM83_BOTF4	68	34
N#Cc1cnc2c(Cl)cccc2c1NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853846573	EH	On-Demand	Mild	MAP3K8	92	36
COCc1csc(CNc2c(C(=O)OC)cc([N+](=O)[O-])cc2[N+](=O)[O-])c1	ZINC000853846611	GG	On-Demand	Bother	CACNA1D	63	37
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000853846662	FD	On-Demand	Reactive	NMBR	58	35
CC[C@@](C)(NC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1)C1CC1	ZINC000853846671	FE	On-Demand	Anodyne	EPHX2	28	44
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA2	57	63
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA1	51	63
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA7	32	47
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA5B	57	33
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA4	51	49
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA5A	61	33
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA14	20	47
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA12	38	50
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	CA9	40	48
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	MTCA1	41	37
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853846677	GC	On-Demand	Reactive	P96878_MYCTU	52	37
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000853846682	GE	On-Demand	Reactive	TBXA2R	17	42
COc1cccc([C@]2(C)CCN(C(=O)Nc3cccnc3Cl)C2)c1	ZINC000853846683	EH	On-Demand	Anodyne	FAAH	15	49
COc1cccc([C@]2(C)CCN(C(=O)Nc3cccnc3Cl)C2)c1	ZINC000853846683	EH	On-Demand	Anodyne	NPY5R	23	42
COc1cccc([C@]2(C)CCN(C(=O)Nc3cccnc3Cl)C2)c1	ZINC000853846683	EH	On-Demand	Anodyne	EPHX2	20	41
COc1cccc([C@]2(C)CCN(C(=O)Nc3cccnc3Cl)C2)c1	ZINC000853846683	EH	On-Demand	Anodyne	G2YM83_BOTF4	72	39
COCc1csc(CNc2ncnc3sc(C)cc23)c1	ZINC000853846691	DH	On-Demand	Anodyne	CLK4	31	40
C=CCOCCCNc1c(C(=O)OCC)nnc2ccccc12	ZINC000853846693	DF	On-Demand	Mild	BCHE	52	34
COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)cc(C(=O)OC)c1	ZINC000853846709	JD	On-Demand	Anodyne	LOX1.1	42	34
COC(=O)c1cc(NC(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)cc(C(=O)OC)c1	ZINC000853846709	JD	On-Demand	Anodyne	O49150_SOLTU	43	34
COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)cc(C(=O)OC)c1	ZINC000853846710	JD	On-Demand	Anodyne	LOX1.1	42	34
COC(=O)c1cc(NC(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)cc(C(=O)OC)c1	ZINC000853846710	JD	On-Demand	Anodyne	O49150_SOLTU	43	34
COc1cccc([C@]2(C)CCN(C(=O)N3CCCCC3)C2)c1	ZINC000853846717	DG	On-Demand	Anodyne	GRIN2C	18	42
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@]4(O)C[C@H]4C3)cc2F)C[C@@H](C)O1	ZINC000853846720	FE	On-Demand	Anodyne	NPY2R	63	36
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@]4(O)C[C@H]4C3)cc2F)C[C@H](C)O1	ZINC000853846722	FE	On-Demand	Anodyne	NPY2R	63	36
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1nc2ccccc2s1	ZINC000853846723	GE	On-Demand	Reactive	CSNK1D	43	47
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1nc2ccccc2s1	ZINC000853846723	GE	On-Demand	Reactive	ST14	45	36
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1nc2ccccc2s1	ZINC000853846723	GE	On-Demand	Reactive	TMPRSS6	61	35
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc2c(c1)OCCO2	ZINC000853846724	GD	On-Demand	Reactive	QPCT	17	41
C[C@@H](CCCO)NC(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853846736	DE	On-Demand	Anodyne	ANPEP	16	41
CON(C)CCNC(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1	ZINC000853846812	GH	On-Demand	Anodyne	UTS2	41	34
CON(C)CCNC(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)c(C)s1	ZINC000853846813	GH	On-Demand	Anodyne	UTS2	41	34
O=C(N1CCCC1)N1CCC(n2nncc2I)CC1	ZINC000853846853	GD	On-Demand	Anodyne	L3MBTL3	60	37
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccc(S(C)(=O)=O)cc2)cc1OC	ZINC000853846855	IF	On-Demand	Anodyne	CPT1A	47	42
CON(C)CCNC(=O)N[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000853846856	DE	On-Demand	Anodyne	KCNQ2	50	42
CON(C)CCNC(=O)N[C@H](C)c1cccc(N2CCCC2)c1	ZINC000853846857	DE	On-Demand	Anodyne	KCNQ2	50	42
COc1ncccc1NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C	ZINC000853846872	FD	On-Demand	Reactive	P2RY1	44	38
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1nc2c(s1)CCCC2	ZINC000853846873	GE	On-Demand	Reactive	SLC27A1	30	40
O=C(NC/C=C/CO)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000853846879	EC	On-Demand	Anodyne	EPHX2	25	40
O=C(NC/C=C\CO)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000853846880	EC	On-Demand	Anodyne	EPHX2	25	40
COc1cccc([C@]2(C)CCN(C(=O)N3CCCC3)C2)c1	ZINC000853846903	CF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@]2(C)CCN(C(=O)N3CCCC3)C2)c1	ZINC000853846903	CF	On-Demand	Anodyne	GRIN2C	17	40
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853846915	GC	On-Demand	Reactive	CASP2	18	43
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853846915	GC	On-Demand	Reactive	CASP6	15	43
COc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846920	FD	On-Demand	Reactive	HRH2	18	44
COc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846920	FD	On-Demand	Reactive	CCR3	21	46
COc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846920	FD	On-Demand	Reactive	MTNR1A	51	43
COc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846920	FD	On-Demand	Reactive	MTNR1B	51	46
COc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846920	FD	On-Demand	Reactive	EPHX2	15	43
COc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853846920	FD	On-Demand	Reactive	TAAR1	31	40
CC[C@@H](O)CNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000853846939	EC	On-Demand	Anodyne	EPHX2	29	45
CN(Cc1cn(C)nn1)C(=O)Nc1cccnc1Cl	ZINC000853846955	CD	On-Demand	Anodyne	G2YM83_BOTF4	68	34
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853846993	GC	On-Demand	Anodyne	LOX1.1	42	36
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853846993	GC	On-Demand	Anodyne	O49150_SOLTU	50	36
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853846994	GC	On-Demand	Anodyne	LOX1.1	42	36
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853846994	GC	On-Demand	Anodyne	O49150_SOLTU	50	36
Cc1cc(C)c2c(O)nc(SCC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)nc2n1	ZINC000853847014	HH	On-Demand	Bother	ENPP1	46	32
Cc1nc(NC(=O)N2CC[C@@]3(O)C[C@H]3C2)sc1-c1ccccc1	ZINC000853847026	EG	On-Demand	Anodyne	NPY5R	22	43
Cc1nc(NC(=O)N2CC[C@@]3(O)C[C@H]3C2)sc1-c1ccccc1	ZINC000853847026	EG	On-Demand	Anodyne	PIK3CG	18	44
Cc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853847069	EE	On-Demand	Reactive	CCKAR	24	46
Cc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853847069	EE	On-Demand	Reactive	HDAC10	20	50
Cc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853847069	EE	On-Demand	Reactive	KCNK3	53	38
Cc1cccc(NC(=O)NNC(=O)CCCNC(=O)C(C)(C)C)c1	ZINC000853847069	EE	On-Demand	Reactive	KCNK9	43	38
O=C(NCC1CCC(O)CC1)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000853847090	GD	On-Demand	Anodyne	EPHX2	26	40
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853847127	GF	On-Demand	Reactive	EPHX2	30	54
CON(C)CCNC(=O)NC1CCN(S(=O)(=O)C(F)(F)F)CC1	ZINC000853847131	FC	On-Demand	Anodyne	EPHX2	27	42
CC[C@@H](NC(=O)Nc1cccnc1Cl)C1CC1	ZINC000853847193	CG	On-Demand	Anodyne	G2YM83_BOTF4	77	41
CC[C@@H](NC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CC1	ZINC000853847198	EH	On-Demand	Anodyne	NPY2R	78	42
CS(=O)(=O)c1ccc2ncnc(NC[C@]34OCCC[C@H]3C4(F)F)c2c1	ZINC000853847219	FE	On-Demand	Anodyne	CLK4	40	37
CN1CCN(c2nc3ccccc3nc2NC[C@]23OCCC[C@H]2C3(F)F)CC1	ZINC000853847220	GF	On-Demand	Anodyne	HTR3A	19	40
CC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CC1	ZINC000853847251	DF	On-Demand	Anodyne	KCNQ2	90	48
CC[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CC1	ZINC000853847251	DF	On-Demand	Anodyne	NPY2R	44	36
COc1ccc2c(NC[C@]34OCCC[C@H]3C4(F)F)ccnc2c1	ZINC000853847260	DG	On-Demand	Anodyne	HRP1_PLAFA	44	39
COc1ccc2c(NC[C@]34OCCC[C@H]3C4(F)F)ccnc2c1	ZINC000853847260	DG	On-Demand	Anodyne	HNMT	56	34
N#Cc1cnc2c(F)cc(F)cc2c1NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853847265	FH	On-Demand	Mild	MAP3K8	62	33
FC1(F)[C@@H]2CCCO[C@@]21CNc1ncnc2ccc(Br)cc12	ZINC000853847274	FH	On-Demand	Anodyne	EGFR	52	39
FC1(F)[C@@H]2CCCO[C@@]21CNc1ncnc2ccc(Br)cc12	ZINC000853847274	FH	On-Demand	Anodyne	DYRK1A	18	41
FC1(F)[C@@H]2CCCO[C@@]21CNc1ncnc2ccc(Br)cc12	ZINC000853847274	FH	On-Demand	Anodyne	CLK1	17	41
FC1(F)[C@@H]2CCCO[C@@]21CNc1ncnc2ccc(Br)cc12	ZINC000853847274	FH	On-Demand	Anodyne	CLK4	50	41
FC1(F)[C@@H]2CCCO[C@@]21CNc1ncnc2ccc(Br)cc12	ZINC000853847274	FH	On-Demand	Anodyne	DYRK1B	17	41
Fc1ccc2ncnc(NC[C@]34OCCC[C@H]3C4(F)F)c2c1	ZINC000853847275	DF	On-Demand	Anodyne	DYRK1A	18	41
Fc1ccc2ncnc(NC[C@]34OCCC[C@H]3C4(F)F)c2c1	ZINC000853847275	DF	On-Demand	Anodyne	CLK1	17	41
Fc1ccc2ncnc(NC[C@]34OCCC[C@H]3C4(F)F)c2c1	ZINC000853847275	DF	On-Demand	Anodyne	CLK4	52	41
Fc1ccc2ncnc(NC[C@]34OCCC[C@H]3C4(F)F)c2c1	ZINC000853847275	DF	On-Demand	Anodyne	DYRK1B	17	41
O=C(c1ccc(NC[C@]23OCCC[C@H]2C3(F)F)nc1)N1CCc2ccccc21	ZINC000853847286	GH	On-Demand	Anodyne	AVPR2	65	39
COc1ccc(CN(C)C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)cc1OC	ZINC000853847287	IE	On-Demand	Anodyne	MT-ND1	15	44
COc1ccc(CN(C)C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)cc1OC	ZINC000853847288	IE	On-Demand	Anodyne	MT-ND1	15	44
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1	ZINC000853847292	JD	On-Demand	Anodyne	TGM2	49	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1	ZINC000853847292	JD	On-Demand	Anodyne	F13A1	54	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1	ZINC000853847293	JD	On-Demand	Anodyne	TGM2	49	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)c3ccc(S(C)(=O)=O)cc3)CC2)cc1	ZINC000853847293	JD	On-Demand	Anodyne	F13A1	54	38
Fc1ccc2c(NC[C@]34OCCC[C@H]3C4(F)F)ccnc2c1	ZINC000853847373	DH	On-Demand	Anodyne	HNMT	44	34
CN1CCO[C@@H](CNC(=O)Nc2cccnc2Cl)[C@@H]1c1cnn(C)c1	ZINC000853847380	FD	On-Demand	Anodyne	G2YM83_BOTF4	70	35
Cn1cnc2c(NC[C@]34OCCC[C@H]3C4(F)F)ncnc21	ZINC000853847414	CD	On-Demand	Anodyne	ADORA1	23	48
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000853847428	HD	On-Demand	Anodyne	GPR119	30	41
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)C1	ZINC000853847430	HD	On-Demand	Anodyne	GPR119	30	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847441	HC	On-Demand	Anodyne	TRY2_BOVIN	41	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847441	HC	On-Demand	Anodyne	F13A1	19	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847441	HC	On-Demand	Anodyne	GPR119	55	44
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847442	HC	On-Demand	Anodyne	TRY2_BOVIN	41	40
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847442	HC	On-Demand	Anodyne	F13A1	19	41
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847442	HC	On-Demand	Anodyne	GPR119	55	44
O=[N+]([O-])c1ccc2ncnc(NC[C@]34OCCC[C@H]3C4(F)F)c2c1	ZINC000853847553	EF	On-Demand	Bother	CLK4	50	39
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853847610	JD	On-Demand	Anodyne	CA2	56	43
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853847610	JD	On-Demand	Anodyne	CA1	38	43
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853847610	JD	On-Demand	Anodyne	CA4	30	43
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853847610	JD	On-Demand	Anodyne	CA14	34	40
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853847610	JD	On-Demand	Anodyne	CA12	27	40
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853847610	JD	On-Demand	Anodyne	CA9	26	40
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853847610	JD	On-Demand	Anodyne	P96878_MYCTU	36	40
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847658	GD	On-Demand	Anodyne	O49150_SOLTU	43	34
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847658	GD	On-Demand	Anodyne	GPR119	47	40
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847659	GD	On-Demand	Anodyne	O49150_SOLTU	43	34
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(S(C)(=O)=O)cc2)CC1	ZINC000853847659	GD	On-Demand	Anodyne	GPR119	47	40
N#Cc1ccc(NC[C@]23OCCC[C@H]2C3(F)F)cc1C(F)(F)F	ZINC000853847679	EH	On-Demand	Mild	AR	52	41
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853847699	GF	On-Demand	Bother	EPHX2	15	43
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853847699	GF	On-Demand	Bother	L3MBTL3	55	36
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853847700	GF	On-Demand	Bother	EPHX2	15	43
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853847700	GF	On-Demand	Bother	L3MBTL3	55	36
COC[C@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(OC)c1	ZINC000853847719	GG	On-Demand	Bother	CACNA1C	53	37
COC[C@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(OC)c1	ZINC000853847719	GG	On-Demand	Bother	CACNA1D	87	37
COC[C@@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(OC)c1	ZINC000853847720	GG	On-Demand	Bother	CACNA1C	53	37
COC[C@@H](NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)c1cccc(OC)c1	ZINC000853847720	GG	On-Demand	Bother	CACNA1D	87	37
COCC1(NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CCCC1	ZINC000853847728	EG	On-Demand	Bother	CACNA1C	46	35
COCC1(NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CCCC1	ZINC000853847728	EG	On-Demand	Bother	CACNA1D	71	35
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000853847735	ED	On-Demand	Bother	CACNA1C	49	36
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000853847735	ED	On-Demand	Bother	CACNA1D	78	36
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	CCKAR	32	43
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	HDAC8	22	52
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	HDAC10	38	52
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	HDAC1	20	52
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	HDAC2	26	52
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	HDAC3	40	43
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	HDAC6	33	48
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	KCNK3	51	36
Cc1cccc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847743	GG	On-Demand	Reactive	KCNK9	41	35
COc1ccc2c(NCc3c(C4CC4)cnn3C)ccnc2c1	ZINC000853847744	DG	On-Demand	Anodyne	PDGFRB	20	43
COc1ccc2c(NCc3c(C4CC4)cnn3C)ccnc2c1	ZINC000853847744	DG	On-Demand	Anodyne	HRP1_PLAFA	115	44
COc1ccc2c(NCc3c(C4CC4)cnn3C)ccnc2c1	ZINC000853847744	DG	On-Demand	Anodyne	HNMT	61	36
Cc1nc(NC(=O)N2CCC[C@@H]2[C@H](C)O)sc1-c1ccccc1	ZINC000853847750	EG	On-Demand	Anodyne	PIK3CG	21	53
Cc1nc(NC(=O)N2CCC[C@@H]2[C@H](C)O)sc1-c1ccccc1	ZINC000853847750	EG	On-Demand	Anodyne	XIAP	25	40
Cc1nc(NC(=O)N2CCC[C@@H]2[C@@H](C)O)sc1-c1ccccc1	ZINC000853847751	EG	On-Demand	Anodyne	PIK3CG	21	53
Cc1nc(NC(=O)N2CCC[C@@H]2[C@@H](C)O)sc1-c1ccccc1	ZINC000853847751	EG	On-Demand	Anodyne	XIAP	25	40
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(F)cc1	ZINC000853847772	GG	On-Demand	Reactive	HDAC10	23	46
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(F)cc1	ZINC000853847772	GG	On-Demand	Reactive	HDAC2	16	46
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(F)cc1	ZINC000853847772	GG	On-Demand	Reactive	HDAC3	19	46
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(F)cc1	ZINC000853847772	GG	On-Demand	Reactive	HDAC6	17	46
FC1(F)[C@@H]2CCCO[C@@]21CNc1nc2ccccc2[nH]1	ZINC000853847783	CF	On-Demand	Anodyne	KCNN3	40	40
CC[C@@H](O)CNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000853847789	DD	On-Demand	Bother	CACNA1D	41	32
Cc1ccc(CC2CN(C(=O)Nc3cccnc3Cl)C2)cc1	ZINC000853847794	DH	On-Demand	Anodyne	CCR3	15	43
Cc1ccc(CC2CN(C(=O)Nc3cccnc3Cl)C2)cc1	ZINC000853847794	DH	On-Demand	Anodyne	G2YM83_BOTF4	71	37
Cc1cc(C)cc(NC(=O)NNC(=O)CCCCCNC(=O)OC(C)(C)C)c1	ZINC000853847836	GH	On-Demand	Reactive	HDAC10	16	43
CON(C)CCNC(=O)NCCc1ccccc1OC(F)(F)F	ZINC000853847871	ED	On-Demand	Anodyne	MTNR1A	31	43
O=C(NCCCc1nc[nH]n1)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000853847877	ED	On-Demand	Bother	SNCA	43	31
COc1ccc(OC(F)F)c(CNC(=O)NCCN(C)OC)c1	ZINC000853847884	ED	On-Demand	Anodyne	MTNR1A	42	39
COc1ccc(OC(F)F)c(CNC(=O)NCCN(C)OC)c1	ZINC000853847884	ED	On-Demand	Anodyne	MTNR1B	28	40
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(Cl)cn1	ZINC000853847885	GF	On-Demand	Reactive	F10	46	29
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(C#N)cc1	ZINC000853847891	GF	On-Demand	Reactive	HDAC10	17	44
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccc1F	ZINC000853847917	GG	On-Demand	Reactive	PAPA1_CARPA	28	41
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccc1F	ZINC000853847917	GG	On-Demand	Reactive	HDAC10	20	41
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccc1F	ZINC000853847917	GG	On-Demand	Reactive	TACR3	18	44
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccc1F	ZINC000853847917	GG	On-Demand	Reactive	HDAC3	15	41
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccc1F	ZINC000853847917	GG	On-Demand	Reactive	HDAC6	15	41
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853848018	GH	On-Demand	Bother	EPHX2	30	60
Cn1ncc(C2CC2)c1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853848029	DE	On-Demand	Bother	GSTM2	106	41
Cn1ncc(C2CC2)c1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853848029	DE	On-Demand	Bother	GSTP1	65	41
O=[N+]([O-])c1ccc(NC[C@]23OCCC[C@H]2C3(F)F)c2nonc12	ZINC000853848034	EE	On-Demand	Bother	GSTM2	101	45
O=[N+]([O-])c1ccc(NC[C@]23OCCC[C@H]2C3(F)F)c2nonc12	ZINC000853848034	EE	On-Demand	Bother	GSTP1	61	45
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccn1	ZINC000853848047	FE	On-Demand	Reactive	HDAC10	17	41
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccn1	ZINC000853848047	FE	On-Demand	Reactive	HDAC3	19	40
Cc1ccc(CC2CN(C(=O)N3CCOCC3)C2)cc1	ZINC000853848054	CD	On-Demand	Anodyne	AKR1C3	17	57
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@@H]3[C@H](C)O)cc2F)C[C@@H](C)O1	ZINC000853848067	FF	On-Demand	Anodyne	NPY2R	73	38
C[C@H]1CN(c2ccc(NC(=O)N3CCC[C@@H]3[C@@H](C)O)cc2F)C[C@@H](C)O1	ZINC000853848068	FF	On-Demand	Anodyne	NPY2R	73	38
CON(C)CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000853848075	DD	On-Demand	Bother	CACNA1C	43	34
CON(C)CCNC(=O)NCc1cc([N+](=O)[O-])ccc1Cl	ZINC000853848075	DD	On-Demand	Bother	CACNA1D	63	34
CS(=O)(=O)C1CN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000853848086	ED	On-Demand	Bother	EPHX2	17	42
CO[C@]1(CO)CCCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000853848088	FD	On-Demand	Bother	EPHX2	17	47
Cc1nc(NC(=O)N[C@H]2CCC[C@H]2Cc2cnn(C)c2)sc1C	ZINC000853848099	EG	On-Demand	Anodyne	CCR3	62	44
Cc1nc(NC(=O)N[C@H]2CCC[C@@H]2Cc2cnn(C)c2)sc1C	ZINC000853848100	EG	On-Demand	Anodyne	CCR3	62	44
Cc1nc(NC(=O)N[C@@H]2CCC[C@H]2Cc2cnn(C)c2)sc1C	ZINC000853848101	EG	On-Demand	Anodyne	CCR3	62	44
Cc1nc(NC(=O)N[C@@H]2CCC[C@@H]2Cc2cnn(C)c2)sc1C	ZINC000853848102	EG	On-Demand	Anodyne	CCR3	62	44
O=C1CC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)N1	ZINC000853848109	ED	On-Demand	Bother	P2RX7	19	44
O=C1CC[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)N1	ZINC000853848109	ED	On-Demand	Bother	SLC27A4	41	30
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(Cl)nc1	ZINC000853848121	GF	On-Demand	Reactive	HDAC10	15	44
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccc(Cl)nc1	ZINC000853848121	GF	On-Demand	Reactive	HDAC3	15	44
Cc1ccc(CC2CN(C(=O)Nc3cccc(N4CCOC4=O)c3)C2)cc1	ZINC000853848136	FH	On-Demand	Anodyne	CCR3	50	43
N#Cc1ccnc(NC[C@]23OCCC[C@H]2C3(F)F)c1	ZINC000853848145	CE	On-Demand	Mild	MAP3K12	49	36
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccnc1	ZINC000853848153	FE	On-Demand	Reactive	HDAC8	15	50
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccnc1	ZINC000853848153	FE	On-Demand	Reactive	HDAC10	18	44
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccnc1	ZINC000853848153	FE	On-Demand	Reactive	HDAC6	15	50
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccnc1	ZINC000853848153	FE	On-Demand	Reactive	NAMPT	28	50
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1nccs1	ZINC000853848155	FE	On-Demand	Reactive	MAP1	104	42
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1nccs1	ZINC000853848155	FE	On-Demand	Reactive	HDAC3	20	40
CN1C[C@@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC1=O	ZINC000853848167	ED	On-Demand	Bother	P2RX7	42	48
CN1C[C@H](CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC1=O	ZINC000853848168	ED	On-Demand	Bother	P2RX7	42	48
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(F)c1	ZINC000853848172	GG	On-Demand	Reactive	PAPA1_CARPA	22	42
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(F)c1	ZINC000853848172	GG	On-Demand	Reactive	HDAC8	18	40
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(F)c1	ZINC000853848172	GG	On-Demand	Reactive	HDAC10	31	48
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(F)c1	ZINC000853848172	GG	On-Demand	Reactive	HDAC1	15	48
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(F)c1	ZINC000853848172	GG	On-Demand	Reactive	HDAC2	20	48
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(F)c1	ZINC000853848172	GG	On-Demand	Reactive	HDAC3	33	42
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(F)c1	ZINC000853848172	GG	On-Demand	Reactive	HDAC6	29	46
Cc1ccc(CC2CN(C(=O)Nc3ccccc3N3CCN(C)CC3)C2)cc1	ZINC000853848175	GG	On-Demand	Anodyne	HTR1A	28	40
Cc1ccc(CC2CN(C(=O)Nc3ccccc3N3CCN(C)CC3)C2)cc1	ZINC000853848175	GG	On-Demand	Anodyne	HTR1B	27	40
Cc1ccc(CC2CN(C(=O)Nc3ccccc3N3CCN(C)CC3)C2)cc1	ZINC000853848175	GG	On-Demand	Anodyne	KCNQ2	74	40
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccnc1Cl	ZINC000853848181	GF	On-Demand	Reactive	G2YM83_BOTF4	43	32
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@@](O)(C2CC2)C1	ZINC000853848182	FF	On-Demand	Bother	EPHX2	17	44
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCC[C@](O)(C2CC2)C1	ZINC000853848183	FF	On-Demand	Bother	EPHX2	17	44
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCC[C@@H]2Cc2cnn(C)c2)CC1	ZINC000853848205	GF	On-Demand	Anodyne	KCNQ2	73	38
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCC[C@@H]2Cc2cnn(C)c2)CC1	ZINC000853848205	GF	On-Demand	Anodyne	CCR3	40	42
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCC[C@H]2Cc2cnn(C)c2)CC1	ZINC000853848206	GF	On-Demand	Anodyne	KCNQ2	73	38
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCC[C@H]2Cc2cnn(C)c2)CC1	ZINC000853848206	GF	On-Demand	Anodyne	CCR3	40	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@H]2Cc2cnn(C)c2)CC1	ZINC000853848207	GF	On-Demand	Anodyne	KCNQ2	73	38
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@H]2Cc2cnn(C)c2)CC1	ZINC000853848207	GF	On-Demand	Anodyne	CCR3	40	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@@H]2Cc2cnn(C)c2)CC1	ZINC000853848208	GF	On-Demand	Anodyne	KCNQ2	73	38
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCC[C@@H]2Cc2cnn(C)c2)CC1	ZINC000853848208	GF	On-Demand	Anodyne	CCR3	40	42
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N(CCN1CCOCC1)CC1CC1	ZINC000853848212	GF	On-Demand	Bother	CASR	46	35
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccc1Cl	ZINC000853848215	GH	On-Demand	Reactive	CCKAR	27	41
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1ccccc1Cl	ZINC000853848215	GH	On-Demand	Reactive	TACR3	17	44
COC(=O)c1occc1CNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853848231	FE	On-Demand	Anodyne	KCNQ2	75	43
Cc1ccc(CC2CN(C(=O)N3CCCC3)C2)cc1	ZINC000853848291	CF	On-Demand	Anodyne	GRIN2B	15	40
COCc1n[nH]c(CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)n1	ZINC000853848308	FD	On-Demand	Bother	CACNA1C	43	36
COCc1n[nH]c(CNC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)n1	ZINC000853848308	FD	On-Demand	Bother	CACNA1D	74	36
O=C(NC[C@H]1CCCS1)NNc1nc2ccc(Cl)cc2s1	ZINC000853848315	EG	On-Demand	Reactive	CSNK1D	34	41
Cc1nc(NC(=O)Nc2ccn(C3CCOCC3)n2)sc1-c1ccccc1	ZINC000853848334	GI	On-Demand	Anodyne	PIK3CA	15	42
Cc1nc(NC(=O)Nc2ccn(C3CCOCC3)n2)sc1-c1ccccc1	ZINC000853848334	GI	On-Demand	Anodyne	PIK3CG	28	42
O=C(Nc1ccc(Cl)nc1)Nc1ccn(C2CCOCC2)n1	ZINC000853848347	DF	On-Demand	Anodyne	MTOR	43	33
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@@H](O)C(F)(F)C1	ZINC000853848363	EE	On-Demand	Bother	EPHX2	19	43
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CC[C@H](O)C(F)(F)C1	ZINC000853848368	EE	On-Demand	Bother	EPHX2	19	43
CCN1CC[C@H](N(CC)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000853848382	FF	On-Demand	Bother	CCR5	28	43
CCN1CC[C@@H](N(CC)C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000853848383	FF	On-Demand	Bother	CCR5	28	43
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853848404	FF	On-Demand	Bother	CPT1A	49	38
O=C(NCc1cc([N+](=O)[O-])ccc1Cl)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853848407	FF	On-Demand	Bother	CPT1A	49	38
COC(=O)[C@@H]1CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C	ZINC000853848417	FF	On-Demand	Bother	EPHX2	15	40
CN1CCN(c2ccccc2NC(=O)NC[C@@H](CO)CC2CC2)CC1	ZINC000853848418	ED	On-Demand	Anodyne	KCNQ2	77	40
CN1CCN(c2ccccc2NC(=O)NC[C@H](CO)CC2CC2)CC1	ZINC000853848420	ED	On-Demand	Anodyne	KCNQ2	77	40
O=C(NC[C@@H](CO)CC1CC1)Nc1cccnc1Cl	ZINC000853848422	CE	On-Demand	Anodyne	G2YM83_BOTF4	73	38
O=C(NC[C@H](CO)CC1CC1)Nc1cccnc1Cl	ZINC000853848424	CE	On-Demand	Anodyne	G2YM83_BOTF4	73	38
O=C(NCC(O)(C1CC1)C1CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853848437	FE	On-Demand	Bother	CACNA1C	50	38
O=C(NCC(O)(C1CC1)C1CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853848437	FE	On-Demand	Bother	CACNA1D	77	38
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000853848468	FD	On-Demand	Mild	HTR1A	49	42
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000853848468	FD	On-Demand	Mild	DRD2	36	42
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1=O	ZINC000853848468	FD	On-Demand	Mild	DRD3	44	36
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853848469	FD	On-Demand	Mild	HTR1A	49	42
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853848469	FD	On-Demand	Mild	DRD2	36	42
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853848469	FD	On-Demand	Mild	DRD3	44	36
CN1C[C@@H](CNC(=O)Nc2cccnc2Cl)CC1=O	ZINC000853848476	CD	On-Demand	Anodyne	G2YM83_BOTF4	70	38
CN1C[C@H](CNC(=O)Nc2cccnc2Cl)CC1=O	ZINC000853848477	CD	On-Demand	Anodyne	G2YM83_BOTF4	70	38
C[C@H]1CN(c2ccc(NC(=O)NC[C@H]3CC(=O)N(C)C3)cc2F)C[C@@H](C)O1	ZINC000853848493	GE	On-Demand	Anodyne	NPY2R	70	37
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(C#N)c1	ZINC000853848510	GF	On-Demand	Reactive	CCR3	17	44
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(C#N)c1	ZINC000853848510	GF	On-Demand	Reactive	HDAC10	24	47
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(C#N)c1	ZINC000853848510	GF	On-Demand	Reactive	HDAC3	18	41
CC(C)(C)OC(=O)NCCCCCC(=O)NNC(=O)Nc1cccc(C#N)c1	ZINC000853848510	GF	On-Demand	Reactive	HDAC6	17	45
CN1CCN(c2ccccc2NC(=O)Nc2ccn(C3CCOCC3)n2)CC1	ZINC000853848522	GF	On-Demand	Anodyne	KCNQ2	69	37
CC[C@@](C)(NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CC1	ZINC000853848524	EH	On-Demand	Bother	CACNA1C	51	37
CC[C@@](C)(NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CC1	ZINC000853848524	EH	On-Demand	Bother	CACNA1D	80	37
CC[C@@](C)(NC(=O)NCc1cc([N+](=O)[O-])ccc1Cl)C1CC1	ZINC000853848524	EH	On-Demand	Bother	SLC27A4	52	33
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H]3CC(=O)N(C)C3)cc2F)C[C@@H](C)O1	ZINC000853848535	GE	On-Demand	Anodyne	NPY2R	70	37
CN1CCN(c2ccccc2NC(=O)N2CCC(=O)N(C)CC2)CC1	ZINC000853848547	ED	On-Demand	Anodyne	HTR1B	19	48
CN1CCN(c2ccccc2NC(=O)N2CCC(=O)N(C)CC2)CC1	ZINC000853848547	ED	On-Demand	Anodyne	KCNQ2	75	39
CN1CCN(c2ccccc2NC(=O)N2CCC(=O)N(C)CC2)CC1	ZINC000853848547	ED	On-Demand	Anodyne	RBP4	21	43
Cc1nc(NC(=O)NC[C@@H](CO)CC2CC2)sc1-c1ccccc1	ZINC000853848555	EH	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)NC[C@H](CO)CC2CC2)sc1-c1ccccc1	ZINC000853848556	EH	On-Demand	Anodyne	PIK3CG	20	41
CN1CCN(C(=O)Nc2cccnc2Cl)CCC1=O	ZINC000853848563	CD	On-Demand	Anodyne	FAAH	17	42
CN1CCN(C(=O)Nc2cccnc2Cl)CCC1=O	ZINC000853848563	CD	On-Demand	Anodyne	RBP4	20	40
CN1CCN(C(=O)Nc2cccnc2Cl)CCC1=O	ZINC000853848563	CD	On-Demand	Anodyne	G2YM83_BOTF4	73	39
CN1CCN(c2ccccc2NC(=O)NCC(O)(C2CC2)C2CC2)CC1	ZINC000853848564	FE	On-Demand	Anodyne	KCNQ2	83	41
C[C@H]1CN(c2ccc(NC(=O)NC[C@H](CO)CC3CC3)cc2F)C[C@@H](C)O1	ZINC000853848598	GF	On-Demand	Anodyne	NPY2R	72	41
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H](CO)CC3CC3)cc2F)C[C@@H](C)O1	ZINC000853848599	GF	On-Demand	Anodyne	NPY2R	72	41
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1=O	ZINC000853848680	EC	On-Demand	Anodyne	HTR1A	51	41
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1=O	ZINC000853848680	EC	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1=O	ZINC000853848680	EC	On-Demand	Anodyne	DRD3	51	38
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1=O	ZINC000853848681	EC	On-Demand	Anodyne	HTR1A	51	41
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1=O	ZINC000853848681	EC	On-Demand	Anodyne	DRD2	40	41
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1=O	ZINC000853848681	EC	On-Demand	Anodyne	DRD3	51	38
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3ccccn3)O2)C1	ZINC000853848698	FE	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3ccccn3)O2)C1	ZINC000853848699	FE	On-Demand	Anodyne	GPR119	15	41
C[C@H]1CCC[C@@H](CNc2nccc(N3CCCC3)n2)O1	ZINC000853848708	CE	On-Demand	Anodyne	SORD	55	35
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848713	GD	On-Demand	Anodyne	HTR1A	68	44
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848713	GD	On-Demand	Anodyne	DRD2	56	43
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848713	GD	On-Demand	Anodyne	DRD4	36	41
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848713	GD	On-Demand	Anodyne	ADRA1D	49	38
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848713	GD	On-Demand	Anodyne	ADRA1A	46	38
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848713	GD	On-Demand	Anodyne	DRD3	66	39
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848713	GD	On-Demand	Anodyne	HTR7	46	37
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848714	GD	On-Demand	Anodyne	HTR1A	68	44
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848714	GD	On-Demand	Anodyne	DRD2	56	43
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848714	GD	On-Demand	Anodyne	DRD4	36	41
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848714	GD	On-Demand	Anodyne	ADRA1D	49	38
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848714	GD	On-Demand	Anodyne	ADRA1A	46	38
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848714	GD	On-Demand	Anodyne	DRD3	66	39
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853848714	GD	On-Demand	Anodyne	HTR7	46	37
O=C(NCC(O)(C1CC1)C1CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853848760	EI	On-Demand	Anodyne	CA1	19	41
O=C(NCC(O)(C1CC1)C1CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853848760	EI	On-Demand	Anodyne	PRNP	40	40
O=C(NCC(O)(C1CC1)C1CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853848760	EI	On-Demand	Anodyne	ROCK2	15	46
O=C(NCC(O)(C1CC1)C1CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853848760	EI	On-Demand	Anodyne	MTOR	49	40
O=C(NCC(O)(C1CC1)C1CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853848760	EI	On-Demand	Anodyne	DGAT1	24	43
Cc1nsc(C(=O)N[C@@H](C)CN2CCC(C)CC2)n1	ZINC000853848817	CD	On-Demand	Anodyne	PLD1	41	34
Cc1nsc(C(=O)N[C@H](C)CN2CCC(C)CC2)n1	ZINC000853848818	CD	On-Demand	Anodyne	PLD1	41	34
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1=O	ZINC000853848820	GE	On-Demand	Anodyne	HTR1A	38	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1=O	ZINC000853848820	GE	On-Demand	Anodyne	DRD2	27	40
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1=O	ZINC000853848821	GE	On-Demand	Anodyne	HTR1A	38	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1=O	ZINC000853848821	GE	On-Demand	Anodyne	DRD2	27	40
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1=O	ZINC000853848822	GE	On-Demand	Anodyne	HTR1A	38	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1=O	ZINC000853848822	GE	On-Demand	Anodyne	DRD2	27	40
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1=O	ZINC000853848823	GE	On-Demand	Anodyne	HTR1A	38	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1=O	ZINC000853848823	GE	On-Demand	Anodyne	DRD2	27	40
C[C@H]1CCC[C@@H](CNc2ncnc3c2c(Br)nn3C)O1	ZINC000853848847	EE	On-Demand	Anodyne	TNK2	50	33
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3ccccc3F)O2)C1	ZINC000853848854	GG	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3ccccc3F)O2)C1	ZINC000853848855	GG	On-Demand	Anodyne	GPR119	18	42
CC[C@@H]1CCC[C@H]1NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853848894	DF	On-Demand	Reactive	SLC27A4	42	31
CC[C@H]1CCC[C@@H]1NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853848895	DF	On-Demand	Reactive	SLC27A4	42	31
CC[C@H]1CCC[C@H]1NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853848896	DF	On-Demand	Reactive	SLC27A4	42	31
CC[C@@H]1CCC[C@@H]1NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853848897	DF	On-Demand	Reactive	SLC27A4	42	31
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	HTR1A	65	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	DRD2	63	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	DRD4	42	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	ADRA1D	74	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	ADRA1A	63	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	ADRA1B	59	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	DRD3	62	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	HTR7	49	38
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848911	GG	On-Demand	Reactive	CCR3	29	41
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	HTR1A	65	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	DRD2	63	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	DRD4	42	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	ADRA1D	74	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	ADRA1A	63	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	ADRA1B	59	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	DRD3	62	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	HTR7	49	38
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853848912	GG	On-Demand	Reactive	CCR3	29	41
CC[C@@](C)(NC(=O)Nc1cccnc1Cl)C1CC1	ZINC000853848919	CG	On-Demand	Anodyne	G2YM83_BOTF4	76	41
COC(=O)c1sccc1NC(=O)N(C)CCN(C)C(=O)OC	ZINC000853848950	ED	On-Demand	Anodyne	FAS	53	52
CN1C[C@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848985	DF	On-Demand	Anodyne	CCR3	34	40
CN1C[C@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848985	DF	On-Demand	Anodyne	CCKBR	41	37
CN1C[C@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848985	DF	On-Demand	Anodyne	MCHR1	18	41
CN1C[C@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848985	DF	On-Demand	Anodyne	NAMPT	17	42
CN1C[C@@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848986	DF	On-Demand	Anodyne	CCR3	34	40
CN1C[C@@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848986	DF	On-Demand	Anodyne	CCKBR	41	37
CN1C[C@@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848986	DF	On-Demand	Anodyne	MCHR1	18	41
CN1C[C@@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853848986	DF	On-Demand	Anodyne	NAMPT	17	42
O=C(NCC(O)(C1CC1)C1CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853848995	FE	On-Demand	Bother	SLC27A4	42	30
O=C(NCC(O)(C1CC1)C1CC1)Nc1cccnc1Cl	ZINC000853849006	CE	On-Demand	Anodyne	G2YM83_BOTF4	71	38
COC(=O)c1cccc(NC(=O)N(C)CCN(C)C(=O)OC)c1	ZINC000853849034	DD	On-Demand	Anodyne	KCNK3	100	37
COC(=O)c1cccc(NC(=O)N(C)CCN(C)C(=O)OC)c1	ZINC000853849034	DD	On-Demand	Anodyne	KCNK9	63	35
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849050	FG	On-Demand	Reactive	HTR1A	53	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849050	FG	On-Demand	Reactive	DRD2	50	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849050	FG	On-Demand	Reactive	ADRA1D	58	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849050	FG	On-Demand	Reactive	ADRA1A	49	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849050	FG	On-Demand	Reactive	ADRA1B	45	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849050	FG	On-Demand	Reactive	DRD3	55	39
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849050	FG	On-Demand	Reactive	NPY1R	15	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849051	FG	On-Demand	Reactive	HTR1A	53	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849051	FG	On-Demand	Reactive	DRD2	50	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849051	FG	On-Demand	Reactive	ADRA1D	58	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849051	FG	On-Demand	Reactive	ADRA1A	49	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849051	FG	On-Demand	Reactive	ADRA1B	45	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849051	FG	On-Demand	Reactive	DRD3	55	39
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853849051	FG	On-Demand	Reactive	NPY1R	15	40
Cc1nc(NC(=O)NC[C@H]2CC(=O)N(C)C2)sc1-c1ccccc1	ZINC000853849058	EF	On-Demand	Anodyne	PIK3CG	21	41
Cc1nc(NC(=O)NC[C@H]2CC(=O)N(C)C2)sc1-c1ccccc1	ZINC000853849058	EF	On-Demand	Anodyne	PI4KB	38	42
Cc1nc(NC(=O)NC[C@H]2CC(=O)N(C)C2)sc1-c1ccccc1	ZINC000853849058	EF	On-Demand	Anodyne	PDE8B	40	31
Cc1nc(NC(=O)NC[C@@H]2CC(=O)N(C)C2)sc1-c1ccccc1	ZINC000853849059	EF	On-Demand	Anodyne	PIK3CG	21	41
Cc1nc(NC(=O)NC[C@@H]2CC(=O)N(C)C2)sc1-c1ccccc1	ZINC000853849059	EF	On-Demand	Anodyne	PI4KB	38	42
Cc1nc(NC(=O)NC[C@@H]2CC(=O)N(C)C2)sc1-c1ccccc1	ZINC000853849059	EF	On-Demand	Anodyne	PDE8B	40	31
CON(C)CCNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849102	ED	On-Demand	Anodyne	GRIN2B	15	43
CON(C)CCNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849102	ED	On-Demand	Anodyne	C3AR1	40	40
CON(C)CCNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849102	ED	On-Demand	Anodyne	EPHX2	29	45
CON(C)CCNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849102	ED	On-Demand	Anodyne	MCHR1	15	43
CON(C)CCNC(=O)N[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849102	ED	On-Demand	Anodyne	BIRC2	25	41
CON(C)CCNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849103	ED	On-Demand	Anodyne	GRIN2B	15	43
CON(C)CCNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849103	ED	On-Demand	Anodyne	C3AR1	40	40
CON(C)CCNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849103	ED	On-Demand	Anodyne	EPHX2	29	45
CON(C)CCNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849103	ED	On-Demand	Anodyne	MCHR1	15	43
CON(C)CCNC(=O)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853849103	ED	On-Demand	Anodyne	BIRC2	25	41
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849167	GF	On-Demand	Reactive	HTR1A	26	41
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849167	GF	On-Demand	Reactive	DRD2	26	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849167	GF	On-Demand	Reactive	ADRA1D	33	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849167	GF	On-Demand	Reactive	ADRA1A	26	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849167	GF	On-Demand	Reactive	ADRA1B	26	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849167	GF	On-Demand	Reactive	WDR5	33	42
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849169	GF	On-Demand	Reactive	HTR1A	26	41
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849169	GF	On-Demand	Reactive	DRD2	26	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849169	GF	On-Demand	Reactive	ADRA1D	33	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849169	GF	On-Demand	Reactive	ADRA1A	26	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849169	GF	On-Demand	Reactive	ADRA1B	26	43
COc1ccccc1N1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853849169	GF	On-Demand	Reactive	WDR5	33	42
CON(C)CCNC(=O)NC[C@H]1CCN(CC(C)C)C1	ZINC000853849204	CC	On-Demand	Anodyne	CACNA1I	54	36
CON(C)CCNC(=O)NC[C@@H]1CCN(CC(C)C)C1	ZINC000853849205	CC	On-Demand	Anodyne	CACNA1I	54	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	HTR1A	64	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	DRD2	52	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	DRD4	28	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	ADRA1D	57	37
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	ADRA1A	52	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	ADRA1B	43	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	DRD3	57	39
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849256	GE	On-Demand	Mild	HTR7	42	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	HTR1A	64	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	DRD2	52	46
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	DRD4	28	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	ADRA1D	57	37
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	ADRA1A	52	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	ADRA1B	43	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	DRD3	57	39
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849257	GE	On-Demand	Mild	HTR7	42	38
C[C@H]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)O1	ZINC000853849261	CF	On-Demand	Bother	GSTM2	116	49
C[C@H]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)O1	ZINC000853849261	CF	On-Demand	Bother	GSTP1	72	49
C[C@H]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)O1	ZINC000853849261	CF	On-Demand	Bother	EPAS1	58	31
Cc1nc(NC(=O)NCC(O)(C2CC2)C2CC2)sc1-c1ccccc1	ZINC000853849290	FH	On-Demand	Anodyne	PIK3CG	23	46
Cc1nc(NC(=O)NCC(O)(C2CC2)C2CC2)sc1-c1ccccc1	ZINC000853849290	FH	On-Demand	Anodyne	PI4KB	43	42
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3cccc(C#N)c3)O2)C1	ZINC000853849291	GF	On-Demand	Mild	CCR3	18	42
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3cccc(C#N)c3)O2)C1	ZINC000853849291	GF	On-Demand	Mild	MCHR1	28	43
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CCC1	ZINC000853849292	DE	On-Demand	Anodyne	SLC12A5	42	36
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CCC1	ZINC000853849292	DE	On-Demand	Anodyne	HCN1	49	30
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CCC1	ZINC000853849292	DE	On-Demand	Anodyne	HCN4	47	30
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3cccc(C#N)c3)O2)C1	ZINC000853849294	GF	On-Demand	Mild	CCR3	18	42
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3cccc(C#N)c3)O2)C1	ZINC000853849294	GF	On-Demand	Mild	MCHR1	28	43
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3ccc(Cl)cn3)O2)C1	ZINC000853849309	GG	On-Demand	Anodyne	F10	48	32
CC(C)(C)OC(=O)C(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853849310	FD	On-Demand	Anodyne	HTR1A	33	41
CC(C)(C)OC(=O)C(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853849310	FD	On-Demand	Anodyne	DRD2	24	42
CC(C)(C)OC(=O)C(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853849310	FD	On-Demand	Anodyne	DRD3	28	42
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3ccc(Cl)cn3)O2)C1	ZINC000853849311	GG	On-Demand	Anodyne	F10	48	32
O=C1CC[C@@H](CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)N1	ZINC000853849384	EC	On-Demand	Bother	CACNA1C	51	38
O=C1CC[C@@H](CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)N1	ZINC000853849384	EC	On-Demand	Bother	CACNA1D	81	38
COC(=O)c1cccc(NNC(=O)NC[C@@H]2CCN(CC(C)C)C2)c1C	ZINC000853849389	FE	On-Demand	Reactive	HTR4	52	37
COC(=O)c1cccc(NNC(=O)NC[C@@H]2CCN(CC(C)C)C2)c1C	ZINC000853849389	FE	On-Demand	Reactive	CACNA1I	42	34
COC(=O)c1cccc(NNC(=O)NC[C@H]2CCN(CC(C)C)C2)c1C	ZINC000853849391	FE	On-Demand	Reactive	HTR4	52	37
COC(=O)c1cccc(NNC(=O)NC[C@H]2CCN(CC(C)C)C2)c1C	ZINC000853849391	FE	On-Demand	Reactive	CACNA1I	42	34
C[C@@]1(CNc2nc(-c3cccnc3)nc3ccccc23)CC1(F)F	ZINC000853849420	EI	On-Demand	Anodyne	PKN2	18	41
C[C@]1(CNc2nc(-c3cccnc3)nc3ccccc23)CC1(F)F	ZINC000853849422	EI	On-Demand	Anodyne	PKN2	18	41
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1C[C@H](O)C12CCC2	ZINC000853849442	ED	On-Demand	Anodyne	STAT6	54	33
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853849444	ED	On-Demand	Anodyne	STAT6	54	33
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853849446	ED	On-Demand	Anodyne	STAT6	54	33
O=C(Nc1ccc(N2CCOCC2)cn1)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853849448	ED	On-Demand	Anodyne	STAT6	54	33
CN1C[C@@H](CNC(=O)Nc2cccc(N3CCOC3=O)c2)CC1=O	ZINC000853849449	ED	On-Demand	Anodyne	EPHX2	19	41
CN1C[C@H](CNC(=O)Nc2cccc(N3CCOC3=O)c2)CC1=O	ZINC000853849450	ED	On-Demand	Anodyne	EPHX2	19	41
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	DRD4	42	32
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	HRH2	16	48
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	CCR3	27	48
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	MTNR1A	66	45
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	MTNR1B	61	48
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	ROCK2	32	46
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	EPHX2	16	46
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	TAAR1	35	43
COC(=O)N(C)CCNC(=O)Nc1cccc(OC)c1	ZINC000853849451	CD	On-Demand	Anodyne	KCNK3	43	38
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CC(=O)N(C)C2)CC1	ZINC000853849486	ED	On-Demand	Anodyne	KCNQ2	77	40
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CC(=O)N(C)C2)CC1	ZINC000853849488	ED	On-Demand	Anodyne	KCNQ2	77	40
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(CC(C)C)C1	ZINC000853849490	FD	On-Demand	Mild	CACNA1I	41	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(CC(C)C)C1	ZINC000853849491	FD	On-Demand	Mild	CACNA1I	41	32
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1=O	ZINC000853849549	FF	On-Demand	Reactive	HTR1A	44	39
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1=O	ZINC000853849549	FF	On-Demand	Reactive	DRD3	42	37
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1=O	ZINC000853849549	FF	On-Demand	Reactive	P2RX7	16	43
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1=O	ZINC000853849550	FF	On-Demand	Reactive	HTR1A	44	39
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1=O	ZINC000853849550	FF	On-Demand	Reactive	DRD3	42	37
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1=O	ZINC000853849550	FF	On-Demand	Reactive	P2RX7	16	43
CN1CCN(c2ccccc2NC(=O)NCc2nc(C(N)=O)cs2)CC1	ZINC000853849556	FD	On-Demand	Anodyne	KCNQ2	71	38
CN1CCN(c2ccccc2NC(=O)NCc2nc(C(N)=O)cs2)CC1	ZINC000853849556	FD	On-Demand	Anodyne	CHEK1	16	44
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1=O	ZINC000853849561	GC	On-Demand	Anodyne	HTR1A	45	40
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1=O	ZINC000853849561	GC	On-Demand	Anodyne	DRD2	33	40
COc1ccccc1N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1=O	ZINC000853849561	GC	On-Demand	Anodyne	DRD3	43	36
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1=O	ZINC000853849562	GC	On-Demand	Anodyne	HTR1A	45	40
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1=O	ZINC000853849562	GC	On-Demand	Anodyne	DRD2	33	40
COc1ccccc1N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1=O	ZINC000853849562	GC	On-Demand	Anodyne	DRD3	43	36
COCCN(CCF)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853849563	FD	On-Demand	Anodyne	HTR1A	55	42
COCCN(CCF)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853849563	FD	On-Demand	Anodyne	DRD2	48	41
COCCN(CCF)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853849563	FD	On-Demand	Anodyne	DRD3	56	38
COCCN(CCF)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1=O	ZINC000853849563	FD	On-Demand	Anodyne	ACKR3	62	32
C[C@H]1CN(c2ccc(NC(=O)NCC(O)(C3CC3)C3CC3)cc2F)C[C@H](C)O1	ZINC000853849653	GG	On-Demand	Anodyne	NPY2R	73	40
C[C@H]1CN(c2ccc(NC(=O)NCC(O)(C3CC3)C3CC3)cc2F)C[C@@H](C)O1	ZINC000853849654	GG	On-Demand	Anodyne	NPY2R	73	40
Cn1cnc2c(N[C@H]3CCc4cc(NC(=O)OC(C)(C)C)ccc43)ncnc21	ZINC000853849673	GH	On-Demand	Anodyne	ADORA1	16	46
Cn1cnc2c(N[C@@H]3CCc4cc(NC(=O)OC(C)(C)C)ccc43)ncnc21	ZINC000853849675	GH	On-Demand	Anodyne	ADORA1	16	46
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853849685	FF	On-Demand	Anodyne	HTR1A	15	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853849685	FF	On-Demand	Anodyne	DRD2	17	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853849685	FF	On-Demand	Anodyne	DRD1	21	40
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853849685	FF	On-Demand	Anodyne	HTR7	15	46
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853849685	FF	On-Demand	Anodyne	KCNQ2	73	47
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853849685	FF	On-Demand	Anodyne	TRPV1	18	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2CCc3ccc(O)cc32)CC1	ZINC000853849685	FF	On-Demand	Anodyne	NPY1R	28	40
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853849688	FF	On-Demand	Anodyne	HTR1A	15	43
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853849688	FF	On-Demand	Anodyne	DRD2	17	43
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853849688	FF	On-Demand	Anodyne	DRD1	21	40
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853849688	FF	On-Demand	Anodyne	HTR7	15	46
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853849688	FF	On-Demand	Anodyne	KCNQ2	73	47
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853849688	FF	On-Demand	Anodyne	TRPV1	18	42
CN1CCN(c2ccccc2NC(=O)N[C@H]2CCc3ccc(O)cc32)CC1	ZINC000853849688	FF	On-Demand	Anodyne	NPY1R	28	40
CC(=O)c1c(F)cccc1NCC[C@]1(C)CC1(F)F	ZINC000853849690	CH	On-Demand	Anodyne	ICMT	29	40
CC(=O)c1c(F)cccc1NCC[C@@]1(C)CC1(F)F	ZINC000853849692	CH	On-Demand	Anodyne	ICMT	29	40
CN1CCN(C(=O)Nc2ccc(Cl)nc2)CCC1=O	ZINC000853849706	CD	On-Demand	Anodyne	PDGFRB	41	37
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	BMP1	18	43
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	CA1	40	40
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	MTNR1A	48	39
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	MTNR1B	38	46
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	ROCK2	15	44
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	NPY5R	19	40
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	ACR	22	40
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	CA12	22	46
COC(=O)N(C)CCNC(=O)Nc1ccc(OC)cc1	ZINC000853849720	CD	On-Demand	Anodyne	CA9	23	46
CN1C[C@@H](CNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CC1=O	ZINC000853849758	ED	On-Demand	Bother	CACNA1D	51	35
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H]1CCc2ccc(O)cc21	ZINC000853849774	FG	On-Demand	Anodyne	NPY1R	28	40
Cn1ncc(C#N)c1N[C@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21	ZINC000853849776	FH	On-Demand	Mild	CSNK2A1	72	37
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853849777	FG	On-Demand	Anodyne	NPY1R	28	40
Cn1ncc(C#N)c1N[C@@H]1CCc2cc(NC(=O)OC(C)(C)C)ccc21	ZINC000853849780	FH	On-Demand	Mild	CSNK2A1	72	37
COC(=O)N(C)CCNC(=O)Nc1ccc2c(c1)OCO2	ZINC000853849805	CD	On-Demand	Anodyne	DYRK2	51	34
O=C1CC[C@@H](CNC(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)N1	ZINC000853849832	EC	On-Demand	Bother	SLC27A4	42	30
Cc1nc(C(=O)N[C@@H](C)CN2CCC(C)CC2)no1	ZINC000853849853	CD	On-Demand	Anodyne	PLD1	49	36
Cc1nc(C(=O)N[C@H](C)CN2CCC(C)CC2)no1	ZINC000853849854	CD	On-Demand	Anodyne	PLD1	49	36
C#CCCN(CCOC)C(=O)NCC1(Cc2ccccc2)CCC1	ZINC000853849860	EG	On-Demand	Mild	SLC12A5	45	34
COC(=O)N(C)CCNC(=O)Nc1cccnc1OC	ZINC000853849866	CC	On-Demand	Anodyne	P2RY1	43	38
COC(=O)N(C)CCNC(=O)Nc1ccc2c(c1)OCCO2	ZINC000853849874	DD	On-Demand	Anodyne	QPCT	17	40
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853849877	GC	On-Demand	Anodyne	HRH2	31	42
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853849877	GC	On-Demand	Anodyne	NPY1R	46	36
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2CCC[C@H]2C(N)=O)c1	ZINC000853849877	GC	On-Demand	Anodyne	CCR3	54	41
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853849878	GC	On-Demand	Anodyne	HRH2	31	42
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853849878	GC	On-Demand	Anodyne	NPY1R	46	36
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2CCC[C@@H]2C(N)=O)c1	ZINC000853849878	GC	On-Demand	Anodyne	CCR3	54	41
COC(=O)N(C)CCNC(=O)Nc1ccc(F)cc1	ZINC000853849881	CD	On-Demand	Anodyne	CCR3	22	41
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3ccc(F)cc13)C2	ZINC000853849886	FG	On-Demand	Anodyne	SIRT3	40	39
COC(=O)N(C)CCNC(=O)Nc1ccccc1C(C)C	ZINC000853849898	CF	On-Demand	Anodyne	SOAT1	54	38
CC(C)(C)OC(=O)NCC12CC(CN1c1ncccc1C(F)(F)F)C2	ZINC000853849906	FH	On-Demand	Anodyne	TRPV1	19	43
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA2	150	58
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA1	140	58
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA7	61	46
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA13	19	41
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA5B	63	42
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA4	109	52
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA5A	67	42
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA14	60	45
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA12	112	49
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CA9	119	49
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	CYNT	48	41
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	NCE103	49	55
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	MTCA1	63	51
COC(=O)N(C)CCNC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853849911	EC	On-Demand	Anodyne	P96878_MYCTU	80	51
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853849912	FG	On-Demand	Anodyne	CPT1A	76	36
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853849913	FG	On-Demand	Anodyne	CPT1A	76	36
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853849914	FG	On-Demand	Anodyne	CPT1A	76	36
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853849915	FG	On-Demand	Anodyne	CPT1A	76	36
CN1CCN(c2ccccc2NC(=O)N(Cc2ccccc2F)CC2CC2)CC1	ZINC000853849937	GI	On-Demand	Anodyne	KCNQ2	78	42
COC(=O)N(C)CCNC(=O)c1nc(-c2ccc(Cl)cc2)nn1C	ZINC000853849957	FD	On-Demand	Anodyne	LIPE	31	41
COC(=O)N(C)CCNC(=O)c1nc(-c2ccc(Cl)cc2)nn1C	ZINC000853849957	FD	On-Demand	Anodyne	UTS2	43	35
Cc1cccc(NC(=O)NC[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853849969	GG	On-Demand	Anodyne	CCKAR	23	41
Cc1cccc(NC(=O)NC[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853849969	GG	On-Demand	Anodyne	CCKBR	33	41
Cc1cccc(NC(=O)NC[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853849971	GG	On-Demand	Anodyne	CCKAR	23	41
Cc1cccc(NC(=O)NC[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853849971	GG	On-Demand	Anodyne	CCKBR	33	41
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	HTR1A	73	45
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	DRD2	66	44
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	DRD4	41	42
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	ADRA1D	65	42
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	ADRA1B	48	42
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	DRD3	72	42
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	HTR7	50	37
COc1ccccc1N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853849974	DD	On-Demand	Anodyne	NPY1R	16	43
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	HTR1A	73	45
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	DRD2	66	44
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	DRD4	41	42
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	ADRA1D	65	42
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	ADRA1A	60	42
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	ADRA1B	48	42
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	DRD3	72	42
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	HTR7	50	37
COc1ccccc1N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853849975	DD	On-Demand	Anodyne	NPY1R	16	43
COC(=O)N(C)CCNC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853849982	DD	On-Demand	Anodyne	KCNK3	91	38
COC(=O)N(C)CCNC(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853849982	DD	On-Demand	Anodyne	KCNK9	57	34
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849985	ED	On-Demand	Mild	HTR1A	60	40
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849985	ED	On-Demand	Mild	DRD2	55	41
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849985	ED	On-Demand	Mild	DRD4	32	41
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849985	ED	On-Demand	Mild	ADRA1D	47	37
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849985	ED	On-Demand	Mild	ADRA1A	42	38
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849985	ED	On-Demand	Mild	DRD3	60	39
C#CCCN(CCOC)C(=O)N[C@H]1CCN(c2ccccc2OC)C1	ZINC000853849985	ED	On-Demand	Mild	HTR7	42	36
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849986	ED	On-Demand	Mild	HTR1A	60	40
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849986	ED	On-Demand	Mild	DRD2	55	41
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849986	ED	On-Demand	Mild	DRD4	32	41
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849986	ED	On-Demand	Mild	ADRA1D	47	37
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849986	ED	On-Demand	Mild	ADRA1A	42	38
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849986	ED	On-Demand	Mild	DRD3	60	39
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(c2ccccc2OC)C1	ZINC000853849986	ED	On-Demand	Mild	HTR7	42	36
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853849991	FF	On-Demand	Anodyne	SCD1	38	41
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853849991	FF	On-Demand	Anodyne	SCD	32	41
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	HTR1A	58	43
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	DRD2	50	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	DRD3	54	39
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850054	FF	On-Demand	Anodyne	HTR7	41	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	HTR1A	58	43
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	DRD2	50	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	DRD3	54	39
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850055	FF	On-Demand	Anodyne	HTR7	41	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	HTR1A	58	43
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	DRD2	50	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	DRD3	54	39
COc1ccccc1N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853850056	FF	On-Demand	Anodyne	HTR7	41	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	HTR1A	58	43
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	DRD2	50	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	DRD4	33	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	ADRA1D	55	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	ADRA1A	46	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	ADRA1B	45	42
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	DRD3	54	39
COc1ccccc1N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853850057	FF	On-Demand	Anodyne	HTR7	41	42
COC(=O)N(C)CCNC(=O)Nc1cccnc1	ZINC000853850112	CC	On-Demand	Anodyne	NAMPT	46	41
O=C1CC[C@@H](CNC(=O)Nc2cccnc2Cl)N1	ZINC000853850125	CD	On-Demand	Anodyne	G2YM83_BOTF4	70	38
COC(=O)N(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853850179	ED	On-Demand	Anodyne	ADRA1D	33	43
COC(=O)N(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853850179	ED	On-Demand	Anodyne	ADRA1A	26	43
COC(=O)N(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853850179	ED	On-Demand	Anodyne	DRD3	48	37
COC(=O)N(C)CCNC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853850179	ED	On-Demand	Anodyne	KCNQ2	77	40
COC(=O)c1cccc(NC(=O)NCCN(C)C(=O)OC)c1	ZINC000853850187	DD	On-Demand	Anodyne	KCNK3	74	35
COC(=O)c1cccc(NC(=O)NCCN(C)C(=O)OC)c1	ZINC000853850187	DD	On-Demand	Anodyne	KCNK9	44	33
COC(=O)N(C)CCNC(=O)Nc1ccc(Cl)cn1	ZINC000853850211	CD	On-Demand	Anodyne	KLKB1	19	40
COC(=O)N(C)CCNC(=O)Nc1ccc(Cl)cn1	ZINC000853850211	CD	On-Demand	Anodyne	F10	56	40
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853850223	GF	On-Demand	Anodyne	ACE	16	41
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853850223	GF	On-Demand	Anodyne	GRIN2B	20	44
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853850223	GF	On-Demand	Anodyne	C3AR1	42	42
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853850223	GF	On-Demand	Anodyne	EPHX2	26	41
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850225	GF	On-Demand	Anodyne	ACE	16	41
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850225	GF	On-Demand	Anodyne	GRIN2B	20	44
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850225	GF	On-Demand	Anodyne	C3AR1	42	42
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850225	GF	On-Demand	Anodyne	EPHX2	26	41
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850227	GF	On-Demand	Anodyne	ACE	16	41
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850227	GF	On-Demand	Anodyne	GRIN2B	20	44
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850227	GF	On-Demand	Anodyne	C3AR1	42	42
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC000853850227	GF	On-Demand	Anodyne	EPHX2	26	41
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853850229	GF	On-Demand	Anodyne	ACE	16	41
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853850229	GF	On-Demand	Anodyne	GRIN2B	20	44
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853850229	GF	On-Demand	Anodyne	C3AR1	42	42
O=C(N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853850229	GF	On-Demand	Anodyne	EPHX2	26	41
COC(=O)N(C)CCNC(=O)Nc1nccs1	ZINC000853850268	CC	On-Demand	Anodyne	MAP1	126	40
COC(=O)N(C)CCNC(=O)Nc1cccnc1Cl	ZINC000853850272	CD	On-Demand	Anodyne	G2YM83_BOTF4	68	34
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3ccc(F)cc3F)O2)C1	ZINC000853850288	GG	On-Demand	Anodyne	GPR119	21	40
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3ccc(F)cc3F)O2)C1	ZINC000853850290	GG	On-Demand	Anodyne	GPR119	21	40
COC(=O)N(C)CCNC(=O)Nc1cccc(OCC(C)C)c1	ZINC000853850326	DF	On-Demand	Anodyne	HRH2	19	42
COC(=O)N(C)CCNC(=O)Nc1cccc(OCC(C)C)c1	ZINC000853850326	DF	On-Demand	Anodyne	PDS	62	33
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CA2	74	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CA1	70	47
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CA7	43	38
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CA14	38	41
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CA12	62	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CA9	60	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	CYNT	34	40
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	NCE103	33	44
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	MTCA1	59	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850364	EC	On-Demand	Anodyne	P96878_MYCTU	73	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CA2	74	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CA1	70	47
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CA7	43	38
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CA14	38	41
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CA12	62	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CA9	60	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	CYNT	34	40
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	NCE103	33	44
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	MTCA1	59	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850365	EC	On-Demand	Anodyne	P96878_MYCTU	73	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CA2	74	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CA1	70	47
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CA7	43	38
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CA14	38	41
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CA12	62	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CA9	60	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	CYNT	34	40
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	NCE103	33	44
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	MTCA1	59	57
NS(=O)(=O)c1ccc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)cc1	ZINC000853850366	EC	On-Demand	Anodyne	P96878_MYCTU	73	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CA2	74	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CA1	70	47
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CA7	43	38
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CA14	38	41
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CA12	62	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CA9	60	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	CYNT	34	40
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	NCE103	33	44
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	MTCA1	59	57
NS(=O)(=O)c1ccc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)cc1	ZINC000853850367	EC	On-Demand	Anodyne	P96878_MYCTU	73	57
CN1CCN(c2ccccc2NC(=O)N[C@H]2C[C@@H](O)C23CCC3)CC1	ZINC000853850415	ED	On-Demand	Anodyne	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)CC1	ZINC000853850416	ED	On-Demand	Anodyne	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@H]2C[C@H](O)C23CCC3)CC1	ZINC000853850417	ED	On-Demand	Anodyne	KCNQ2	76	41
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@H](O)C23CCC3)CC1	ZINC000853850418	ED	On-Demand	Anodyne	KCNQ2	76	41
C#CCNC(=O)c1ccc(N[C@H]2CCN(C3CCCCC3)C2)nc1	ZINC000853850420	EE	On-Demand	Mild	L3MBTL3	44	35
C#CCNC(=O)c1ccc(N[C@@H]2CCN(C3CCCCC3)C2)nc1	ZINC000853850421	EE	On-Demand	Mild	L3MBTL3	44	35
COC(=O)N(C)CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853850479	GE	On-Demand	Anodyne	NPY2R	65	35
COC(=O)N(C)CCNC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853850481	GE	On-Demand	Anodyne	NPY2R	65	35
COC(=O)N(C)CCNC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853850482	GE	On-Demand	Anodyne	NPY2R	65	35
COC(=O)N(C)CCNC(=O)Nc1ccc(C)c(Cl)c1	ZINC000853850484	CE	On-Demand	Anodyne	RAF1	19	45
COC(=O)N(C)CCNC(=O)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853850498	FD	On-Demand	Anodyne	CCR3	49	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3ccsc13)C2	ZINC000853850512	EG	On-Demand	Anodyne	SIRT3	71	44
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3ccsc13)C2	ZINC000853850512	EG	On-Demand	Anodyne	SIRT2	71	44
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3ccsc13)C2	ZINC000853850512	EG	On-Demand	Anodyne	SIRT1	64	44
COC(=O)N(C)CCNC(=O)Nc1cccc(Br)c1	ZINC000853850517	EE	On-Demand	Anodyne	EGFR	39	40
C[C@]1(CNc2nccc(N3CCCC3)n2)CC1(F)F	ZINC000853850533	CF	On-Demand	Anodyne	SORD	43	35
C[C@@]1(CNc2nccc(N3CCCC3)n2)CC1(F)F	ZINC000853850535	CF	On-Demand	Anodyne	SORD	43	35
COC(=O)N(C)CCNC(=O)Nc1ccccc1Cl	ZINC000853850553	CE	On-Demand	Anodyne	CXCL8	49	39
COC(=O)N(C)CCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853850588	EC	On-Demand	Anodyne	F10	40	31
COC(=O)N(C)CCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853850588	EC	On-Demand	Anodyne	EPHB4	62	33
COC(=O)N(C)CCNC(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853850588	EC	On-Demand	Anodyne	STAT6	53	36
COC(=O)N(C)CCNC(=O)Nc1ccc(Cl)cc1Cl	ZINC000853850600	DF	On-Demand	Anodyne	PYGL	17	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	HTR1A	67	42
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	DRD2	61	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	DRD4	38	41
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	ADRA1D	67	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	ADRA1A	61	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	ADRA1B	53	45
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	DRD3	64	41
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	HTR7	48	37
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	NPY1R	15	40
COc1ccccc1N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850605	FG	On-Demand	Reactive	CCR3	19	42
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	HTR1A	67	42
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	DRD2	61	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	DRD4	38	41
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	ADRA1D	67	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	ADRA1A	61	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	ADRA1B	53	45
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	DRD3	64	41
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	HTR7	48	37
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	NPY1R	15	40
COc1ccccc1N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853850607	FG	On-Demand	Reactive	CCR3	19	42
COC(=O)N(C)CCNC(=O)Nc1ccc(-c2ncon2)cc1	ZINC000853850611	DD	On-Demand	Anodyne	MTOR	50	38
COC(=O)N(C)CCNC(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853850643	ED	On-Demand	Anodyne	NPY2R	45	33
COC(=O)N(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853850662	CE	On-Demand	Anodyne	MCHR1	15	48
COC(=O)N(C)CCNC(=O)Nc1cccc(Cl)c1	ZINC000853850662	CE	On-Demand	Anodyne	KCNK3	40	38
COC(=O)N(C)CCNC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000853850676	CD	On-Demand	Bother	NMBR	55	32
C[C@H]1CN(C(=O)Nc2ccc(Cl)nc2)CC[C@@H](C)O1	ZINC000853850683	CF	On-Demand	Anodyne	EPHX2	16	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC(=O)N(C)CC3)cc2F)C[C@H](C)O1	ZINC000853850731	GE	On-Demand	Anodyne	NPY2R	65	38
C[C@H]1CN(c2ccc(NC(=O)N3CCC(=O)N(C)CC3)cc2F)C[C@@H](C)O1	ZINC000853850732	GE	On-Demand	Anodyne	NPY2R	65	38
C[C@H]1CN(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC[C@@H](C)O1	ZINC000853850760	GG	On-Demand	Anodyne	NPY2R	82	39
C[C@H]1CN(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC[C@@H](C)O1	ZINC000853850760	GG	On-Demand	Anodyne	EPHX2	17	41
C[C@H]1CN(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC[C@@H](C)O1	ZINC000853850761	GG	On-Demand	Anodyne	NPY2R	82	39
C[C@H]1CN(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC[C@@H](C)O1	ZINC000853850761	GG	On-Demand	Anodyne	EPHX2	17	41
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@H](C)O[C@@H](C)C3)cc2F)C[C@H](C)O1	ZINC000853850762	GG	On-Demand	Anodyne	NPY2R	82	39
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@H](C)O[C@@H](C)C3)cc2F)C[C@H](C)O1	ZINC000853850762	GG	On-Demand	Anodyne	EPHX2	17	41
COC(=O)N(C)CCNC(=O)Nc1cc(OC)cc(OC)c1	ZINC000853850793	DD	On-Demand	Anodyne	MTNR1B	21	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3ccccc13)C2	ZINC000853850797	EG	On-Demand	Anodyne	SIRT3	44	39
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3ccccc13)C2	ZINC000853850797	EG	On-Demand	Anodyne	SIRT2	40	39
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3ccccc13)C2	ZINC000853850797	EG	On-Demand	Anodyne	SIRT1	40	34
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3cccc(F)c13)C2	ZINC000853850807	FG	On-Demand	Anodyne	SIRT3	41	34
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3cccc(F)c13)C2	ZINC000853850807	FG	On-Demand	Anodyne	SIRT2	46	38
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3cccc(F)c13)C2	ZINC000853850807	FG	On-Demand	Anodyne	SIRT1	41	34
CC(C)(C)OC(=O)NCC12CC(CN1c1cc(C#N)nc3ccccc13)C2	ZINC000853850819	FH	On-Demand	Mild	ACACB	15	40
COC(=O)N(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853850824	CD	On-Demand	Anodyne	CCKAR	23	49
COC(=O)N(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853850824	CD	On-Demand	Anodyne	CCKBR	35	46
COC(=O)N(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853850824	CD	On-Demand	Anodyne	KCNK3	81	40
COC(=O)N(C)CCNC(=O)Nc1cccc(C)c1	ZINC000853850824	CD	On-Demand	Anodyne	KCNK9	69	40
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3cc(F)ccc3F)O2)C1	ZINC000853850879	GG	On-Demand	Anodyne	GPR119	15	42
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3cc(F)ccc3F)O2)C1	ZINC000853850880	GG	On-Demand	Anodyne	GPR119	15	42
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3nccs3)O2)C1	ZINC000853850881	FE	On-Demand	Anodyne	MAP1	63	33
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3nccs3)O2)C1	ZINC000853850882	FE	On-Demand	Anodyne	MAP1	63	33
COC(=O)N(C)CCNC(=O)Nc1cc(C)nn1-c1cccc(C(F)(F)F)c1	ZINC000853850891	GG	On-Demand	Anodyne	MAPK14	15	45
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853850900	FF	On-Demand	Anodyne	SCD1	40	43
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853850900	FF	On-Demand	Anodyne	SCD	37	43
COc1ccc2c(NC[C@]3(C)CC3(F)F)ccnc2c1	ZINC000853850901	CH	On-Demand	Anodyne	HRP1_PLAFA	102	45
COc1ccc2c(NC[C@]3(C)CC3(F)F)ccnc2c1	ZINC000853850901	CH	On-Demand	Anodyne	HNMT	57	35
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000853850902	GG	On-Demand	Anodyne	SCD1	39	42
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000853850902	GG	On-Demand	Anodyne	SCD	34	45
COc1ccc2c(NC[C@@]3(C)CC3(F)F)ccnc2c1	ZINC000853850903	CH	On-Demand	Anodyne	HRP1_PLAFA	102	45
COc1ccc2c(NC[C@@]3(C)CC3(F)F)ccnc2c1	ZINC000853850903	CH	On-Demand	Anodyne	HNMT	57	35
COC(=O)N(C)CCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853850907	DC	On-Demand	Anodyne	CASP3	15	46
COC(=O)N(C)CCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853850907	DC	On-Demand	Anodyne	CASP2	18	42
COC(=O)N(C)CCNC(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853850907	DC	On-Demand	Anodyne	CASP6	15	42
COC(=O)N(C)CCNC(=O)Nc1cccnc1N1CCCC1	ZINC000853850919	DD	On-Demand	Anodyne	KCNQ2	53	33
CC[C@@](C)(NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CC1	ZINC000853850929	EG	On-Demand	Anodyne	KCNQ2	82	43
COC(=O)N(C)CCNC(=O)c1cc(C(C)=O)cn1C	ZINC000853850934	CC	On-Demand	Anodyne	HRAS	47	31
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853850942	EF	On-Demand	Anodyne	CDK5	20	46
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc(C#N)c(Cl)c1)C2	ZINC000853850944	EH	On-Demand	Mild	AR	23	40
CC(C)(C)OC(=O)NCC12CC(CN1c1cc(C#N)c3ccccc3n1)C2	ZINC000853850956	FH	On-Demand	Mild	ACACB	16	43
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA2	69	54
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA1	68	48
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA7	33	40
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA5B	57	33
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA4	67	54
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA5A	61	33
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA14	27	40
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA12	54	54
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	CA9	56	48
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	NCE103	23	43
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	MTCA1	44	40
COC(=O)N(C)CCNC(=O)Nc1cccc(S(N)(=O)=O)c1	ZINC000853850957	EC	On-Demand	Anodyne	P96878_MYCTU	55	40
C=CCC1(NC(=O)Nc2ccccc2N2CCN(C)CC2)CCCC1	ZINC000853850975	EG	On-Demand	Mild	KCNQ2	79	41
Nc1nc(Cl)cc(N[C@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851040	CF	On-Demand	Anodyne	HRH4	45	46
Nc1nc(Cl)cc(N[C@@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851041	CF	On-Demand	Anodyne	HRH4	45	46
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNC(=O)Nc3cccnc3Cl)O2)C1	ZINC000853851120	GG	On-Demand	Anodyne	G2YM83_BOTF4	65	33
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNC(=O)Nc3cccnc3Cl)O2)C1	ZINC000853851121	GG	On-Demand	Anodyne	G2YM83_BOTF4	65	33
COc1cccc(NC(=O)NC[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853851124	GF	On-Demand	Anodyne	CCR3	19	42
COc1cccc(NC(=O)NC[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853851124	GF	On-Demand	Anodyne	EPHX2	21	43
COc1cccc(NC(=O)NC[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853851125	GF	On-Demand	Anodyne	CCR3	19	42
COc1cccc(NC(=O)NC[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)c1	ZINC000853851125	GF	On-Demand	Anodyne	EPHX2	21	43
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853851139	FC	On-Demand	Anodyne	HRH2	24	41
COC(=O)N(C)CCNC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853851139	FC	On-Demand	Anodyne	NPY1R	40	39
COC(=O)N(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853851140	CD	On-Demand	Anodyne	CCR3	30	43
COC(=O)N(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853851140	CD	On-Demand	Anodyne	AKR1C3	15	43
COC(=O)N(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853851140	CD	On-Demand	Anodyne	KCNK3	90	36
COC(=O)N(C)CCNC(=O)Nc1cccc(C(C)=O)c1	ZINC000853851140	CD	On-Demand	Anodyne	KCNK9	57	34
COC(=O)N(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853851142	EE	On-Demand	Anodyne	P2RY1	67	40
COC(=O)N(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853851142	EE	On-Demand	Anodyne	RAF1	20	41
COC(=O)N(C)CCNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853851142	EE	On-Demand	Anodyne	EPHX2	58	45
COC(=O)N(C)CCNC(=O)Nc1nc2c(s1)CCCC2	ZINC000853851147	DD	On-Demand	Anodyne	SLC27A1	30	40
COCc1cc([N+](=O)[O-])ccc1N1CC2CC1(CNC(=O)OC(C)(C)C)C2	ZINC000853851153	GG	On-Demand	Bother	CACNA1D	49	32
COC(=O)N(C)CCNC(=O)Nc1cccc(CN(C)C)c1	ZINC000853851165	DD	On-Demand	Anodyne	ROCK2	25	46
COC(=O)N(C)CCNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853851167	EF	On-Demand	Anodyne	PIK3CG	23	48
COC(=O)N(C)CCNC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853851167	EF	On-Demand	Anodyne	PI4KB	39	44
COC(=O)N(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853851186	DF	On-Demand	Anodyne	RAF1	27	42
COC(=O)N(C)CCNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853851186	DF	On-Demand	Anodyne	EPHX2	34	53
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc(C(=O)NC3CC3)cn1)C2	ZINC000853851189	FE	On-Demand	Anodyne	HPGDS	33	40
COC(=O)N(C)CCNC(=O)Nc1ncc(-c2ccccc2)s1	ZINC000853851196	EF	On-Demand	Anodyne	CDK5	21	40
COC(=O)N(C)CCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853851199	CD	On-Demand	Bother	CACNA1C	51	36
COC(=O)N(C)CCNC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853851199	CD	On-Demand	Bother	CACNA1D	78	35
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc([N+](=O)[O-])c3nonc13)C2	ZINC000853851208	GF	On-Demand	Bother	GSTM2	112	47
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc([N+](=O)[O-])c3nonc13)C2	ZINC000853851208	GF	On-Demand	Bother	GSTP1	69	47
COC(=O)N(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853851221	EC	On-Demand	Anodyne	CA2	21	44
COC(=O)N(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853851221	EC	On-Demand	Anodyne	NCE103	19	42
COC(=O)N(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853851221	EC	On-Demand	Anodyne	MTCA1	41	38
COC(=O)N(C)CCNC(=O)Nc1ccc(S(C)(=O)=O)cc1	ZINC000853851221	EC	On-Demand	Anodyne	P96878_MYCTU	52	38
Cc1nc(NC(=O)N2CCC(=O)N(C)CC2)sc1-c1ccccc1	ZINC000853851230	EF	On-Demand	Anodyne	PIK3CG	20	48
COC(=O)N(C)CCNC(=O)Nc1cccc2ccccc12	ZINC000853851235	DF	On-Demand	Anodyne	TRPV1	26	47
COC(=O)N(C)CCNC(=O)Nc1cccc2ccccc12	ZINC000853851235	DF	On-Demand	Anodyne	MTNR1A	33	46
C[C@H]1CN(C(=O)Nc2cccnc2Cl)CC[C@@H](C)O1	ZINC000853851247	CF	On-Demand	Anodyne	SMO	21	42
C[C@H]1CN(C(=O)Nc2cccnc2Cl)CC[C@@H](C)O1	ZINC000853851247	CF	On-Demand	Anodyne	G2YM83_BOTF4	77	40
c1cc(N2CCCC2)nc(N[C@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851272	DF	On-Demand	Anodyne	HRH4	21	43
c1cc(N2CCCC2)nc(N[C@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851272	DF	On-Demand	Anodyne	MAPK9	27	44
c1cc(N2CCCC2)nc(N[C@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851272	DF	On-Demand	Anodyne	MAPK8	30	44
c1cc(N2CCCC2)nc(N[C@@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851273	DF	On-Demand	Anodyne	HRH4	21	43
c1cc(N2CCCC2)nc(N[C@@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851273	DF	On-Demand	Anodyne	MAPK9	27	44
c1cc(N2CCCC2)nc(N[C@@H]2CCN(C3CCCCC3)C2)n1	ZINC000853851273	DF	On-Demand	Anodyne	MAPK8	30	44
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H]3CCC(=O)N3)cc2F)C[C@H](C)O1	ZINC000853851281	FD	On-Demand	Anodyne	NPY2R	68	38
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H]3CCC(=O)N3)cc2F)C[C@@H](C)O1	ZINC000853851282	FD	On-Demand	Anodyne	NPY2R	68	38
C=CCC1(NC(=O)Nc2ccc(N3CCOCC3)cn2)CCCC1	ZINC000853851318	EF	On-Demand	Mild	STAT6	62	36
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853851328	DH	On-Demand	Anodyne	EPHX2	27	43
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853851329	DH	On-Demand	Anodyne	EPHX2	27	43
CC[C@H](C)N(CC)C(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000853851331	DI	On-Demand	Anodyne	BACE1	17	40
CC[C@H](C)N(CC)C(=O)N[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000853851332	DI	On-Demand	Anodyne	BACE1	17	40
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853851340	GF	On-Demand	Anodyne	ROCK1	32	41
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853851340	GF	On-Demand	Anodyne	ROCK2	42	39
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853851340	GF	On-Demand	Anodyne	SCD1	39	43
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853851340	GF	On-Demand	Anodyne	SCD	37	49
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3[nH]ccc13)C2	ZINC000853851354	EE	On-Demand	Anodyne	AKT2	45	43
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3[nH]ccc13)C2	ZINC000853851354	EE	On-Demand	Anodyne	JAK3	23	42
CC(C)(C)OC(=O)NCC12CC(CN1c1nc(O)c3ccccc3n1)C2	ZINC000853851378	FF	On-Demand	Anodyne	ACACB	16	44
COC(=O)N(C)CCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853851381	DE	On-Demand	Anodyne	ERBB4	40	36
COC(=O)N(C)CCNC(=O)Nc1ccc(F)c(Cl)c1	ZINC000853851381	DE	On-Demand	Anodyne	MCHR1	29	44
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc(S(C)(=O)=O)cc1)C2	ZINC000853851382	FF	On-Demand	Anodyne	GPR119	33	44
COC(=O)N(C)CCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853851393	DF	On-Demand	Anodyne	RAF1	27	44
COC(=O)N(C)CCNC(=O)Nc1ccccc1C(F)(F)F	ZINC000853851396	DF	On-Demand	Anodyne	RBP4	32	45
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3cc(Cl)ccc13)C2	ZINC000853851403	FH	On-Demand	Anodyne	HRP1_PLAFA	67	35
COC(=O)N(C)CCNC(=O)Nc1cccc(C#N)c1	ZINC000853851415	CD	On-Demand	Mild	CCR3	25	48
COC(=O)N(C)CCNC(=O)Nc1cccc(C#N)c1	ZINC000853851415	CD	On-Demand	Mild	MCHR1	30	48
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853851416	GG	On-Demand	Anodyne	SCD1	41	53
COC(=O)N(C)CCNC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853851416	GG	On-Demand	Anodyne	SCD	36	53
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H]1C[C@H](O)C12CCC2	ZINC000853851420	DH	On-Demand	Anodyne	EPHX2	27	43
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853851421	DH	On-Demand	Anodyne	EPHX2	27	43
Cc1nc(NC(=O)N[C@H]2C[C@H](O)C23CCC3)sc1-c1ccccc1	ZINC000853851422	EH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2C[C@H](O)C23CCC3)sc1-c1ccccc1	ZINC000853851423	EH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@H]2C[C@@H](O)C23CCC3)sc1-c1ccccc1	ZINC000853851424	EH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N[C@@H]2C[C@@H](O)C23CCC3)sc1-c1ccccc1	ZINC000853851425	EH	On-Demand	Anodyne	PIK3CG	19	40
Cc1nc(NC(=O)N2CC[C@@H](C)O[C@@H](C)C2)sc1-c1ccccc1	ZINC000853851594	EI	On-Demand	Anodyne	PIK3CG	21	45
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)CC[C@@H](C)O1	ZINC000853851630	EE	On-Demand	Anodyne	KCNQ2	72	42
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)CC[C@@H](C)O1	ZINC000853851630	EE	On-Demand	Anodyne	RBP4	42	36
COC(=O)N(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853851656	DE	On-Demand	Anodyne	LCK	23	49
COC(=O)N(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853851656	DE	On-Demand	Anodyne	CSNK1D	43	48
COC(=O)N(C)CCNC(=O)Nc1nc2ccccc2s1	ZINC000853851656	DE	On-Demand	Anodyne	TMPRSS6	40	32
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA2	93	48
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA1	84	48
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA7	44	41
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA5B	34	41
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA4	73	48
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA5A	39	41
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA14	37	41
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA12	66	48
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	CA9	69	48
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	F13A1	59	36
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	NCE103	36	43
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	MTCA1	59	48
C=CCC1(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)CCCC1	ZINC000853851695	DE	On-Demand	Mild	P96878_MYCTU	73	48
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853851751	GH	On-Demand	Anodyne	CTSK	23	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853851752	GH	On-Demand	Anodyne	CTSK	23	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853851753	GH	On-Demand	Anodyne	CTSK	23	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853851754	GH	On-Demand	Anodyne	CTSK	23	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CC(S(=O)(=O)CC)C1	ZINC000853851776	GD	On-Demand	Anodyne	CTSK	15	41
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N1CC(S(=O)(=O)CC)C1	ZINC000853851777	GD	On-Demand	Anodyne	CTSK	15	41
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H]1C[C@H](O)C1	ZINC000853851807	ED	On-Demand	Anodyne	CTSK	17	42
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N[C@H]1C[C@H](O)C1	ZINC000853851808	ED	On-Demand	Anodyne	CTSK	17	42
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	HTR1A	73	48
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	DRD2	50	47
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	ADRA1D	47	46
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	HTR1D	19	48
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	HTR1B	23	48
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	ADRA1A	43	46
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	ADRA1B	36	46
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	DRD3	55	41
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	HTR7	49	43
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853851856	GG	On-Demand	Anodyne	KCNQ2	71	39
CNc1nc(N2CC3CC2(CNC(=O)OC(C)(C)C)C3)nc2ccccc12	ZINC000853851867	FG	On-Demand	Anodyne	ACACB	15	41
CC(C)(C)OC(=O)NCC12CC(CN1c1nc(N)c3ccccc3n1)C2	ZINC000853851871	FF	On-Demand	Anodyne	ACACB	15	42
COC(=O)N(C)CCNC(=O)Nc1cccc(C)n1	ZINC000853851913	CD	On-Demand	Anodyne	GRM5	20	45
O=C(N[C@@H]1C[C@H]1c1ccccc1Cl)N1CCCCC1	ZINC000853851943	CG	On-Demand	Anodyne	EPHX2	34	53
COc1ccccc1[C@@H]1C[C@H]1NC(=O)N1CCCCC1	ZINC000853851961	CF	On-Demand	Anodyne	EPHX2	28	57
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N(CCN1CCOCC1)CC1CC1	ZINC000853851962	GG	On-Demand	Anodyne	CASR	48	37
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N(CCN1CCOCC1)CC1CC1	ZINC000853851963	GG	On-Demand	Anodyne	CASR	48	37
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N1CCC(O)(CO)CC1	ZINC000853851964	ED	On-Demand	Anodyne	GHRHR	57	35
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N1CCC(O)(CO)CC1	ZINC000853851965	ED	On-Demand	Anodyne	GHRHR	57	35
COC(=O)N(C)CCNC(=O)Nc1ccccc1OC(F)(F)F	ZINC000853851969	EE	On-Demand	Anodyne	P2RY1	47	37
CC(C)(C)OC(=O)NCC12CC(CN1c1noc(-c3ccccc3)n1)C2	ZINC000853851990	FG	On-Demand	Anodyne	PDE8B	46	31
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N1CCC(CO)(CO)C1	ZINC000853852013	ED	On-Demand	Anodyne	EPHX2	19	41
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N1CCC(CO)(CO)C1	ZINC000853852014	ED	On-Demand	Anodyne	EPHX2	19	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1C[C@H](C)[C@@H](O)[C@H](C)C1	ZINC000853852016	FF	On-Demand	Anodyne	CTSK	16	42
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1C[C@@H](C)C(O)[C@H](C)C1	ZINC000853852017	FF	On-Demand	Anodyne	CTSK	16	42
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1C[C@H](C)C(O)[C@@H](C)C1	ZINC000853852018	FF	On-Demand	Anodyne	CTSK	16	42
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N1C[C@H](C)[C@@H](O)[C@H](C)C1	ZINC000853852019	FF	On-Demand	Anodyne	CTSK	16	42
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)NCC1CCC(O)CC1	ZINC000853852020	FF	On-Demand	Anodyne	CTSK	16	41
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NCC1CCC(O)CC1	ZINC000853852021	FF	On-Demand	Anodyne	CTSK	16	41
CC(C)(CO)[C@H](NC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000853852034	FH	On-Demand	Anodyne	BACE1	29	43
CC(C)(CO)[C@H](NC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21)C1CC1	ZINC000853852035	FH	On-Demand	Anodyne	BACE1	29	43
COc1ccc2c(N3CCN(S(C)(=O)=O)[C@H](C)C3)ccnc2c1	ZINC000853852070	ED	On-Demand	Anodyne	HSD11B1	15	45
C#CCCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853852093	FE	On-Demand	Mild	HTR1A	37	48
C#CCCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853852093	FE	On-Demand	Mild	DRD2	34	41
C#CCCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853852093	FE	On-Demand	Mild	HTR2A	25	45
C#CCCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853852093	FE	On-Demand	Mild	HTR2C	15	41
C#CCCCCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853852093	FE	On-Demand	Mild	DRD3	55	43
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CC(S(C)(=O)=O)C1	ZINC000853852155	GD	On-Demand	Anodyne	CTSK	17	42
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N1CC(S(C)(=O)=O)C1	ZINC000853852156	GD	On-Demand	Anodyne	CTSK	17	42
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCCC[C@H]1[C@@H](C)CO	ZINC000853852160	GG	On-Demand	Anodyne	HLA-DRB3	44	31
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCCC[C@@H]1[C@H](C)CO	ZINC000853852161	GG	On-Demand	Anodyne	HLA-DRB3	44	31
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCCC[C@@H]1[C@@H](C)CO	ZINC000853852162	GG	On-Demand	Anodyne	HLA-DRB3	44	31
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCCC[C@H]1[C@H](C)CO	ZINC000853852163	GG	On-Demand	Anodyne	HLA-DRB3	44	31
COC(=O)N(C)CCNC(=O)Nc1cccc(NC(C)=O)c1	ZINC000853852193	DD	On-Demand	Anodyne	KCNK3	67	36
COC(=O)N(C)CCNC(=O)Nc1cccc(NC(C)=O)c1	ZINC000853852193	DD	On-Demand	Anodyne	KCNK9	59	36
Cn1nnc2c(N3CC4CC3(CNC(=O)OC(C)(C)C)C4)ncnc21	ZINC000853852195	ED	On-Demand	Anodyne	SIRT3	28	40
Cn1nnc2c(N3CC4CC3(CNC(=O)OC(C)(C)C)C4)ncnc21	ZINC000853852195	ED	On-Demand	Anodyne	SIRT2	24	40
Cn1nnc2c(N3CC4CC3(CNC(=O)OC(C)(C)C)C4)ncnc21	ZINC000853852195	ED	On-Demand	Anodyne	SIRT1	19	40
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853852213	GG	On-Demand	Anodyne	L3MBTL3	50	37
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853852214	GG	On-Demand	Anodyne	L3MBTL3	50	37
O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853852215	GG	On-Demand	Anodyne	L3MBTL3	50	37
O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853852216	GG	On-Demand	Anodyne	L3MBTL3	50	37
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853852232	DG	On-Demand	Anodyne	P2RY1	40	37
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853852232	DG	On-Demand	Anodyne	G2YM83_BOTF4	62	35
COc1ccccc1[C@@H]1C[C@H]1NC(=O)C(F)(F)C(=O)N1CCOCC1	ZINC000853852243	FD	On-Demand	Anodyne	EPHX2	21	40
C#Cc1cccnc1N1CCN(S(C)(=O)=O)[C@H](C)C1	ZINC000853852269	CC	On-Demand	Mild	HSD11B1	18	52
C#CCCCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853852340	ED	On-Demand	Mild	HRH2	23	42
C#CCCCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853852340	ED	On-Demand	Mild	CCR3	26	43
C#CCCCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853852341	ED	On-Demand	Mild	HRH2	23	42
C#CCCCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853852341	ED	On-Demand	Mild	CCR3	26	43
C#CCCCCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853852342	CE	On-Demand	Mild	MME	31	43
C#CCCCCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853852342	CE	On-Demand	Mild	NPY5R	15	41
C#CCCCCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853852342	CE	On-Demand	Mild	NPFFR1	45	32
C#CCCCCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853852343	CE	On-Demand	Mild	MME	31	43
C#CCCCCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853852343	CE	On-Demand	Mild	NPY5R	15	41
C#CCCCCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853852343	CE	On-Demand	Mild	NPFFR1	45	32
COC(=O)c1cnc(N2CCN(S(C)(=O)=O)[C@H](C)C2)cc1C(F)(F)F	ZINC000853852349	GD	On-Demand	Anodyne	HSD11B1	28	41
Cn1ccnc1C(=O)NCC1(C#N)CCCCC1	ZINC000853852357	BD	On-Demand	Mild	HCN1	51	32
Cn1ccnc1C(=O)NCC1(C#N)CCCCC1	ZINC000853852357	BD	On-Demand	Mild	HCN4	49	32
C#CCCCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853852383	DE	On-Demand	Mild	MTNR1A	40	41
C#CCCCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853852383	DE	On-Demand	Mild	MTNR1B	41	41
C#CCCCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853852384	DE	On-Demand	Mild	MTNR1A	40	41
C#CCCCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853852384	DE	On-Demand	Mild	MTNR1B	41	41
C#CCCCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853852386	DG	On-Demand	Reactive	CSNK1D	38	42
COc1ccccc1[C@@H]1C[C@H]1NC(=O)n1ccnc1	ZINC000853852433	CE	On-Demand	Anodyne	EPHX2	15	44
C#CCCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853852442	CD	On-Demand	Mild	CPT1A	52	33
C#CCCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853852443	CD	On-Demand	Mild	CPT1A	52	33
Cc1cc(C(=O)NC2CCC3(CC2)CC3(F)F)n2nc(C)cc2n1	ZINC000853852449	EG	On-Demand	Anodyne	MAPK13	61	35
C[C@H]1CN(c2ccc(NC(=O)NCC3(C#N)CCCCC3)cc2F)C[C@H](C)O1	ZINC000853852481	GI	On-Demand	Mild	NPY2R	50	36
C[C@H]1CN(c2ccc(NC(=O)NCC3(C#N)CCCCC3)cc2F)C[C@@H](C)O1	ZINC000853852485	GI	On-Demand	Mild	NPY2R	50	36
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000853852499	EF	On-Demand	Anodyne	BACE1	19	41
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CC3(CCC3)Oc3ccccc32)C1	ZINC000853852500	EF	On-Demand	Anodyne	BACE1	19	41
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CC(=O)N(C)C1	ZINC000853852504	FD	On-Demand	Anodyne	CTSK	15	40
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CC(=O)N(C)C1	ZINC000853852505	FD	On-Demand	Anodyne	CTSK	15	40
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CC(=O)N(C)C1	ZINC000853852506	FD	On-Demand	Anodyne	CTSK	15	40
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CC(=O)N(C)C1	ZINC000853852507	FD	On-Demand	Anodyne	CTSK	15	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc(C(=O)NCCO)nn1)C2	ZINC000853852510	GC	On-Demand	Anodyne	SCD1	33	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc(C(=O)NCCO)nn1)C2	ZINC000853852510	GC	On-Demand	Anodyne	SCD	23	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3c1ncn3C1CC1)C2	ZINC000853852519	FF	On-Demand	Anodyne	OXGR1	80	31
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc3c1ncn3C1CC1)C2	ZINC000853852519	FF	On-Demand	Anodyne	Q4VQ11_PIG	40	35
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853852542	GG	On-Demand	Anodyne	CTSK	15	41
CCCC[C@@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853852543	GG	On-Demand	Anodyne	CTSK	15	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853852544	GG	On-Demand	Anodyne	CTSK	15	41
CCCC[C@H](CNC(=O)OC(C)(C)C)NC(=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853852545	GG	On-Demand	Anodyne	CTSK	15	41
C#CCCCCNC(=O)N1CCNC(=O)[C@@H]1c1cccc(C)c1	ZINC000853852560	DD	On-Demand	Mild	ADRA1D	17	43
C#CCCCCNC(=O)N1CCNC(=O)[C@@H]1c1cccc(C)c1	ZINC000853852560	DD	On-Demand	Mild	ADRA1B	19	43
C#CCCCCNC(=O)N1CCNC(=O)[C@H]1c1cccc(C)c1	ZINC000853852561	DD	On-Demand	Mild	ADRA1D	17	43
C#CCCCCNC(=O)N1CCNC(=O)[C@H]1c1cccc(C)c1	ZINC000853852561	DD	On-Demand	Mild	ADRA1B	19	43
CC(=O)c1ccc(N2CCN(S(C)(=O)=O)[C@H](C)C2)c(S(N)(=O)=O)c1	ZINC000853852615	GC	On-Demand	Anodyne	HSD11B1	19	46
CN1CCN(c2ccccc2NC(=O)NCC2(C#N)CCCCC2)CC1	ZINC000853852647	FG	On-Demand	Mild	KCNQ2	79	41
CN1CCN(c2ccccc2NC(=O)NCC2(C#N)CCCCC2)CC1	ZINC000853852647	FG	On-Demand	Mild	CSF1R	19	43
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(S(C)(=O)=O)[C@H](C)C1	ZINC000853852657	FC	On-Demand	Bother	HSD11B1	16	45
C[C@@H](CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)CC1(C)OCCO1	ZINC000853852664	ED	On-Demand	Anodyne	CPT1A	46	33
C[C@@H](CNC(=O)N1CCCC[C@H]1c1nc[nH]n1)CC1(C)OCCO1	ZINC000853852666	ED	On-Demand	Anodyne	CPT1A	46	33
CN1CCN(c2ccccc2NC(=O)NC2CCC3(CC2)CC3(F)F)CC1	ZINC000853852798	GH	On-Demand	Anodyne	KCNQ2	74	38
C#CCCCCNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853852821	CF	On-Demand	Mild	IMDH_CRYPV	51	32
O=C(Nc1ccc(Cl)nc1)NC1CCC2(CC1)CC2(F)F	ZINC000853852845	DH	On-Demand	Anodyne	EPHX2	49	46
O=C(Nc1cccc(N2CCOC2=O)c1)NC1CCC2(CC1)CC2(F)F	ZINC000853852852	FH	On-Demand	Anodyne	EPHX2	37	42
COc1cc(F)c([N+](=O)[O-])c(N2CCN(S(C)(=O)=O)[C@H](C)C2)c1	ZINC000853852868	ED	On-Demand	Bother	HSD11B1	15	48
C[C@@H](CNC(=O)N1CCC2(CCc3ccccc3O2)CC1)CC1(C)OCCO1	ZINC000853852898	GG	On-Demand	Anodyne	SCD1	18	44
C[C@@H](CNC(=O)N1CCC2(CCc3ccccc3O2)CC1)CC1(C)OCCO1	ZINC000853852898	GG	On-Demand	Anodyne	SCD	31	44
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc(S(C)(=O)=O)cc1F)C2	ZINC000853852956	GF	On-Demand	Anodyne	SLC6A9	24	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ccc(S(C)(=O)=O)cc1F)C2	ZINC000853852956	GF	On-Demand	Anodyne	GPR119	44	42
COC(=O)N(C)CCNC(=O)Nc1cc(Cl)ccc1OC	ZINC000853852974	DE	On-Demand	Anodyne	RBP4	17	41
COc1ccccc1[C@@H]1C[C@H]1NC(=O)Nc1ccc(Cl)nc1	ZINC000853853003	DG	On-Demand	Anodyne	PDGFRA	46	36
CC[C@@H](O)CNC(=O)N[C@H]1CC2(CCC2)Oc2ccccc21	ZINC000853853041	DF	On-Demand	Anodyne	BACE1	26	42
CC[C@@H](O)CNC(=O)N[C@@H]1CC2(CCC2)Oc2ccccc21	ZINC000853853042	DF	On-Demand	Anodyne	BACE1	26	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@H]2c2ccccc2Cl)CC1	ZINC000853853051	GH	On-Demand	Anodyne	DRD2	15	42
CN1CCN(c2ccccc2NC(=O)N[C@@H]2C[C@H]2c2ccccc2Cl)CC1	ZINC000853853051	GH	On-Demand	Anodyne	KCNQ2	79	46
C#CCCCCNC(=O)N[C@@H]1C[C@@H](C(=O)OC)C1	ZINC000853853057	CD	On-Demand	Mild	EPHX2	16	44
C#CCCCOc1cccnc1N1CCN(S(C)(=O)=O)[C@H](C)C1	ZINC000853853059	ED	On-Demand	Mild	HSD11B1	15	46
COC(=O)c1sc(N2CCN(S(C)(=O)=O)[C@H](C)C2)nc1Cl	ZINC000853853079	FD	On-Demand	Anodyne	PARE	80	35
N#CC1(CNC(=O)Nc2cccnc2Cl)CCCCC1	ZINC000853853154	CG	On-Demand	Mild	G2YM83_BOTF4	70	36
CC(=O)c1ccc(N2CCN(S(C)(=O)=O)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000853853293	ED	On-Demand	Bother	HSD11B1	19	45
COCc1cc([N+](=O)[O-])ccc1N1CCN(S(C)(=O)=O)[C@H](C)C1	ZINC000853853310	ED	On-Demand	Bother	HSD11B1	16	47
C#CCCCCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853853325	DD	On-Demand	Mild	L3MBTL3	49	38
C#CCCCCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853853326	DD	On-Demand	Mild	L3MBTL3	49	38
C#CCCCCNC(=O)NC1(c2cccc(OC)c2)CCC1	ZINC000853853488	DG	On-Demand	Mild	DRD4	40	31
C[C@H](CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)CC1(C)OCCO1	ZINC000853853521	FE	On-Demand	Anodyne	PSMB8	50	33
C[C@@H](CNC(=O)N(C)[C@@H](CO)Cc1ccccc1)CC1(C)OCCO1	ZINC000853853522	FE	On-Demand	Anodyne	PSMB8	50	33
C[C@H](CNC(=O)N(C)[C@H](CO)Cc1ccccc1)CC1(C)OCCO1	ZINC000853853523	FE	On-Demand	Anodyne	PSMB8	50	33
C[C@@H](CNC(=O)N(C)[C@H](CO)Cc1ccccc1)CC1(C)OCCO1	ZINC000853853524	FE	On-Demand	Anodyne	PSMB8	50	33
COc1cc(N2CCN(S(C)(=O)=O)[C@H](C)C2)c([N+](=O)[O-])cc1OC	ZINC000853853531	FD	On-Demand	Clean	HSD11B1	15	42
Cc1nc(NC(=O)N2CCC([C@H]3CCCCO3)CC2)sc1-c1ccccc1	ZINC000853853553	GJ	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2CCC([C@@H]3CCCCO3)CC2)sc1-c1ccccc1	ZINC000853853554	GJ	On-Demand	Anodyne	PIK3CG	21	46
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H]([C@H]3CCCCO3)C2)CC1	ZINC000853853598	GG	On-Demand	Anodyne	KCNQ2	69	38
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H]([C@@H]3CCCCO3)C2)CC1	ZINC000853853599	GG	On-Demand	Anodyne	KCNQ2	69	38
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H]([C@@H]3CCCCO3)C2)CC1	ZINC000853853600	GG	On-Demand	Anodyne	KCNQ2	69	38
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H]([C@H]3CCCCO3)C2)CC1	ZINC000853853601	GG	On-Demand	Anodyne	KCNQ2	69	38
C[C@@H](CNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)CC1(C)OCCO1	ZINC000853853604	FD	On-Demand	Anodyne	PYGL	31	44
C[C@@H](CNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)CC1(C)OCCO1	ZINC000853853604	FD	On-Demand	Anodyne	PYGM	28	44
C[C@@H](CNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O)CC1(C)OCCO1	ZINC000853853604	FD	On-Demand	Anodyne	TPP2	44	32
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc(F)c1Br)C2	ZINC000853853626	GF	On-Demand	Anodyne	SIRT3	23	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc(F)c1Br)C2	ZINC000853853626	GF	On-Demand	Anodyne	SIRT2	22	40
CC(C)(C)OC(=O)NCC12CC(CN1c1ncnc(F)c1Br)C2	ZINC000853853626	GF	On-Demand	Anodyne	SIRT1	19	40
C[C@@H](CNC(=O)N1CCO[C@H](c2cccc(Cl)c2)[C@H]1C)CC1(C)OCCO1	ZINC000853853642	GH	On-Demand	Anodyne	MDM2	100	35
C[C@@H](CNC(=O)N[C@H]1CCc2ccccc2-n2ccnc21)CC1(C)OCCO1	ZINC000853853678	GF	On-Demand	Anodyne	NPY1R	26	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(C(F)(F)F)cc2)O1	ZINC000853853859	FD	On-Demand	Reactive	EPHX2	34	42
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(C(F)(F)F)cc2)O1	ZINC000853853862	FD	On-Demand	Reactive	EPHX2	34	42
C[C@@H]1[C@@H](C(F)(F)F)OCCN1C(=O)Nc1cccnc1Cl	ZINC000853853869	DF	On-Demand	Anodyne	G2YM83_BOTF4	69	37
C[C@H]1[C@H](C(F)(F)F)OCCN1C(=O)Nc1cccnc1Cl	ZINC000853853871	DF	On-Demand	Anodyne	G2YM83_BOTF4	69	37
Cn1ncc(C2CCC2)c1CNC(=O)Nc1cccnc1Cl	ZINC000853853892	DG	On-Demand	Anodyne	G2YM83_BOTF4	70	35
C[C@@H]1CCN(C(=O)Nc2nccs2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853853899	FG	On-Demand	Anodyne	MAP1	70	35
Cc1cccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853929	GI	On-Demand	Anodyne	CCKAR	17	40
Cc1cccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853929	GI	On-Demand	Anodyne	CCKBR	24	40
Cc1cccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853929	GI	On-Demand	Anodyne	RBP4	66	36
Cc1cccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853929	GI	On-Demand	Anodyne	P2RY14	46	34
Cc1cccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853930	GI	On-Demand	Anodyne	CCKAR	17	40
Cc1cccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853930	GI	On-Demand	Anodyne	CCKBR	24	40
Cc1cccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853930	GI	On-Demand	Anodyne	RBP4	66	36
Cc1cccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1	ZINC000853853930	GI	On-Demand	Anodyne	P2RY14	46	34
Cn1ncc(C2CCC2)c1CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853853932	GF	On-Demand	Bother	CACNA1C	48	36
Cn1ncc(C2CCC2)c1CNC(=O)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853853932	GF	On-Demand	Bother	CACNA1D	71	36
COC(=O)/C=C\c1ccc(N2CCN(S(C)(=O)=O)[C@H](C)C2)c([N+](=O)[O-])c1	ZINC000853853948	GD	On-Demand	Clean	HSD11B1	15	40
FCC[C@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853853949	CF	On-Demand	Anodyne	SORD	72	38
FCC[C@@H]1CCCN(c2nccc(N3CCCC3)n2)C1	ZINC000853853950	CF	On-Demand	Anodyne	SORD	72	38
C[C@H](CNC(=O)N(CCN1CCOCC1)CC1CC1)CC1(C)OCCO1	ZINC000853854018	FD	On-Demand	Anodyne	CASR	42	35
C[C@@H](CNC(=O)N(CCN1CCOCC1)CC1CC1)CC1(C)OCCO1	ZINC000853854019	FD	On-Demand	Anodyne	CASR	42	35
Cc1cncc(CCNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)n1	ZINC000853854024	GF	On-Demand	Anodyne	NPY2R	52	36
Cc1cncc(CCNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)n1	ZINC000853854025	GF	On-Demand	Anodyne	NPY2R	52	36
Cc1cncc(CCNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)n1	ZINC000853854026	GF	On-Demand	Anodyne	NPY2R	52	36
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccccc2OC(F)(F)F)O1	ZINC000853854072	GD	On-Demand	Reactive	P2RY1	48	37
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccccc2OC(F)(F)F)O1	ZINC000853854075	GD	On-Demand	Reactive	P2RY1	48	37
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(-c3ncon3)cc2)O1	ZINC000853854082	FC	On-Demand	Reactive	MTOR	85	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(-c3ncon3)cc2)O1	ZINC000853854083	FC	On-Demand	Reactive	MTOR	85	40
Cn1ncc(C2CCC2)c1CNC(=O)Nc1ccc(Cl)nc1	ZINC000853854086	DG	On-Demand	Anodyne	NAMPT	23	40
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(N3CCCC3)nc2)O1	ZINC000853854127	FC	On-Demand	Reactive	MTOR	24	41
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(N3CCCC3)nc2)O1	ZINC000853854128	FC	On-Demand	Reactive	MTOR	24	41
Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854138	GI	On-Demand	Anodyne	PIK3CA	46	38
Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854138	GI	On-Demand	Anodyne	CHRNA7	22	42
Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854138	GI	On-Demand	Anodyne	PRNP	42	36
Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854138	GI	On-Demand	Anodyne	MTOR	131	39
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc3cccnc23)O1	ZINC000853854141	ED	On-Demand	Reactive	WNT3	17	40
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc3cccnc23)O1	ZINC000853854143	ED	On-Demand	Reactive	WNT3	17	40
CN1CCN(c2ccccc2NC(=O)NCc2c(C3CCC3)cnn2C)CC1	ZINC000853854205	GF	On-Demand	Anodyne	HTR7	15	40
CN1CCN(c2ccccc2NC(=O)NCc2c(C3CCC3)cnn2C)CC1	ZINC000853854205	GF	On-Demand	Anodyne	KCNQ2	75	40
O=[N+]([O-])c1ccc(N2CCC[C@H](CCF)C2)c2nonc12	ZINC000853854209	CF	On-Demand	Bother	GSTM2	102	48
O=[N+]([O-])c1ccc(N2CCC[C@H](CCF)C2)c2nonc12	ZINC000853854209	CF	On-Demand	Bother	GSTP1	60	48
O=[N+]([O-])c1ccc(N2CCC[C@@H](CCF)C2)c2nonc12	ZINC000853854211	CF	On-Demand	Bother	GSTM2	102	48
O=[N+]([O-])c1ccc(N2CCC[C@@H](CCF)C2)c2nonc12	ZINC000853854211	CF	On-Demand	Bother	GSTP1	60	48
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854226	GI	On-Demand	Anodyne	CCKAR	34	40
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854226	GI	On-Demand	Anodyne	PIK3CA	40	41
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854226	GI	On-Demand	Anodyne	CHRNA7	15	43
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854226	GI	On-Demand	Anodyne	MTOR	110	41
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853854226	GI	On-Demand	Anodyne	CCKBR	54	40
O=C(N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1)N1CC[C@H](O)C(F)(F)C1	ZINC000853854235	GH	On-Demand	Anodyne	CACNA1H	43	38
O=C(N[C@@H](c1cccc(F)c1)c1cccc(Cl)c1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853854238	GH	On-Demand	Anodyne	CACNA1H	43	38
O=C(N[C@H](c1cccc(F)c1)c1cccc(Cl)c1)N1CC[C@H](O)C(F)(F)C1	ZINC000853854240	GH	On-Demand	Anodyne	CACNA1H	43	38
O=C(N[C@H](c1cccc(F)c1)c1cccc(Cl)c1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853854242	GH	On-Demand	Anodyne	CACNA1H	43	38
Cc1ccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cn1	ZINC000853854244	GG	On-Demand	Anodyne	EPHX2	38	40
Cc1ccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cn1	ZINC000853854244	GG	On-Demand	Anodyne	RBP4	42	41
Cc1ccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cn1	ZINC000853854246	GG	On-Demand	Anodyne	EPHX2	38	40
Cc1ccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cn1	ZINC000853854246	GG	On-Demand	Anodyne	RBP4	42	41
CC[C@@H](CN1CCCC1)NC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853854253	FG	On-Demand	Anodyne	OPRK1	18	43
CC[C@H](CN1CCCC1)NC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853854255	FG	On-Demand	Anodyne	OPRK1	18	43
CC[C@H](CN1CCCC1)NC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853854257	FG	On-Demand	Anodyne	OPRK1	18	43
CC[C@@H](CN1CCCC1)NC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853854259	FG	On-Demand	Anodyne	OPRK1	18	43
CN1CCN(c2ccccc2NC(=O)N2CCC([C@@H]3CCCCO3)CC2)CC1	ZINC000853854357	GG	On-Demand	Anodyne	HTR1B	15	43
CN1CCN(c2ccccc2NC(=O)N2CCC([C@@H]3CCCCO3)CC2)CC1	ZINC000853854357	GG	On-Demand	Anodyne	KCNQ2	71	39
CN1CCN(c2ccccc2NC(=O)N2CCC([C@H]3CCCCO3)CC2)CC1	ZINC000853854358	GG	On-Demand	Anodyne	HTR1B	15	43
CN1CCN(c2ccccc2NC(=O)N2CCC([C@H]3CCCCO3)CC2)CC1	ZINC000853854358	GG	On-Demand	Anodyne	KCNQ2	71	39
Cc1cncc(CCNC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)n1	ZINC000853854369	FE	On-Demand	Bother	CACNA1D	50	34
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCO[C@H]2c2nccn2C)CC1	ZINC000853854399	GE	On-Demand	Anodyne	KCNQ2	65	33
C#CCNC(=O)c1ccc(N2CCC[C@H](CCF)C2)nc1	ZINC000853854437	CE	On-Demand	Mild	HPGDS	27	46
C#CCNC(=O)c1ccc(N2CCC[C@@H](CCF)C2)nc1	ZINC000853854439	CE	On-Demand	Mild	HPGDS	27	46
Cc1cc(C(F)(F)F)c(N2CCN(S(C)(=O)=O)[C@H](C)C2)nn1	ZINC000853854476	ED	On-Demand	Anodyne	HSD11B1	30	49
CC(=O)c1ccc(N2CCC[C@H](CCF)C2)c([N+](=O)[O-])c1	ZINC000853854487	CG	On-Demand	Bother	TAAR1	15	43
CC(=O)c1ccc(N2CCC[C@@H](CCF)C2)c([N+](=O)[O-])c1	ZINC000853854490	CG	On-Demand	Bother	TAAR1	15	43
O=C(C(=O)N1CCC(CO)(CO)C1)c1ccc(Cl)cc1	ZINC000853854506	CC	On-Demand	Anodyne	CCR1	42	36
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	CA2	70	47
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	CA1	65	46
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	CA7	35	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	CA4	56	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	CA14	35	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	CA12	52	46
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	CA9	55	47
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	MTCA1	52	45
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854560	FB	On-Demand	Reactive	P96878_MYCTU	66	45
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	CA2	70	47
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	CA1	65	46
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	CA7	35	40
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	CA4	56	43
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	CA14	35	40
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	CA12	52	46
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	CA9	55	47
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	MTCA1	52	45
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)O1	ZINC000853854565	FB	On-Demand	Reactive	P96878_MYCTU	66	45
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853854600	DC	On-Demand	Reactive	CCR3	17	43
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853854600	DC	On-Demand	Reactive	MCHR1	25	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853854601	DC	On-Demand	Reactive	CCR3	17	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(C#N)c2)O1	ZINC000853854601	DC	On-Demand	Reactive	MCHR1	25	43
O=C(Nc1ccccc1C(F)(F)F)N1CCn2ncc(Br)c2C1	ZINC000853854639	GH	On-Demand	Anodyne	RBP4	85	42
CCn1nccc1[C@H]1NC(=O)CC[C@@H]1NC(=O)Nc1cccnc1Cl	ZINC000853854666	FE	On-Demand	Anodyne	G2YM83_BOTF4	66	35
CCn1nccc1[C@@H]1NC(=O)CC[C@@H]1NC(=O)Nc1cccnc1Cl	ZINC000853854667	FE	On-Demand	Anodyne	G2YM83_BOTF4	66	35
CCn1nccc1[C@@H]1NC(=O)CC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853854668	FE	On-Demand	Anodyne	G2YM83_BOTF4	66	35
CCn1nccc1[C@H]1NC(=O)CC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853854669	FE	On-Demand	Anodyne	G2YM83_BOTF4	66	35
C[C@@H]1CCN(C(=O)Nc2cccc(C#N)c2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853854686	FH	On-Demand	Mild	CCR3	21	42
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccccc2N2CCN(C)CC2)O1	ZINC000853854704	GC	On-Demand	Reactive	KCNQ2	72	38
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccccc2N2CCN(C)CC2)O1	ZINC000853854705	GC	On-Demand	Reactive	KCNQ2	72	38
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(Cl)cn2)O1	ZINC000853854744	EC	On-Demand	Reactive	F10	36	41
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(Cl)cn2)O1	ZINC000853854745	EC	On-Demand	Reactive	F10	36	41
CC[C@@H](CN1CCCC1)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854867	FE	On-Demand	Clean	MTNR1A	17	46
CC[C@@H](CN1CCCC1)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854867	FE	On-Demand	Clean	MTNR1B	18	46
CC[C@H](CN1CCCC1)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854868	FE	On-Demand	Clean	MTNR1A	17	46
CC[C@H](CN1CCCC1)NC(=O)N[C@@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854868	FE	On-Demand	Clean	MTNR1B	18	46
CC[C@@H](CN1CCCC1)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854869	FE	On-Demand	Clean	MTNR1A	17	46
CC[C@@H](CN1CCCC1)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854869	FE	On-Demand	Clean	MTNR1B	18	46
CC[C@H](CN1CCCC1)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854870	FE	On-Demand	Clean	MTNR1A	17	46
CC[C@H](CN1CCCC1)NC(=O)N[C@H]1CCN(c2ccc(OC)cc2)C1	ZINC000853854870	FE	On-Demand	Clean	MTNR1B	18	46
N#Cc1cc(C(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c[nH]1	ZINC000853854917	GF	On-Demand	Mild	L3MBTL3	45	35
N#Cc1cc(C(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c[nH]1	ZINC000853854918	GF	On-Demand	Mild	L3MBTL3	45	35
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@@H](C)O2)n1	ZINC000853854952	DC	On-Demand	Reactive	GRM5	16	40
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@@H](C)O2)n1	ZINC000853854953	DC	On-Demand	Reactive	GRM5	16	40
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@H](C)O2)n1	ZINC000853854954	DC	On-Demand	Reactive	GRM5	16	40
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@H](C)O2)n1	ZINC000853854955	DC	On-Demand	Reactive	GRM5	16	40
COc1ccccc1NC(=O)N1CC[C@@H](C)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000853854968	GH	On-Demand	Anodyne	DRD2	25	45
Cn1ncc(C2CCC2)c1CNC(=O)C(F)(F)c1ccccc1F	ZINC000853854971	EG	On-Demand	Anodyne	P2RX7	17	41
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ncc(Cc3ccccc3)s2)O1	ZINC000853854972	GD	On-Demand	Reactive	MGEA5	33	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ncc(Cc3ccccc3)s2)O1	ZINC000853854973	GD	On-Demand	Reactive	MGEA5	33	40
CCC1(CC)CCCN(c2ccc(-c3nc(C)no3)cn2)C1	ZINC000853855067	DH	On-Demand	Anodyne	SCARB1	58	36
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)O1	ZINC000853855149	FE	On-Demand	Reactive	MTOR	72	41
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(-c3ccccc3)cc2)O1	ZINC000853855151	FE	On-Demand	Reactive	MTOR	72	41
C[C@@H]1CCN(C(=O)Nc2cccnc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853855171	GH	On-Demand	Anodyne	G2YM83_BOTF4	59	37
C[C@@H]1[C@@H](C(F)(F)F)OCCN1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853855186	GF	On-Demand	Anodyne	KCNQ2	69	37
C[C@H]1[C@H](C(F)(F)F)OCCN1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853855190	GF	On-Demand	Anodyne	KCNQ2	69	37
O=C(Nc1nccs1)N1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853855228	GG	On-Demand	Anodyne	MAP1	77	38
O=C(Nc1nccs1)N1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853855230	GG	On-Demand	Anodyne	MAP1	77	38
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccccc2C(F)(F)F)O1	ZINC000853855279	FD	On-Demand	Reactive	RBP4	72	38
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccccc2C(F)(F)F)O1	ZINC000853855286	FD	On-Demand	Reactive	RBP4	72	38
Cn1nccc1[C@@H]1OCCC[C@H]1CNC(=O)Nc1cccnc1Cl	ZINC000853855292	EF	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853855308	GE	On-Demand	Anodyne	KCNQ2	72	38
O=[N+]([O-])c1ccc(N2CCC[C@H](CCF)C2)cc1	ZINC000853855323	CG	On-Demand	Bother	SSTR1	40	47
O=[N+]([O-])c1ccc(N2CCC[C@@H](CCF)C2)cc1	ZINC000853855325	CG	On-Demand	Bother	SSTR1	40	47
Cc1ccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1	ZINC000853855361	GI	On-Demand	Anodyne	EPHX2	55	42
Cc1ccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1	ZINC000853855361	GI	On-Demand	Anodyne	RBP4	62	34
Cc1ccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1	ZINC000853855364	GI	On-Demand	Anodyne	EPHX2	55	42
Cc1ccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1	ZINC000853855364	GI	On-Demand	Anodyne	RBP4	62	34
Cc1nc(NC(=O)N2CCC[C@@H]([C@@H]3CCCCO3)C2)sc1-c1ccccc1	ZINC000853855396	GJ	On-Demand	Anodyne	PIK3CG	16	44
Cc1nc(NC(=O)N2CCC[C@@H]([C@H]3CCCCO3)C2)sc1-c1ccccc1	ZINC000853855397	GJ	On-Demand	Anodyne	PIK3CG	16	44
Cc1nc(NC(=O)N2CCC[C@H]([C@@H]3CCCCO3)C2)sc1-c1ccccc1	ZINC000853855398	GJ	On-Demand	Anodyne	PIK3CG	16	44
Cc1nc(NC(=O)N2CCC[C@H]([C@H]3CCCCO3)C2)sc1-c1ccccc1	ZINC000853855399	GJ	On-Demand	Anodyne	PIK3CG	16	44
Cc1cncc(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853855407	FD	On-Demand	Anodyne	HTR1A	23	40
Cc1cncc(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853855407	FD	On-Demand	Anodyne	HTR1D	40	29
Cc1cncc(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853855407	FD	On-Demand	Anodyne	HTR1B	41	40
Cc1cncc(CCNC(=O)Nc2ccccc2N2CCN(C)CC2)n1	ZINC000853855407	FD	On-Demand	Anodyne	KCNQ2	72	38
C[C@@H](CNC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1)CC1(C)OCCO1	ZINC000853855435	GF	On-Demand	Anodyne	GHRHR	40	31
C[C@@H](CNC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1)CC1(C)OCCO1	ZINC000853855436	GF	On-Demand	Anodyne	GHRHR	40	31
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccnc2Cl)O1	ZINC000853855458	EC	On-Demand	Reactive	G2YM83_BOTF4	71	37
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccnc2Cl)O1	ZINC000853855459	EC	On-Demand	Reactive	G2YM83_BOTF4	71	37
CC(=O)c1cccc(NC(=O)N2CC[C@@H](C)C[C@H]2CNC(=O)OC(C)(C)C)c1	ZINC000853855542	GI	On-Demand	Anodyne	CCR3	26	41
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853855551	EF	On-Demand	Anodyne	G2YM83_BOTF4	69	36
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000853855562	EG	On-Demand	Mild	ACACA	29	42
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(OCC(C)C)cc1	ZINC000853855562	EG	On-Demand	Mild	ACACB	33	41
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000853855563	EG	On-Demand	Mild	ACACA	29	42
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(OCC(C)C)cc1	ZINC000853855563	EG	On-Demand	Mild	ACACB	33	41
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853855623	GF	On-Demand	Anodyne	CCKBR	44	34
Cc1cccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)n1	ZINC000853855669	GG	On-Demand	Anodyne	SORT1	15	40
Cc1cccc(NC(=O)N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)n1	ZINC000853855669	GG	On-Demand	Anodyne	RBP4	57	36
Cc1cccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)n1	ZINC000853855670	GG	On-Demand	Anodyne	SORT1	15	40
Cc1cccc(NC(=O)N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)n1	ZINC000853855670	GG	On-Demand	Anodyne	RBP4	57	36
CCn1nccc1[C@@H]1OCC[C@H]1NC(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853855671	GH	On-Demand	Anodyne	PIK3CG	19	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(OC(F)(F)F)cc2)O1	ZINC000853855677	GD	On-Demand	Reactive	P2RY1	65	42
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccc(OC(F)(F)F)cc2)O1	ZINC000853855677	GD	On-Demand	Reactive	EPHX2	62	45
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(OC(F)(F)F)cc2)O1	ZINC000853855680	GD	On-Demand	Reactive	P2RY1	65	42
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccc(OC(F)(F)F)cc2)O1	ZINC000853855680	GD	On-Demand	Reactive	EPHX2	62	45
COc1ccccc1NC(=O)N1CCn2ncc(Br)c2C1	ZINC000853855727	FF	On-Demand	Anodyne	RBP4	20	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2nccs2)O1	ZINC000853855754	CC	On-Demand	Reactive	MAP1	82	35
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2nccs2)O1	ZINC000853855756	CC	On-Demand	Reactive	MAP1	82	35
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2ccccc2Cl)O1	ZINC000853855805	ED	On-Demand	Reactive	EPHB3	44	33
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2ccccc2Cl)O1	ZINC000853855808	ED	On-Demand	Reactive	EPHB3	44	33
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855813	DC	On-Demand	Reactive	CCKBR	42	39
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855813	DC	On-Demand	Reactive	KCNK3	49	37
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855814	DC	On-Demand	Reactive	CCKBR	42	39
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855814	DC	On-Demand	Reactive	KCNK3	49	37
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855815	DC	On-Demand	Reactive	CCKBR	42	39
Cc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855815	DC	On-Demand	Reactive	KCNK3	49	37
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855816	DC	On-Demand	Reactive	CCKBR	42	39
Cc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855816	DC	On-Demand	Reactive	KCNK3	49	37
CC(=O)Nc1cccc(NC(=O)N2CCn3ncc(Br)c3C2)c1	ZINC000853855836	GF	On-Demand	Anodyne	CSNK2A1	21	45
CC(=O)Nc1cccc(NC(=O)N2CCn3ncc(Br)c3C2)c1	ZINC000853855836	GF	On-Demand	Anodyne	P2RY14	47	34
Cc1nc(NC(=O)N2CCC(CO)(CO)C2)sc1-c1ccccc1	ZINC000853855846	EE	On-Demand	Anodyne	NPY5R	24	41
Cc1nc(NC(=O)N2CCC(CO)(CO)C2)sc1-c1ccccc1	ZINC000853855846	EE	On-Demand	Anodyne	PIK3CG	21	45
Cc1cccc(NC(=O)N2CCn3ncc(Br)c3C2)c1	ZINC000853855849	EG	On-Demand	Anodyne	P2RY14	50	36
Cc1cccc(NC(=O)N2CCn3ncc(Br)c3C2)c1	ZINC000853855849	EG	On-Demand	Anodyne	LIMK2	19	45
Cc1cccc(NC(=O)N2CCn3ncc(Br)c3C2)c1	ZINC000853855849	EG	On-Demand	Anodyne	KCNK3	49	37
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855863	DC	On-Demand	Reactive	CCR3	17	43
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855863	DC	On-Demand	Reactive	MTNR1A	15	42
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855863	DC	On-Demand	Reactive	MTNR1B	20	42
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855863	DC	On-Demand	Reactive	EPHX2	22	45
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855864	DC	On-Demand	Reactive	CCR3	17	43
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855864	DC	On-Demand	Reactive	MTNR1A	15	42
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855864	DC	On-Demand	Reactive	MTNR1B	20	42
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@H](C)O2)c1	ZINC000853855864	DC	On-Demand	Reactive	EPHX2	22	45
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855865	DC	On-Demand	Reactive	CCR3	17	43
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855865	DC	On-Demand	Reactive	MTNR1A	15	42
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855865	DC	On-Demand	Reactive	MTNR1B	20	42
COc1cccc(NC(=O)NNC(=O)[C@@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855865	DC	On-Demand	Reactive	EPHX2	22	45
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855866	DC	On-Demand	Reactive	CCR3	17	43
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855866	DC	On-Demand	Reactive	MTNR1A	15	42
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855866	DC	On-Demand	Reactive	MTNR1B	20	42
COc1cccc(NC(=O)NNC(=O)[C@H]2CN(C)C[C@@H](C)O2)c1	ZINC000853855866	DC	On-Demand	Reactive	EPHX2	22	45
O=C(Nc1nc2c(s1)CCCC2)N1CCn2ncc(Br)c2C1	ZINC000853855893	GG	On-Demand	Anodyne	SLC27A1	35	40
O=C(N1CCOCC1)N1CCn2ncc(Br)c2C1	ZINC000853855936	DC	On-Demand	Anodyne	AKR1C3	17	47
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccnc2)O1	ZINC000853855939	CB	On-Demand	Reactive	MTOR	25	43
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccnc2)O1	ZINC000853855939	CB	On-Demand	Reactive	RPS6KA3	18	41
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccnc2)O1	ZINC000853855939	CB	On-Demand	Reactive	NAMPT	40	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccnc2)O1	ZINC000853855940	CB	On-Demand	Reactive	MTOR	25	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccnc2)O1	ZINC000853855940	CB	On-Demand	Reactive	RPS6KA3	18	41
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccnc2)O1	ZINC000853855940	CB	On-Demand	Reactive	NAMPT	40	43
COC(=O)c1cccc(NC(=O)N2CCn3ncc(Br)c3C2)c1	ZINC000853855946	GE	On-Demand	Anodyne	P2RY14	49	35
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855975	FB	On-Demand	Reactive	CA2	30	48
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855975	FB	On-Demand	Reactive	CA1	24	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855975	FB	On-Demand	Reactive	CA4	27	45
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855975	FB	On-Demand	Reactive	CA12	25	48
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855975	FB	On-Demand	Reactive	CA9	26	48
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855975	FB	On-Demand	Reactive	P96878_MYCTU	48	38
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855978	FB	On-Demand	Reactive	CA2	30	48
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855978	FB	On-Demand	Reactive	CA1	24	40
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855978	FB	On-Demand	Reactive	CA4	27	45
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855978	FB	On-Demand	Reactive	CA12	25	48
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855978	FB	On-Demand	Reactive	CA9	26	48
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(S(N)(=O)=O)c2)O1	ZINC000853855978	FB	On-Demand	Reactive	P96878_MYCTU	48	38
O=C(Nc1ccc(C(F)(F)F)cc1)N1CCn2ncc(Br)c2C1	ZINC000853855992	GH	On-Demand	Anodyne	TRPV1	20	50
O=C(Nc1ccc(C(F)(F)F)cc1)N1CCn2ncc(Br)c2C1	ZINC000853855992	GH	On-Demand	Anodyne	EPHX2	46	45
O=C(Nc1ccc(C(F)(F)F)cc1)N1CCn2ncc(Br)c2C1	ZINC000853855992	GH	On-Demand	Anodyne	TRPM8	55	46
Ic1cnnn1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853856010	GD	On-Demand	Anodyne	AKT2	54	63
Ic1cnnn1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853856010	GD	On-Demand	Anodyne	AKT3	31	41
Ic1cnnn1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853856010	GD	On-Demand	Anodyne	JAK3	23	57
Ic1cnnn1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853856010	GD	On-Demand	Anodyne	JAK1	70	39
Ic1cnnn1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853856010	GD	On-Demand	Anodyne	JAK2	20	43
Ic1cnnn1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853856010	GD	On-Demand	Anodyne	ROCK2	15	41
Ic1cnnn1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853856010	GD	On-Demand	Anodyne	AKT1	20	43
COC(=O)c1sccc1NC(=O)N1CCn2ncc(Br)c2C1	ZINC000853856021	GF	On-Demand	Anodyne	FAS	34	43
O=C(NCCCSc1nccs1)NCc1cccnc1N1CCCC1	ZINC000853856022	GG	On-Demand	Clean	SCN10A	15	41
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2nc3ccccc3s2)O1	ZINC000853856045	ED	On-Demand	Reactive	CSNK1D	26	43
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2nc3ccccc3s2)O1	ZINC000853856046	ED	On-Demand	Reactive	CSNK1D	26	43
O=C(N1CCCCC1)N1CCC2(CCCC2=O)CC1	ZINC000853856058	CE	On-Demand	Anodyne	LIPE	33	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(Cl)c2)O1	ZINC000853856154	ED	On-Demand	Reactive	CCKBR	21	40
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)Nc2cccc(Cl)c2)O1	ZINC000853856154	ED	On-Demand	Reactive	F13A1	15	43
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(Cl)c2)O1	ZINC000853856157	ED	On-Demand	Reactive	CCKBR	21	40
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)Nc2cccc(Cl)c2)O1	ZINC000853856157	ED	On-Demand	Reactive	F13A1	15	43
Cc1cccc(NC(=O)N2CCn3ncc(Br)c3C2)n1	ZINC000853856162	EE	On-Demand	Anodyne	GRM5	15	42
Cc1cccc(NC(=O)N2CCn3ncc(Br)c3C2)n1	ZINC000853856162	EE	On-Demand	Anodyne	SORT1	21	43
NC(=O)c1ccc(N2CCC(n3nncc3I)CC2)nn1	ZINC000853856166	GC	On-Demand	Anodyne	SCD1	45	47
O=C(Nc1ccc(Cl)nc1)N1CCC(CO)(CO)C1	ZINC000853856222	CC	On-Demand	Anodyne	EPHX2	35	43
C[C@H]1CN(c2ccc(NC(=O)N3CCC(CO)(CO)C3)cc2F)C[C@H](C)O1	ZINC000853856226	GD	On-Demand	Anodyne	NPY2R	76	37
C[C@H]1CN(c2ccc(NC(=O)N3CCC(CO)(CO)C3)cc2F)C[C@@H](C)O1	ZINC000853856227	GD	On-Demand	Anodyne	NPY2R	76	37
COCCOc1ccc(NC(=O)N2CCn3ncc(Br)c3C2)cn1	ZINC000853856249	GE	On-Demand	Anodyne	PDGFRB	29	40
O=C(Nc1nccs1)N1CCn2ncc(Br)c2C1	ZINC000853856254	EE	On-Demand	Anodyne	MAP1	64	38
CN1CCN(c2ccccc2NC(=O)N2CCC(CO)(CO)C2)CC1	ZINC000853856284	EC	On-Demand	Anodyne	HTR1B	21	42
CN1CCN(c2ccccc2NC(=O)N2CCC(CO)(CO)C2)CC1	ZINC000853856284	EC	On-Demand	Anodyne	KCNQ2	79	43
CC(=O)c1cccc(NC(=O)N2CCn3ncc(Br)c3C2)c1	ZINC000853856297	FF	On-Demand	Anodyne	P2RY14	49	35
O=C(N1CCC(CO)(CO)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853856304	EC	On-Demand	Bother	CACNA1C	44	34
O=C(N1CCC(CO)(CO)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853856304	EC	On-Demand	Bother	CACNA1D	72	34
COc1ccc(CN(C)C(=O)[C@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)cc1OC	ZINC000853856338	IE	On-Demand	Anodyne	MT-ND1	15	44
COc1ccc(CN(C)C(=O)[C@@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)cc1OC	ZINC000853856340	IE	On-Demand	Anodyne	MT-ND1	15	44
Cc1cc([C@@H]2CCN(C(=O)Nc3ccc(Cl)nc3)C2)c(O)cc1Cl	ZINC000853856349	FI	On-Demand	Anodyne	PRCP	40	32
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc2ccccc2c1	ZINC000853856366	IH	On-Demand	Anodyne	TPH1	48	40
COCc1cc([N+](=O)[O-])ccc1N1CC[C@@]2(O)C[C@H]2C1	ZINC000853856381	CD	On-Demand	Bother	CACNA1D	60	34
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)CC1	ZINC000853856383	ID	On-Demand	Anodyne	TRY2_BOVIN	15	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)CC1	ZINC000853856384	ID	On-Demand	Anodyne	TRY2_BOVIN	15	40
Cc1nc(NC(=O)NC[C@@H]2CCO[C@H]2c2nccn2C)sc1-c1ccccc1	ZINC000853856386	GH	On-Demand	Anodyne	PI4KB	38	43
O=C(N1CC[C@@H]2C[C@@H]2C1)C(F)(F)c1ccccc1F	ZINC000853856393	CF	On-Demand	Anodyne	RBP4	85	38
O=C(N1CC[C@H]2C[C@H]2C1)C(F)(F)c1ccccc1F	ZINC000853856394	CF	On-Demand	Anodyne	RBP4	85	38
O=C(N1CC[C@H]2C[C@@H]2C1)C(F)(F)c1ccccc1F	ZINC000853856395	CF	On-Demand	Anodyne	RBP4	85	38
O=C(Nc1nc2c(s1)CCCCC2)N1CCn2ncc(Br)c2C1	ZINC000853856396	GG	On-Demand	Anodyne	SLC27A1	34	40
O=C(N1CC[C@@H]2C[C@H]2C1)C(F)(F)c1ccccc1F	ZINC000853856397	CF	On-Demand	Anodyne	RBP4	85	38
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@H]4C[C@H]4C3)cc2F)C[C@@H](C)O1	ZINC000853856516	EG	On-Demand	Anodyne	NPY2R	76	38
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@H]4C[C@@H]4C3)cc2F)C[C@@H](C)O1	ZINC000853856518	EG	On-Demand	Anodyne	NPY2R	76	38
COc1cccc([C@]2(C)CCN(c3ccc(N)cc3[N+](=O)[O-])C2)c1	ZINC000853856524	EG	On-Demand	Bother	TAAR1	18	43
O=C(NCc1ncccn1)Nc1ccc(N2CCOCC2)cn1	ZINC000853856586	DD	On-Demand	Anodyne	PRNP	32	41
O=C(NCc1ncccn1)Nc1ccc(N2CCOCC2)cn1	ZINC000853856586	DD	On-Demand	Anodyne	MTOR	44	39
O=C(NCc1ncccn1)Nc1ccc(N2CCOCC2)cn1	ZINC000853856586	DD	On-Demand	Anodyne	STAT6	73	39
O=C(NCc1ncccn1)Nc1ccc(N2CCOCC2)cn1	ZINC000853856586	DD	On-Demand	Anodyne	NAMPT	31	42
CN1CCN(c2ccccc2NC(=O)NC[C@H]2C(C)(C)C2(F)F)CC1	ZINC000853856593	FF	On-Demand	Anodyne	KCNQ2	86	45
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2C(C)(C)C2(F)F)CC1	ZINC000853856594	FF	On-Demand	Anodyne	KCNQ2	86	45
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H]3C(C)(C)C3(F)F)cc2F)C[C@@H](C)O1	ZINC000853856601	GH	On-Demand	Anodyne	NPY2R	61	37
C[C@H]1CN(c2ccc(NC(=O)NC[C@H]3C(C)(C)C3(F)F)cc2F)C[C@@H](C)O1	ZINC000853856603	GH	On-Demand	Anodyne	NPY2R	61	37
CC(=O)Nc1cccc(NC(=O)N2CC[C@H](c3cc(C)c(Cl)cc3O)C2)c1	ZINC000853856605	GI	On-Demand	Anodyne	MCHR1	30	42
CC(=O)Nc1cccc(NC(=O)N2CC[C@@H](c3cc(C)c(Cl)cc3O)C2)c1	ZINC000853856606	GI	On-Demand	Anodyne	MCHR1	30	42
Cc1cc([C@@H]2CCN(C(=O)Nc3cc(F)ccc3F)C2)c(O)cc1Cl	ZINC000853856612	FJ	On-Demand	Anodyne	PRCP	52	36
Cc1cc([C@@H]2CCN(C(=O)Nc3cc(F)ccc3F)C2)c(O)cc1Cl	ZINC000853856612	FJ	On-Demand	Anodyne	RBP4	36	42
COC(=O)Cc1csc(NC(=O)NCc2ncccn2)n1	ZINC000853856629	DC	On-Demand	Anodyne	ROCK1	19	43
COC(=O)Cc1csc(NC(=O)NCc2ncccn2)n1	ZINC000853856629	DC	On-Demand	Anodyne	ROCK2	15	46
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCc2ncccn2)c1	ZINC000853856631	FD	On-Demand	Anodyne	HRH2	26	41
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCc2ncccn2)c1	ZINC000853856631	FD	On-Demand	Anodyne	CCR3	47	37
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCc2ncccn2)c1	ZINC000853856631	FD	On-Demand	Anodyne	PRMT3	44	31
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCc2ncccn2)c1	ZINC000853856632	FD	On-Demand	Anodyne	HRH2	26	41
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCc2ncccn2)c1	ZINC000853856632	FD	On-Demand	Anodyne	CCR3	47	37
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCc2ncccn2)c1	ZINC000853856632	FD	On-Demand	Anodyne	PRMT3	44	31
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@](C)(c2cccc(OC)c2)C1	ZINC000853856707	FG	On-Demand	Bother	TAAR1	21	41
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@](C)(c2cccc(OC)c2)C1	ZINC000853856708	FG	On-Demand	Bother	TAAR1	21	41
O=C(Nc1ccc(Cl)nc1)N1CC[C@@H]2C[C@H]2C1	ZINC000853856722	CF	On-Demand	Anodyne	EPHX2	20	41
O=C(Nc1ccc(Cl)nc1)N1CC[C@@H]2C[C@H]2C1	ZINC000853856722	CF	On-Demand	Anodyne	RBP4	42	35
O=C(Nc1ccc(Cl)nc1)N1CC[C@H]2C[C@@H]2C1	ZINC000853856723	CF	On-Demand	Anodyne	EPHX2	20	41
O=C(Nc1ccc(Cl)nc1)N1CC[C@H]2C[C@@H]2C1	ZINC000853856723	CF	On-Demand	Anodyne	RBP4	42	35
O=C(Nc1ccc(Cl)nc1)N1CC[C@H]2C[C@H]2C1	ZINC000853856724	CF	On-Demand	Anodyne	EPHX2	20	41
O=C(Nc1ccc(Cl)nc1)N1CC[C@H]2C[C@H]2C1	ZINC000853856724	CF	On-Demand	Anodyne	RBP4	42	35
O=C(Nc1ccc(Cl)nc1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853856725	CF	On-Demand	Anodyne	EPHX2	20	41
O=C(Nc1ccc(Cl)nc1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853856725	CF	On-Demand	Anodyne	RBP4	42	35
CCSC1(CNC(=O)Nc2cccnc2Cl)CC1	ZINC000853856785	CG	On-Demand	Anodyne	G2YM83_BOTF4	78	40
COc1cccc([C@]2(C)CCN(c3cc(C)nc(N)n3)C2)c1	ZINC000853856789	CF	On-Demand	Anodyne	HRH4	18	46
O=C(N1CC[C@@H]2C[C@@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853856821	DE	On-Demand	Bother	CACNA1D	59	33
O=C(N1CC[C@H]2C[C@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853856822	DE	On-Demand	Bother	CACNA1D	59	33
O=C(N1CC[C@H]2C[C@@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853856823	DE	On-Demand	Bother	CACNA1D	59	33
O=C(N1CC[C@@H]2C[C@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853856824	DE	On-Demand	Bother	CACNA1D	59	33
COc1ccccc1NC(=O)N1CC[C@@H](c2cc(C)c(Cl)cc2O)C1	ZINC000853856826	FI	On-Demand	Anodyne	HTR4	23	41
COc1ccccc1NC(=O)N1CC[C@@H](c2cc(C)c(Cl)cc2O)C1	ZINC000853856826	FI	On-Demand	Anodyne	RBP4	50	51
COc1ccccc1NC(=O)N1CC[C@@H](c2cc(C)c(Cl)cc2O)C1	ZINC000853856826	FI	On-Demand	Anodyne	SMO	21	47
COc1ccccc1NC(=O)N1CC[C@H](c2cc(C)c(Cl)cc2O)C1	ZINC000853856827	FI	On-Demand	Anodyne	HTR4	23	41
COc1ccccc1NC(=O)N1CC[C@H](c2cc(C)c(Cl)cc2O)C1	ZINC000853856827	FI	On-Demand	Anodyne	RBP4	50	51
COc1ccccc1NC(=O)N1CC[C@H](c2cc(C)c(Cl)cc2O)C1	ZINC000853856827	FI	On-Demand	Anodyne	SMO	21	47
CON(C)CCNC(=O)N[C@H](C)Cc1ccccc1Br	ZINC000853856900	EE	On-Demand	Anodyne	ANPEP	21	44
CON(C)CCNC(=O)N[C@H](C)Cc1ccccc1Br	ZINC000853856900	EE	On-Demand	Anodyne	PAPA1_CARPA	19	41
CON(C)CCNC(=O)N[C@@H](C)Cc1ccccc1Br	ZINC000853856901	EE	On-Demand	Anodyne	ANPEP	21	44
CON(C)CCNC(=O)N[C@@H](C)Cc1ccccc1Br	ZINC000853856901	EE	On-Demand	Anodyne	PAPA1_CARPA	19	41
Cc1cc([C@@H]2CCN(C(=O)Nc3ccc(Cl)cn3)C2)c(O)cc1Cl	ZINC000853856915	FI	On-Demand	Anodyne	F10	38	43
Cc1cc([C@@H]2CCN(C(=O)Nc3ccc(Cl)cn3)C2)c(O)cc1Cl	ZINC000853856915	FI	On-Demand	Anodyne	PRCP	47	32
Cc1cc(C)cc(NC(=O)NCCc2ccc(O)nc2)c1	ZINC000853856938	CF	On-Demand	Anodyne	RAF1	18	41
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)CC1	ZINC000853856999	HD	On-Demand	Anodyne	TRY2_BOVIN	21	43
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)CC1	ZINC000853856999	HD	On-Demand	Anodyne	PTR1	47	34
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)CC1	ZINC000853857000	HD	On-Demand	Anodyne	TRY2_BOVIN	21	43
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)CC1	ZINC000853857000	HD	On-Demand	Anodyne	PTR1	47	34
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)C1	ZINC000853857009	ID	On-Demand	Anodyne	DPP7	45	33
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)C1	ZINC000853857010	ID	On-Demand	Anodyne	DPP7	45	33
CCSC1(CNC(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)CC1	ZINC000853857050	GH	On-Demand	Anodyne	NPY2R	71	39
CCSC1(CNC(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)CC1	ZINC000853857051	GH	On-Demand	Anodyne	NPY2R	71	39
CCSC1(CNC(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)CC1	ZINC000853857052	GH	On-Demand	Anodyne	NPY2R	71	39
COc1cccc([C@]2(C)CCN(c3cc(N)ccc3[N+](=O)[O-])C2)c1	ZINC000853857061	EG	On-Demand	Bother	TAAR1	19	40
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C[C@@H](C)O)c3ccccc3)C2)cc1	ZINC000853857077	GG	On-Demand	Clean	MTNR1A	15	43
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C[C@@H](C)O)c3ccccc3)C2)cc1	ZINC000853857077	GG	On-Demand	Clean	MTNR1B	16	43
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C[C@H](C)O)c3ccccc3)C2)cc1	ZINC000853857078	GG	On-Demand	Clean	MTNR1A	15	43
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C[C@H](C)O)c3ccccc3)C2)cc1	ZINC000853857078	GG	On-Demand	Clean	MTNR1B	16	43
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C[C@@H](C)O)c3ccccc3)C2)cc1	ZINC000853857079	GG	On-Demand	Clean	MTNR1A	15	43
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C[C@@H](C)O)c3ccccc3)C2)cc1	ZINC000853857079	GG	On-Demand	Clean	MTNR1B	16	43
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C[C@H](C)O)c3ccccc3)C2)cc1	ZINC000853857080	GG	On-Demand	Clean	MTNR1A	15	43
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C[C@H](C)O)c3ccccc3)C2)cc1	ZINC000853857080	GG	On-Demand	Clean	MTNR1B	16	43
C#CCNC(=O)c1ccc(N2CC[C@](C)(c3cccc(OC)c3)C2)nc1	ZINC000853857089	EF	On-Demand	Mild	DRD4	47	36
C#CCNC(=O)c1ccc(N2CC[C@@](C)(c3cccc(OC)c3)C2)nc1	ZINC000853857090	EF	On-Demand	Mild	DRD4	47	36
COC(=O)c1cccc(N2CC[C@@]3(O)C[C@H]3C2)n1	ZINC000853857114	BC	On-Demand	Anodyne	HSD11B1	15	46
COC(=O)c1sc(N2CC[C@](C)(c3cccc(OC)c3)C2)nc1Cl	ZINC000853857156	FH	On-Demand	Anodyne	DRD4	41	32
COC(=O)c1sc(N2CC[C@@](C)(c3cccc(OC)c3)C2)nc1Cl	ZINC000853857157	FH	On-Demand	Anodyne	DRD4	41	32
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	CA2	59	45
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	CA1	54	44
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	CA7	38	42
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	CA4	47	42
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	CA14	31	42
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	S1PR2	19	42
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	EPHX2	42	40
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	CA12	42	45
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	CA9	46	45
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	MTCA1	48	43
CN(C)C1CCC2(CC1)CCN(C(=O)Nc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000853857158	GE	On-Demand	Anodyne	P96878_MYCTU	60	43
Cc1cccc(NC(=O)N2CC[C@@H](c3cc(C)c(Cl)cc3O)C2)n1	ZINC000853857163	EI	On-Demand	Anodyne	HTR1F	58	36
Cc1cccc(NC(=O)N2CC[C@@H](c3cc(C)c(Cl)cc3O)C2)n1	ZINC000853857163	EI	On-Demand	Anodyne	GRM5	22	42
Cc1cccc(NC(=O)N2CC[C@@H](c3cc(C)c(Cl)cc3O)C2)n1	ZINC000853857163	EI	On-Demand	Anodyne	SORT1	15	43
Cc1cccc(NC(=O)N2CC[C@H](c3cc(C)c(Cl)cc3O)C2)n1	ZINC000853857164	EI	On-Demand	Anodyne	HTR1F	58	36
Cc1cccc(NC(=O)N2CC[C@H](c3cc(C)c(Cl)cc3O)C2)n1	ZINC000853857164	EI	On-Demand	Anodyne	GRM5	22	42
Cc1cccc(NC(=O)N2CC[C@H](c3cc(C)c(Cl)cc3O)C2)n1	ZINC000853857164	EI	On-Demand	Anodyne	SORT1	15	43
CCSC1(CNC(=O)Nc2ccc(Cl)nc2)CC1	ZINC000853857165	CG	On-Demand	Anodyne	NAMPT	17	42
CN1CCN(c2ccccc2NC(=O)NCc2ncccn2)CC1	ZINC000853857172	ED	On-Demand	Anodyne	HTR1A	47	35
CN1CCN(c2ccccc2NC(=O)NCc2ncccn2)CC1	ZINC000853857172	ED	On-Demand	Anodyne	KCNQ2	82	44
CN1CCN(c2ccccc2NC(=O)NCc2ncccn2)CC1	ZINC000853857172	ED	On-Demand	Anodyne	P2RY1	38	41
CN1CCN(c2ccccc2NC(=O)NCc2ncccn2)CC1	ZINC000853857172	ED	On-Demand	Anodyne	CSF1R	15	47
COc1cccc([C@@]2(C)CCN(c3nccc(N4CCCC4)n3)C2)c1	ZINC000853857185	EG	On-Demand	Anodyne	GALR2	46	38
COc1cccc([C@]2(C)CCN(c3nccc(N4CCCC4)n3)C2)c1	ZINC000853857186	EG	On-Demand	Anodyne	GALR2	46	38
Cc1cc([C@@H]2CCN(C(=O)Nc3cccnc3Cl)C2)c(O)cc1Cl	ZINC000853857187	FI	On-Demand	Anodyne	SMO	21	43
Cc1cc([C@@H]2CCN(C(=O)Nc3cccnc3Cl)C2)c(O)cc1Cl	ZINC000853857187	FI	On-Demand	Anodyne	G2YM83_BOTF4	58	34
Cc1nc(NC(=O)N2CC[C@H]3C[C@H]3C2)sc1-c1ccccc1	ZINC000853857203	DH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2CC[C@H]3C[C@H]3C2)sc1-c1ccccc1	ZINC000853857203	DH	On-Demand	Anodyne	RBP4	54	35
Cc1nc(NC(=O)N2CC[C@@H]3C[C@H]3C2)sc1-c1ccccc1	ZINC000853857204	DH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2CC[C@@H]3C[C@H]3C2)sc1-c1ccccc1	ZINC000853857204	DH	On-Demand	Anodyne	RBP4	54	35
Cc1nc(NC(=O)N2CC[C@H]3C[C@@H]3C2)sc1-c1ccccc1	ZINC000853857205	DH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2CC[C@H]3C[C@@H]3C2)sc1-c1ccccc1	ZINC000853857205	DH	On-Demand	Anodyne	RBP4	54	35
Cc1nc(NC(=O)N2CC[C@@H]3C[C@@H]3C2)sc1-c1ccccc1	ZINC000853857206	DH	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2CC[C@@H]3C[C@@H]3C2)sc1-c1ccccc1	ZINC000853857206	DH	On-Demand	Anodyne	RBP4	54	35
CN1CCN(c2ccccc2NC(=O)NCC2(O)CCC(C)(C)CC2)CC1	ZINC000853857222	FF	On-Demand	Anodyne	KCNQ2	79	41
CCSC1(CNC(=O)Nc2ccccc2N2CCN(C)CC2)CC1	ZINC000853857232	EF	On-Demand	Anodyne	KCNQ2	81	42
COc1cccc([C@]2(C)CCN(c3cc(Cl)nc(N)n3)C2)c1	ZINC000853857244	DF	On-Demand	Anodyne	HRH4	16	44
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853857254	JD	On-Demand	Anodyne	CA2	78	41
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853857254	JD	On-Demand	Anodyne	CA1	60	41
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853857254	JD	On-Demand	Anodyne	CA7	41	38
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853857254	JD	On-Demand	Anodyne	CA4	50	41
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853857254	JD	On-Demand	Anodyne	CA14	42	38
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccc(CS(C)(=O)=O)cc1)c1ccc(S(N)(=O)=O)cc1	ZINC000853857254	JD	On-Demand	Anodyne	CA9	40	41
COC(=O)c1cccc(N2CC[C@](C)(c3cccc(OC)c3)C2)n1	ZINC000853857271	EG	On-Demand	Anodyne	DRD4	40	30
COC(=O)c1cccc(N2CC[C@@](C)(c3cccc(OC)c3)C2)n1	ZINC000853857272	EG	On-Demand	Anodyne	DRD4	40	30
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@H]3C2)CC1	ZINC000853857286	DE	On-Demand	Anodyne	HTR1D	15	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@H]3C2)CC1	ZINC000853857286	DE	On-Demand	Anodyne	HTR1B	19	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@H]3C2)CC1	ZINC000853857286	DE	On-Demand	Anodyne	KCNQ2	74	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@H]3C2)CC1	ZINC000853857286	DE	On-Demand	Anodyne	RBP4	67	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@H]3C2)CC1	ZINC000853857287	DE	On-Demand	Anodyne	HTR1D	15	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@H]3C2)CC1	ZINC000853857287	DE	On-Demand	Anodyne	HTR1B	19	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@H]3C2)CC1	ZINC000853857287	DE	On-Demand	Anodyne	KCNQ2	74	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@H]3C2)CC1	ZINC000853857287	DE	On-Demand	Anodyne	RBP4	67	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000853857288	DE	On-Demand	Anodyne	HTR1D	15	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000853857288	DE	On-Demand	Anodyne	HTR1B	19	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000853857288	DE	On-Demand	Anodyne	KCNQ2	74	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3C[C@@H]3C2)CC1	ZINC000853857288	DE	On-Demand	Anodyne	RBP4	67	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@@H]3C2)CC1	ZINC000853857289	DE	On-Demand	Anodyne	HTR1D	15	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@@H]3C2)CC1	ZINC000853857289	DE	On-Demand	Anodyne	HTR1B	19	46
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@@H]3C2)CC1	ZINC000853857289	DE	On-Demand	Anodyne	KCNQ2	74	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3C[C@@H]3C2)CC1	ZINC000853857289	DE	On-Demand	Anodyne	RBP4	67	40
C[C@@]12COC[C@@H]1CN(c1ccc([N+](=O)[O-])c3nonc13)C2	ZINC000853857305	CD	On-Demand	Bother	GSTM2	91	39
C[C@@]12COC[C@@H]1CN(c1ccc([N+](=O)[O-])c3nonc13)C2	ZINC000853857305	CD	On-Demand	Bother	GSTP1	52	39
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)c1	ZINC000853857445	HE	On-Demand	Anodyne	KCNK3	54	31
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)c1	ZINC000853857445	HE	On-Demand	Anodyne	KCNK9	42	31
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)c1	ZINC000853857446	HE	On-Demand	Anodyne	KCNK3	54	31
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(CS(C)(=O)=O)cc2)c1	ZINC000853857446	HE	On-Demand	Anodyne	KCNK9	42	31
N#Cc1ccnc(N2CCC(n3nncc3I)CC2)c1	ZINC000853857513	GD	On-Demand	Mild	MAP3K12	44	31
O=C(NCCc1ccc(O)nc1)Nc1nc2c(s1)CCCC2	ZINC000853857586	DE	On-Demand	Anodyne	SLC27A1	39	43
O=C(Nc1ccc(Cl)nc1)N1CCC2(CCCC2=O)CC1	ZINC000853857587	DG	On-Demand	Anodyne	CACNA1H	41	35
O=C(Nc1ccc(Cl)nc1)N1CCC2(CCCC2=O)CC1	ZINC000853857587	DG	On-Demand	Anodyne	NPY5R	32	41
Ic1cnnn1C1CCN(c2ccccn2)CC1	ZINC000853857645	FE	On-Demand	Anodyne	EBP	28	45
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA2	127	50
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA1	112	50
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA7	62	45
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA5B	34	40
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA4	90	46
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA5A	38	40
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA14	63	46
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	EPHX2	22	41
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA12	93	49
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	CA9	90	49
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	NCE103	35	46
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	MTCA1	56	49
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	P96878_MYCTU	72	49
C[C@H]1CC[C@@H](CNC(=O)Nc2ccc(S(N)(=O)=O)cc2)N1C	ZINC000853857651	EC	On-Demand	Anodyne	NAMPT	46	40
COC(=O)CCCCCCCNC(=O)N[C@H]1COC(C)(C)C1	ZINC000853857661	DE	On-Demand	Anodyne	EPHX2	36	61
COC(=O)CCCCCCCNC(=O)N[C@@H]1COC(C)(C)C1	ZINC000853857662	DE	On-Demand	Anodyne	EPHX2	36	61
COC(=O)CCCCCCCNC(=O)N[C@H]1CCCC[C@@H]1C#N	ZINC000853857681	DF	On-Demand	Mild	EPHX2	23	63
COC(=O)CCCCCCCNC(=O)N[C@H]1CCCC[C@H]1C#N	ZINC000853857682	DF	On-Demand	Mild	EPHX2	23	63
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCCC[C@@H]1C#N	ZINC000853857683	DF	On-Demand	Mild	EPHX2	23	63
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCCC[C@H]1C#N	ZINC000853857684	DF	On-Demand	Mild	EPHX2	23	63
C#CCCN(CCOC)C(=O)N[C@H]1CCc2c(OC)cccc21	ZINC000853857719	DE	On-Demand	Mild	HTR1A	18	45
C#CCCN(CCOC)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000853857720	DE	On-Demand	Mild	HTR1A	18	45
O=C(Nc1ccc2oc(=O)ccc2c1)N(CCN1CCOCC1)CC1CC1	ZINC000853857726	FE	On-Demand	Anodyne	CASR	61	44
O[C@@]12CCN(c3nccc(N4CCCC4)n3)C[C@@H]1C2	ZINC000853857729	CD	On-Demand	Anodyne	SORD	77	37
Cc1nsc(C(=O)N[C@H](c2ccccc2)[C@H](O)C(C)C)n1	ZINC000853857736	DE	On-Demand	Anodyne	TACR3	33	42
Cc1nsc(C(=O)N[C@H](c2ccccc2)[C@@H](O)C(C)C)n1	ZINC000853857737	DE	On-Demand	Anodyne	TACR3	33	42
Cc1nsc(C(=O)N[C@@H](c2ccccc2)[C@H](O)C(C)C)n1	ZINC000853857738	DE	On-Demand	Anodyne	TACR3	33	42
Cc1nsc(C(=O)N[C@@H](c2ccccc2)[C@@H](O)C(C)C)n1	ZINC000853857739	DE	On-Demand	Anodyne	TACR3	33	42
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCNC1=O	ZINC000853857745	CC	On-Demand	Anodyne	EPHX2	26	57
COC(=O)CCCCCCCNC(=O)N[C@H]1CCNC1=O	ZINC000853857746	CC	On-Demand	Anodyne	EPHX2	26	57
O=C(NCC1CCC(O)CC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853857751	EE	On-Demand	Anodyne	EPHX2	25	46
COC(=O)c1ccc(CNC(=O)N2CCCC2)c(F)c1	ZINC000853857752	CD	On-Demand	Anodyne	BDKRB1	29	44
COC(=O)c1ccc(CNC(=O)N2CCCC2)c(F)c1	ZINC000853857752	CD	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCc1ccc(O)nc1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853857756	FE	On-Demand	Anodyne	CCR3	54	41
O=C(NNc1ccc(Cl)cn1)Nc1nc(CN2CCOCC2)cs1	ZINC000853857796	FE	On-Demand	Reactive	F10	52	36
C#C[C@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857803	CF	On-Demand	Mild	CCKAR	20	40
C#C[C@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857803	CF	On-Demand	Mild	CCKBR	30	45
C#C[C@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857803	CF	On-Demand	Mild	KCNK3	62	39
C#C[C@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857803	CF	On-Demand	Mild	KCNK9	48	39
C#C[C@@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857805	CF	On-Demand	Mild	CCKAR	20	40
C#C[C@@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857805	CF	On-Demand	Mild	CCKBR	30	45
C#C[C@@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857805	CF	On-Demand	Mild	KCNK3	62	39
C#C[C@@H](NC(=O)Nc1cccc(C)c1)C1CCOCC1	ZINC000853857805	CF	On-Demand	Mild	KCNK9	48	39
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCCC2)C1	ZINC000853857811	CF	On-Demand	Anodyne	CCR5	30	42
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCCC2)C1	ZINC000853857811	CF	On-Demand	Anodyne	MCHR1	19	42
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCCC2)C1	ZINC000853857811	CF	On-Demand	Anodyne	L3MBTL3	51	38
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCCC2)C1	ZINC000853857814	CF	On-Demand	Anodyne	CCR5	30	42
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCCC2)C1	ZINC000853857814	CF	On-Demand	Anodyne	MCHR1	19	42
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCCC2)C1	ZINC000853857814	CF	On-Demand	Anodyne	L3MBTL3	51	38
C#C[C@H](NC(=O)Nc1ncc(Cc2ccccc2)s1)C1CCOCC1	ZINC000853857843	FG	On-Demand	Mild	CDK5	44	41
C#C[C@@H](NC(=O)Nc1ncc(Cc2ccccc2)s1)C1CCOCC1	ZINC000853857845	FG	On-Demand	Mild	CDK5	44	41
O=C(NCCc1ccc(Cl)nc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853857858	EE	On-Demand	Anodyne	CPT1A	68	41
O=C(NCCc1ccc(Cl)nc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853857860	EE	On-Demand	Anodyne	CPT1A	68	41
C#C[C@@H](NC(=O)Nc1nc2ccccc2s1)C1CCOCC1	ZINC000853857894	DF	On-Demand	Mild	CASR	15	42
C#C[C@@H](NC(=O)Nc1nc2ccccc2s1)C1CCOCC1	ZINC000853857894	DF	On-Demand	Mild	CSNK1D	17	43
C#C[C@H](NC(=O)Nc1nc2ccccc2s1)C1CCOCC1	ZINC000853857896	DF	On-Demand	Mild	CASR	15	42
C#C[C@H](NC(=O)Nc1nc2ccccc2s1)C1CCOCC1	ZINC000853857896	DF	On-Demand	Mild	CSNK1D	17	43
C#Cc1cnc(N2CCc3cc(OC)ccc3C2)nc1	ZINC000853857913	CE	On-Demand	Mild	DRD5	18	46
C#C[C@@H](NC(=O)Nc1ccccc1Cl)C1CCOCC1	ZINC000853857929	CF	On-Demand	Mild	CXCL8	45	36
C#C[C@H](NC(=O)Nc1ccccc1Cl)C1CCOCC1	ZINC000853857930	CF	On-Demand	Mild	CXCL8	45	36
C#C[C@H](NC(=O)Nc1ccc(C)c(Cl)c1)C1CCOCC1	ZINC000853857931	DG	On-Demand	Mild	EPHX2	16	49
C#C[C@@H](NC(=O)Nc1ccc(C)c(Cl)c1)C1CCOCC1	ZINC000853857932	DG	On-Demand	Mild	EPHX2	16	49
O=C(N(CCN1CCOCC1)CC1CC1)C(F)(F)c1ccccc1F	ZINC000853857982	FE	On-Demand	Anodyne	CASR	52	40
COC(=O)CCCCCCCNC(=O)N1CCC(c2ccon2)CC1	ZINC000853857989	FG	On-Demand	Anodyne	ETHR	40	32
CN1CCN(c2ccccc2NC(=O)N2CCOC(C3CC3)(C3CC3)C2)CC1	ZINC000853858006	GF	On-Demand	Anodyne	KCNQ2	69	38
OC1CCC(CNCc2c(-c3ccccc3)nc3sccn23)CC1	ZINC000853858016	EH	On-Demand	Anodyne	VCP	42	34
O=C(Nc1cccc(N2CCOC2=O)c1)N(CCN1CCOCC1)CC1CC1	ZINC000853858022	GE	On-Demand	Anodyne	CASR	63	48
Cn1ccnc1C(=O)NCC1CCC(O)CC1	ZINC000853858026	BC	On-Demand	Anodyne	CACNA1I	56	36
COC(=O)CCCCCCCNC(=O)N1CCc2cc(OC)ccc2C1	ZINC000853858031	FG	On-Demand	Anodyne	DRD4	43	32
COC(=O)CCCCCCCNC(=O)N1CCc2cc(OC)ccc2C1	ZINC000853858031	FG	On-Demand	Anodyne	DRD3	15	45
COC(=O)CCCCCCCNC(=O)N1CCc2cc(OC)ccc2C1	ZINC000853858031	FG	On-Demand	Anodyne	DRD5	20	45
COC(=O)CCCCCCCNC(=O)N1CCc2cc(OC)ccc2C1	ZINC000853858031	FG	On-Demand	Anodyne	MTNR1A	54	43
COC(=O)CCCCCCCNC(=O)N1CCc2cc(OC)ccc2C1	ZINC000853858031	FG	On-Demand	Anodyne	MTNR1B	52	43
COC(=O)CCCCCCCNC(=O)N[C@H]1CC[C@H](C)S(=O)(=O)C1	ZINC000853858037	FD	On-Demand	Anodyne	EPHX2	24	63
COC(=O)CCCCCCCNC(=O)N[C@H]1CC[C@@H](C)S(=O)(=O)C1	ZINC000853858038	FD	On-Demand	Anodyne	EPHX2	24	63
COC(=O)CCCCCCCNC(=O)N[C@@H]1CC[C@H](C)S(=O)(=O)C1	ZINC000853858039	FD	On-Demand	Anodyne	EPHX2	24	63
COC(=O)CCCCCCCNC(=O)N[C@@H]1CC[C@@H](C)S(=O)(=O)C1	ZINC000853858040	FD	On-Demand	Anodyne	EPHX2	24	63
O=C(NNc1ccc(Cl)cn1)Nc1ccc(N2CCOCC2)cn1	ZINC000853858071	EE	On-Demand	Reactive	F10	50	35
O=C(NNc1ccc(Cl)cn1)Nc1ccc(N2CCOCC2)cn1	ZINC000853858071	EE	On-Demand	Reactive	AKR1C3	15	48
O=C(NNc1ccc(Cl)cn1)Nc1ccc(N2CCOCC2)cn1	ZINC000853858071	EE	On-Demand	Reactive	STAT6	57	36
COc1cccc(C2(NC(=O)NCCc3ccc(Cl)nc3)CCC2)c1	ZINC000853858093	FH	On-Demand	Anodyne	MTNR1A	43	36
C#C[C@@H](NC(=O)Nc1ccccc1N1CCN(CC)CC1)C1CCOCC1	ZINC000853858113	FE	On-Demand	Mild	KCNQ2	83	44
C#C[C@H](NC(=O)Nc1ccccc1N1CCN(CC)CC1)C1CCOCC1	ZINC000853858115	FE	On-Demand	Mild	KCNQ2	83	44
CN(c1ccccc1)[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853858126	EG	On-Demand	Anodyne	RBP4	57	38
CN(c1ccccc1)[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853858126	EG	On-Demand	Anodyne	SMO	37	40
CN(c1ccccc1)[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853858126	EG	On-Demand	Anodyne	G2YM83_BOTF4	69	37
CN(c1ccccc1)[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853858128	EG	On-Demand	Anodyne	RBP4	57	38
CN(c1ccccc1)[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853858128	EG	On-Demand	Anodyne	SMO	37	40
CN(c1ccccc1)[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853858128	EG	On-Demand	Anodyne	G2YM83_BOTF4	69	37
C#CCCN(CCOC)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000853858169	EF	On-Demand	Mild	MTNR1A	66	43
C#CCCN(CCOC)C(=O)NCCc1ccc(OC)cc1Cl	ZINC000853858169	EF	On-Demand	Mild	MTNR1B	49	38
C#C[C@H](NC(=O)Nc1cccc(C#N)c1)C1CCOCC1	ZINC000853858175	CE	On-Demand	Mild	CCR3	16	42
C#C[C@@H](NC(=O)Nc1cccc(C#N)c1)C1CCOCC1	ZINC000853858178	CE	On-Demand	Mild	CCR3	16	42
C#C[C@H](NC(=O)Nc1ccc(OC)cc1)C1CCOCC1	ZINC000853858184	CE	On-Demand	Mild	MTOR	46	35
C#C[C@H](NC(=O)Nc1ccc(OC)cc1)C1CCOCC1	ZINC000853858184	CE	On-Demand	Mild	EPHX2	19	40
C#C[C@@H](NC(=O)Nc1ccc(OC)cc1)C1CCOCC1	ZINC000853858185	CE	On-Demand	Mild	MTOR	46	35
C#C[C@@H](NC(=O)Nc1ccc(OC)cc1)C1CCOCC1	ZINC000853858185	CE	On-Demand	Mild	EPHX2	19	40
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858199	CE	On-Demand	Anodyne	CCR5	31	40
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858199	CE	On-Demand	Anodyne	MCHR1	20	41
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858199	CE	On-Demand	Anodyne	SFRP1	46	34
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858199	CE	On-Demand	Anodyne	WNT3	49	34
CN(c1ccccc1)[C@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858199	CE	On-Demand	Anodyne	L3MBTL3	54	39
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858201	CE	On-Demand	Anodyne	CCR5	31	40
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858201	CE	On-Demand	Anodyne	MCHR1	20	41
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858201	CE	On-Demand	Anodyne	SFRP1	46	34
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858201	CE	On-Demand	Anodyne	WNT3	49	34
CN(c1ccccc1)[C@@H]1CCN(C(=O)N2CCCC2)C1	ZINC000853858201	CE	On-Demand	Anodyne	L3MBTL3	54	39
CC[C@H](C)N(CC)C(=O)NCCc1ccc(Cl)nc1	ZINC000853858214	CG	On-Demand	Anodyne	NACHRBETA2	42	38
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	CA2	59	48
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	CA1	57	47
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	CA4	44	45
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	CA14	33	40
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	CA12	50	48
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	CA9	49	48
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	MTCA1	53	48
C#C[C@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858225	EC	On-Demand	Mild	P96878_MYCTU	67	48
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	CA2	59	48
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	CA1	57	47
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	CA4	44	45
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	CA14	33	40
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	CA12	50	48
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	CA9	49	48
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	MTCA1	53	48
C#C[C@@H](NC(=O)Nc1ccc(S(N)(=O)=O)cc1)C1CCOCC1	ZINC000853858229	EC	On-Demand	Mild	P96878_MYCTU	67	48
C#C[C@H](NC(=O)Nc1cnc(-c2ccccc2)nc1)C1CCOCC1	ZINC000853858230	EF	On-Demand	Mild	MTOR	49	38
COC(=O)CCCCCCCNC(=O)N1CC[C@H]1c1ccc(F)cc1	ZINC000853858259	FH	On-Demand	Anodyne	ADRA1A	47	37
COC(=O)CCCCCCCNC(=O)N1CC[C@H]1c1ccc(F)cc1	ZINC000853858259	FH	On-Demand	Anodyne	ASAH1	88	35
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853858260	FH	On-Demand	Anodyne	ADRA1A	47	37
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853858260	FH	On-Demand	Anodyne	ASAH1	88	35
C[C@H](NC(=O)Nc1cccnc1Cl)C1CCC(F)CC1	ZINC000853858262	CH	On-Demand	Anodyne	G2YM83_BOTF4	71	38
Cc1cc(C(=O)NCC2CCC(O)CC2)n2nc(C)cc2n1	ZINC000853858267	DD	On-Demand	Anodyne	CACNA1I	46	32
Cc1cc(N2CC[C@@]3(O)C[C@H]3C2)nc(N)n1	ZINC000853858270	BC	On-Demand	Anodyne	HRH4	42	39
COC(=O)c1ccc(CNC(=O)N2CCCCC2)c(F)c1	ZINC000853858293	CE	On-Demand	Anodyne	BDKRB1	29	46
COC(=O)c1ccc(CNC(=O)N2CCCCC2)c(F)c1	ZINC000853858293	CE	On-Demand	Anodyne	EPHX2	17	45
Cc1nsc(C(=O)N(CCN2CCOCC2)CC2CC2)n1	ZINC000853858294	DD	On-Demand	Anodyne	CASR	41	38
C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CCC(F)CC1	ZINC000853858311	FG	On-Demand	Anodyne	KCNQ2	77	44
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCc2ccccc2-n2ccnc21	ZINC000853858319	GH	On-Demand	Anodyne	EPHX2	18	47
COC(=O)CCCCCCCNC(=O)N[C@H]1CCc2ccccc2-n2ccnc21	ZINC000853858320	GH	On-Demand	Anodyne	EPHX2	18	47
COC(=O)CCCCCCCNC(=O)N1C[C@@H]2CCCC[C@@H]21	ZINC000853858323	DG	On-Demand	Anodyne	ASAH1	56	32
COC(=O)CCCCCCCNC(=O)N[C@H]1C[C@H](O)C1	ZINC000853858343	CD	On-Demand	Anodyne	EPHX2	41	70
CN1CCN(c2ccccc2NC(=O)NCC2CCC(O)CC2)CC1	ZINC000853858348	EE	On-Demand	Anodyne	HTR1A	40	40
CN1CCN(c2ccccc2NC(=O)NCC2CCC(O)CC2)CC1	ZINC000853858348	EE	On-Demand	Anodyne	HTR1D	21	40
CN1CCN(c2ccccc2NC(=O)NCC2CCC(O)CC2)CC1	ZINC000853858348	EE	On-Demand	Anodyne	HTR1B	25	40
CN1CCN(c2ccccc2NC(=O)NCC2CCC(O)CC2)CC1	ZINC000853858348	EE	On-Demand	Anodyne	DRD3	42	36
CN1CCN(c2ccccc2NC(=O)NCC2CCC(O)CC2)CC1	ZINC000853858348	EE	On-Demand	Anodyne	KCNQ2	79	41
CN1CCN(c2ccccc2NC(=O)NCC2CCC(O)CC2)CC1	ZINC000853858348	EE	On-Demand	Anodyne	CSF1R	17	46
C#C[C@@H](NC(=O)Nc1cnc(-c2ccccc2)nc1)C1CCOCC1	ZINC000853858353	EF	On-Demand	Mild	MTOR	49	38
C#C[C@H](NC(=O)Nc1ccc2c(c1)C(=O)NC2=O)C1CCOCC1	ZINC000853858368	ED	On-Demand	Mild	CASP2	16	41
C#C[C@@H](NC(=O)Nc1ccc2c(c1)C(=O)NC2=O)C1CCOCC1	ZINC000853858369	ED	On-Demand	Mild	CASP2	16	41
C#C[C@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858375	CE	On-Demand	Mild	MTNR1A	20	45
C#C[C@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858375	CE	On-Demand	Mild	MTNR1B	25	45
C#C[C@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858375	CE	On-Demand	Mild	EPHX2	22	46
C#C[C@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858375	CE	On-Demand	Mild	TAAR1	38	43
C#C[C@@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858376	CE	On-Demand	Mild	MTNR1A	20	45
C#C[C@@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858376	CE	On-Demand	Mild	MTNR1B	25	45
C#C[C@@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858376	CE	On-Demand	Mild	EPHX2	22	46
C#C[C@@H](NC(=O)Nc1cccc(OC)c1)C1CCOCC1	ZINC000853858376	CE	On-Demand	Mild	TAAR1	38	43
C#C[C@H](NC(=O)Nc1ccc(-c2cc(O)nc(C)n2)cc1)C1CCOCC1	ZINC000853858377	FF	On-Demand	Mild	MTOR	87	35
C#C[C@@H](NC(=O)Nc1ccc(-c2cc(O)nc(C)n2)cc1)C1CCOCC1	ZINC000853858378	FF	On-Demand	Mild	MTOR	87	35
Cc1nc(NC(=O)N2CC[C@H](N(C)C(=O)N(C)C)C2)sc1-c1ccccc1	ZINC000853858381	GG	On-Demand	Anodyne	PIK3CG	18	45
Cc1nc(NC(=O)N2CC[C@H](N(C)C(=O)N(C)C)C2)sc1-c1ccccc1	ZINC000853858381	GG	On-Demand	Anodyne	PI4KB	40	39
Cc1nc(NC(=O)N2CC[C@@H](N(C)C(=O)N(C)C)C2)sc1-c1ccccc1	ZINC000853858382	GG	On-Demand	Anodyne	PIK3CG	18	45
Cc1nc(NC(=O)N2CC[C@@H](N(C)C(=O)N(C)C)C2)sc1-c1ccccc1	ZINC000853858382	GG	On-Demand	Anodyne	PI4KB	40	39
CS(=O)(=O)C1CN(C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000853858387	DC	On-Demand	Anodyne	NACHRBETA2	40	34
Cc1nc(NC(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)sc1-c1ccccc1	ZINC000853858389	GH	On-Demand	Anodyne	PIK3CG	20	43
Cc1nc(NC(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)sc1-c1ccccc1	ZINC000853858390	GH	On-Demand	Anodyne	PIK3CG	20	43
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NNc2ccc(Cl)cn2)c1	ZINC000853858391	GE	On-Demand	Reactive	F10	21	41
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NNc2ccc(Cl)cn2)c1	ZINC000853858392	GE	On-Demand	Reactive	F10	21	41
O=C(NCCc1ccc(Cl)nc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853858394	GE	On-Demand	Anodyne	CCR3	20	42
O=C(NCCc1ccc(Cl)nc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853858394	GE	On-Demand	Anodyne	MCHR1	19	42
O=C(NCCc1ccc(Cl)nc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853858395	GE	On-Demand	Anodyne	CCR3	20	42
O=C(NCCc1ccc(Cl)nc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853858395	GE	On-Demand	Anodyne	MCHR1	19	42
C#C[C@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858396	EC	On-Demand	Mild	CA2	21	50
C#C[C@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858396	EC	On-Demand	Mild	CA4	18	48
C#C[C@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858396	EC	On-Demand	Mild	CA12	20	50
C#C[C@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858396	EC	On-Demand	Mild	CA9	19	50
C#C[C@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858396	EC	On-Demand	Mild	P96878_MYCTU	43	37
C#C[C@@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858397	EC	On-Demand	Mild	CA2	21	50
C#C[C@@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858397	EC	On-Demand	Mild	CA4	18	48
C#C[C@@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858397	EC	On-Demand	Mild	CA12	20	50
C#C[C@@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858397	EC	On-Demand	Mild	CA9	19	50
C#C[C@@H](NC(=O)Nc1cccc(S(N)(=O)=O)c1)C1CCOCC1	ZINC000853858397	EC	On-Demand	Mild	P96878_MYCTU	43	37
O=C(NCC1=CCCC1)Nc1ccc(Cl)nc1	ZINC000853858402	CF	On-Demand	Anodyne	NAMPT	36	46
COCc1cc([N+](=O)[O-])ccc1N1CCc2cc(OC)ccc2C1	ZINC000853858408	EG	On-Demand	Bother	CA14	17	45
C#C[C@H](NC(=O)Nc1ccc(C)cc1)C1CCOCC1	ZINC000853858421	CF	On-Demand	Mild	PIK3CA	21	40
C#C[C@H](NC(=O)Nc1ccc(C)cc1)C1CCOCC1	ZINC000853858421	CF	On-Demand	Mild	MTOR	49	40
C#C[C@@H](NC(=O)Nc1ccc(C)cc1)C1CCOCC1	ZINC000853858422	CF	On-Demand	Mild	PIK3CA	21	40
C#C[C@@H](NC(=O)Nc1ccc(C)cc1)C1CCOCC1	ZINC000853858422	CF	On-Demand	Mild	MTOR	49	40
C#C[C@H](NC(=O)Nc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000853858442	EE	On-Demand	Mild	PIK3CA	17	44
C#C[C@H](NC(=O)Nc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000853858442	EE	On-Demand	Mild	MTOR	37	44
C#C[C@H](NC(=O)Nc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000853858442	EE	On-Demand	Mild	DGAT1	43	42
C#C[C@@H](NC(=O)Nc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000853858443	EE	On-Demand	Mild	PIK3CA	17	44
C#C[C@@H](NC(=O)Nc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000853858443	EE	On-Demand	Mild	MTOR	37	44
C#C[C@@H](NC(=O)Nc1ccc(N2CCCC2)nc1)C1CCOCC1	ZINC000853858443	EE	On-Demand	Mild	DGAT1	43	42
C#C[C@H](NC(=O)Nc1cccc(Cl)c1)C1CCOCC1	ZINC000853858453	CF	On-Demand	Mild	EPHX2	15	47
C#C[C@@H](NC(=O)Nc1cccc(Cl)c1)C1CCOCC1	ZINC000853858454	CF	On-Demand	Mild	EPHX2	15	47
C[C@H]1CN(c2ccc(NC(=O)NNc3ccc(Cl)cn3)cc2F)C[C@H](C)O1	ZINC000853858456	GH	On-Demand	Reactive	NPY2R	57	33
Ic1cnnn1C1CCN(c2nc3ccccc3[nH]2)CC1	ZINC000853858511	GF	On-Demand	Anodyne	KCNN3	19	43
Cc1nc(NC(=O)N2CCC3(CCCC3=O)CC2)sc1-c1ccccc1	ZINC000853858524	FI	On-Demand	Anodyne	NPY5R	36	44
Cc1nc(NC(=O)N2CCC3(CCCC3=O)CC2)sc1-c1ccccc1	ZINC000853858524	FI	On-Demand	Anodyne	PIK3CG	19	49
O=C(NCC1CCC(O)CC1)Nc1cccnc1Cl	ZINC000853858561	CE	On-Demand	Anodyne	G2YM83_BOTF4	71	38
COC(=O)c1ccc(CNC(=O)C(F)(F)C(=O)N2CCOCC2)c(F)c1	ZINC000853858581	FC	On-Demand	Anodyne	BDKRB1	27	44
C#CCNC(=O)c1ccc(N2CC[C@@]3(O)C[C@H]3C2)nc1	ZINC000853858585	CC	On-Demand	Mild	HDAC1	17	41
O=C(NCC1CCC(O)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853858587	EE	On-Demand	Bother	CACNA1D	61	37
COC(=O)[C@@H]1CCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H]1C	ZINC000853858616	FE	On-Demand	Anodyne	HTR1A	17	44
COC(=O)[C@@H]1CCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H]1C	ZINC000853858616	FE	On-Demand	Anodyne	HTR1B	17	44
COC(=O)[C@@H]1CCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H]1C	ZINC000853858616	FE	On-Demand	Anodyne	KCNQ2	70	38
COC(=O)[C@@H]1CCN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@H]1C	ZINC000853858616	FE	On-Demand	Anodyne	RBP4	33	40
C[C@H]1CN(c2ccc(NC(=O)NNc3ccc(Cl)cn3)cc2F)C[C@@H](C)O1	ZINC000853858630	GH	On-Demand	Reactive	NPY2R	57	33
C#C[C@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858635	EE	On-Demand	Mild	CHRM2	15	42
C#C[C@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858635	EE	On-Demand	Mild	CHRM3	17	42
C#C[C@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858635	EE	On-Demand	Mild	MTOR	44	33
C#C[C@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858635	EE	On-Demand	Mild	ACR	40	32
C#C[C@@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858637	EE	On-Demand	Mild	CHRM2	15	42
C#C[C@@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858637	EE	On-Demand	Mild	CHRM3	17	42
C#C[C@@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858637	EE	On-Demand	Mild	MTOR	44	33
C#C[C@@H](NC(=O)Nc1ccc(C(=O)OCC)cc1)C1CCOCC1	ZINC000853858637	EE	On-Demand	Mild	ACR	40	32
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853858666	FE	On-Demand	Anodyne	L3MBTL3	77	38
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853858667	FE	On-Demand	Anodyne	L3MBTL3	77	38
C#C[C@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)C1CCOCC1	ZINC000853858669	GH	On-Demand	Mild	SCD1	34	44
C#C[C@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)C1CCOCC1	ZINC000853858669	GH	On-Demand	Mild	SCD	30	44
C#C[C@@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)C1CCOCC1	ZINC000853858670	GH	On-Demand	Mild	SCD1	34	44
C#C[C@@H](NC(=O)Nc1ncc(Cc2cccc(Cl)c2)s1)C1CCOCC1	ZINC000853858670	GH	On-Demand	Mild	SCD	30	44
C#C[C@@H](NC(=O)Nc1cccnc1Cl)C1CCOCC1	ZINC000853858686	CE	On-Demand	Mild	G2YM83_BOTF4	67	35
C#C[C@H](NC(=O)Nc1cccnc1Cl)C1CCOCC1	ZINC000853858687	CE	On-Demand	Mild	G2YM83_BOTF4	67	35
CON(C)CCNC(=O)NCCc1ccc(Cl)nc1	ZINC000853858704	CD	On-Demand	Anodyne	NACHRBETA2	33	41
O=C(NNc1ccc(Cl)cn1)Nc1ccc(N2CCCC2)nc1	ZINC000853858711	EF	On-Demand	Reactive	F10	26	40
O=C(NNc1ccc(Cl)cn1)Nc1ccc(N2CCCC2)nc1	ZINC000853858711	EF	On-Demand	Reactive	DGAT1	34	42
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(C)(F)F)C1	ZINC000853858713	CE	On-Demand	Anodyne	RBP4	58	43
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(C)(F)F)C1	ZINC000853858713	CE	On-Demand	Anodyne	SFRP1	117	39
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(C)(F)F)C1	ZINC000853858713	CE	On-Demand	Anodyne	WNT3	82	39
CN(c1ccccc1)[C@H]1CCN(C(=O)C(C)(F)F)C1	ZINC000853858714	CE	On-Demand	Anodyne	RBP4	58	43
CN(c1ccccc1)[C@H]1CCN(C(=O)C(C)(F)F)C1	ZINC000853858714	CE	On-Demand	Anodyne	SFRP1	117	39
CN(c1ccccc1)[C@H]1CCN(C(=O)C(C)(F)F)C1	ZINC000853858714	CE	On-Demand	Anodyne	WNT3	82	39
CN1CCN(c2ccccc2NC(=O)NNc2ccc(Cl)cn2)CC1	ZINC000853858715	FF	On-Demand	Reactive	DRD1	55	39
CN1CCN(c2ccccc2NC(=O)NNc2ccc(Cl)cn2)CC1	ZINC000853858715	FF	On-Demand	Reactive	F10	40	55
CN1CCN(c2ccccc2NC(=O)NNc2ccc(Cl)cn2)CC1	ZINC000853858715	FF	On-Demand	Reactive	KCNQ2	75	43
CN1CCN(c2ccccc2NC(=O)NNc2ccc(Cl)cn2)CC1	ZINC000853858715	FF	On-Demand	Reactive	CSF1R	16	42
CN(c1ccccc1)[C@H]1CCN(C(=O)C(=O)OC(C)(C)C)C1	ZINC000853858723	DE	On-Demand	Anodyne	GPR119	22	40
CN(c1ccccc1)[C@H]1CCN(C(=O)C(=O)OC(C)(C)C)C1	ZINC000853858723	DE	On-Demand	Anodyne	SFRP1	80	37
CN(c1ccccc1)[C@H]1CCN(C(=O)C(=O)OC(C)(C)C)C1	ZINC000853858723	DE	On-Demand	Anodyne	WNT3	55	35
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)OC(C)(C)C)C1	ZINC000853858724	DE	On-Demand	Anodyne	GPR119	22	40
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)OC(C)(C)C)C1	ZINC000853858724	DE	On-Demand	Anodyne	SFRP1	80	37
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(=O)OC(C)(C)C)C1	ZINC000853858724	DE	On-Demand	Anodyne	WNT3	55	35
C#C[C@H](NC(=O)Nc1ccc(F)cc1)C1CCOCC1	ZINC000853858725	CE	On-Demand	Mild	EPHX2	17	44
C#C[C@@H](NC(=O)Nc1ccc(F)cc1)C1CCOCC1	ZINC000853858726	CE	On-Demand	Mild	EPHX2	17	44
CN1CCN(C(=O)NCCc2ccc(Cl)nc2)CCC1=O	ZINC000853858735	DD	On-Demand	Anodyne	NACHRBETA2	44	33
O=C(NNc1ccc(Cl)cn1)Nc1nc2c(s1)CCCC2	ZINC000853858745	DG	On-Demand	Reactive	SLC27A1	34	41
COC(=O)/C=C\c1ccc(N2CCc3cc(OC)ccc3C2)c([N+](=O)[O-])c1	ZINC000853858748	FG	On-Demand	Clean	TAAR1	20	43
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccc(CS(C)(=O)=O)cc2)cc1OC	ZINC000853858849	JF	On-Demand	Anodyne	TMPRSS11D	59	34
COC(=O)c1ccc(CNC(=O)C(=O)OC(C)(C)C)c(F)c1	ZINC000853858858	DD	On-Demand	Anodyne	BDKRB1	27	44
CN(c1ccccc1)[C@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C1	ZINC000853858869	EG	On-Demand	Anodyne	RBP4	47	33
CN(c1ccccc1)[C@@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C1	ZINC000853858871	EG	On-Demand	Anodyne	RBP4	47	33
C#C[C@H](NC(=O)Nc1ccc(Cl)c(Cl)c1)C1CCOCC1	ZINC000853858872	EH	On-Demand	Mild	NR2E3	61	35
C#C[C@@H](NC(=O)Nc1ccc(Cl)c(Cl)c1)C1CCOCC1	ZINC000853858874	EH	On-Demand	Mild	NR2E3	61	35
Cc1nc(NC(=O)NCC2CCC(O)CC2)sc1-c1ccccc1	ZINC000853858879	EH	On-Demand	Anodyne	PIK3CG	22	44
Cc1nc(NC(=O)NCC2CCC(O)CC2)sc1-c1ccccc1	ZINC000853858879	EH	On-Demand	Anodyne	PI4KB	42	43
Cc1nc(NC(=O)NCC2CCC(O)CC2)sc1-c1ccccc1	ZINC000853858879	EH	On-Demand	Anodyne	VCP	46	38
COC[C@H](NC(=O)NCCc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853858894	FF	On-Demand	Anodyne	MTNR1A	48	38
COC[C@H](NC(=O)NCCc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853858894	FF	On-Demand	Anodyne	MTNR1B	43	38
COC[C@@H](NC(=O)NCCc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853858896	FF	On-Demand	Anodyne	MTNR1A	48	38
COC[C@@H](NC(=O)NCCc1ccc(Cl)nc1)c1cccc(OC)c1	ZINC000853858896	FF	On-Demand	Anodyne	MTNR1B	43	38
COC(=O)CCCCCCCNC(=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853858930	EE	On-Demand	Anodyne	EPHX2	15	41
COC(=O)CCCCCCCNC(=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853858936	EE	On-Demand	Anodyne	EPHX2	15	41
C#C[C@H](NC(=O)Nc1cccc(C(=O)OC)c1)C1CCOCC1	ZINC000853858941	DE	On-Demand	Mild	EPHX2	19	47
C#C[C@H](NC(=O)Nc1cccc(C(=O)OC)c1)C1CCOCC1	ZINC000853858941	DE	On-Demand	Mild	KCNK3	68	34
C#C[C@H](NC(=O)Nc1cccc(C(=O)OC)c1)C1CCOCC1	ZINC000853858941	DE	On-Demand	Mild	KCNK9	46	32
C#C[C@@H](NC(=O)Nc1cccc(C(=O)OC)c1)C1CCOCC1	ZINC000853858943	DE	On-Demand	Mild	EPHX2	19	47
C#C[C@@H](NC(=O)Nc1cccc(C(=O)OC)c1)C1CCOCC1	ZINC000853858943	DE	On-Demand	Mild	KCNK3	68	34
C#C[C@@H](NC(=O)Nc1cccc(C(=O)OC)c1)C1CCOCC1	ZINC000853858943	DE	On-Demand	Mild	KCNK9	46	32
C[C@H]1CN(c2ccc(NC(=O)NCC3=CCCC3)cc2F)C[C@H](C)O1	ZINC000853858952	EH	On-Demand	Anodyne	NPY2R	60	35
COC(=O)CCCCCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853858953	FF	On-Demand	Anodyne	CPT1A	49	34
C[C@H]1CN(c2ccc(NC(=O)NCC3=CCCC3)cc2F)C[C@@H](C)O1	ZINC000853858954	EH	On-Demand	Anodyne	NPY2R	60	35
C#C[C@H](NC(=O)Nc1ccc(Cl)cc1)C1CCOCC1	ZINC000853858957	CF	On-Demand	Mild	MTOR	26	40
C#C[C@@H](NC(=O)Nc1ccc(Cl)cc1)C1CCOCC1	ZINC000853858958	CF	On-Demand	Mild	MTOR	26	40
COC(=O)CCCCCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853858960	FF	On-Demand	Anodyne	CPT1A	49	34
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)CC1	ZINC000853858978	GE	On-Demand	Anodyne	KCNQ2	74	39
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)CC1	ZINC000853858980	GE	On-Demand	Anodyne	KCNQ2	74	39
COC(=O)CCCCCCCNC(=O)NC1CC(C)(C)C1	ZINC000853858989	CF	On-Demand	Anodyne	EPHX2	43	68
COC(=O)CCCCCCCNC(=O)N[C@@]1(C)CC1(C)C	ZINC000853858998	CF	On-Demand	Anodyne	EPHX2	37	62
COC(=O)CCCCCCCNC(=O)N[C@]1(C)CC1(C)C	ZINC000853858999	CF	On-Demand	Anodyne	EPHX2	37	62
CN1CCN(c2ccccc2NC(=O)NCC2=CCCC2)CC1	ZINC000853859007	DF	On-Demand	Anodyne	KCNQ2	82	45
CCN1CC[C@H](N(CC)C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000853859009	DE	On-Demand	Anodyne	CCR5	24	42
CCN1CC[C@@H](N(CC)C(=O)NCCc2ccc(Cl)nc2)C1	ZINC000853859012	DE	On-Demand	Anodyne	CCR5	24	42
COC(=O)c1ccc(CNC(=O)C(C)(F)F)c(F)c1	ZINC000853859029	CD	On-Demand	Anodyne	BDKRB1	29	52
O=C(NNc1ccc(Cl)cn1)Nc1cccnc1N1CCCC1	ZINC000853859036	EF	On-Demand	Reactive	F10	33	45
O=C(NNc1ccc(Cl)cn1)Nc1cccnc1N1CCCC1	ZINC000853859036	EF	On-Demand	Reactive	KCNQ2	43	37
O=C(NNc1ccc(Cl)cn1)Nc1cccnc1N1CCCC1	ZINC000853859036	EF	On-Demand	Reactive	SCN2A	17	41
O=C(NNc1ccc(Cl)cn1)Nc1cccnc1N1CCCC1	ZINC000853859036	EF	On-Demand	Reactive	SCN10A	15	41
O=C(NNc1ccc(Cl)cn1)Nc1cccnc1N1CCCC1	ZINC000853859036	EF	On-Demand	Reactive	G2YM83_BOTF4	45	32
C[C@H]1CN(c2ccc(NC(=O)NCC3CCC(O)CC3)cc2F)C[C@H](C)O1	ZINC000853859041	GG	On-Demand	Anodyne	NPY2R	69	38
C[C@H]1CN(c2ccc(NC(=O)NCC3CCC(O)CC3)cc2F)C[C@@H](C)O1	ZINC000853859043	GG	On-Demand	Anodyne	NPY2R	69	38
O=C(NCCc1ccc(O)nc1)Nc1ccc2c(c1)OCCO2	ZINC000853859119	DD	On-Demand	Anodyne	QPCT	18	42
O=C(NCCc1ccc(O)nc1)Nc1ccc2c(c1)OCCO2	ZINC000853859119	DD	On-Demand	Anodyne	PRMT3	61	34
O=C(NCC1=CCCC1)Nc1cccnc1Cl	ZINC000853859160	CF	On-Demand	Anodyne	G2YM83_BOTF4	73	37
CC(C)(C)N1C[C@@H](CNC(=O)c2nc(Br)cs2)CC1=O	ZINC000853859169	FE	On-Demand	Anodyne	CACNA1I	48	34
CC(C)(C)N1C[C@H](CNC(=O)c2nc(Br)cs2)CC1=O	ZINC000853859170	FE	On-Demand	Anodyne	CACNA1I	48	34
C#C[C@H](NC(=O)Nc1nccs1)C1CCOCC1	ZINC000853859187	CD	On-Demand	Mild	MAP1	99	39
C#C[C@H](NC(=O)Nc1nccs1)C1CCOCC1	ZINC000853859187	CD	On-Demand	Mild	GCK	16	46
C#C[C@@H](NC(=O)Nc1nccs1)C1CCOCC1	ZINC000853859188	CD	On-Demand	Mild	MAP1	99	39
C#C[C@@H](NC(=O)Nc1nccs1)C1CCOCC1	ZINC000853859188	CD	On-Demand	Mild	GCK	16	46
C#C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CCOCC1	ZINC000853859208	FD	On-Demand	Mild	KCNQ2	80	43
C#C[C@@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)C1CCOCC1	ZINC000853859209	FD	On-Demand	Mild	KCNQ2	80	43
CN(c1ccccc1)[C@H]1CCN(C(=O)c2nccn2C)C1	ZINC000853859222	CD	On-Demand	Anodyne	CCR5	18	40
CN(c1ccccc1)[C@@H]1CCN(C(=O)c2nccn2C)C1	ZINC000853859223	CD	On-Demand	Anodyne	CCR5	18	40
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@@H](C)n2ncnc21	ZINC000853859226	EE	On-Demand	Anodyne	EPHX2	21	51
C#C[C@H](NC(=O)Nc1ccc(C#N)cc1)C1CCOCC1	ZINC000853859227	CE	On-Demand	Mild	DHODH	16	43
COC(=O)CCCCCCCNC(=O)N[C@H]1C[C@@H](C)n2ncnc21	ZINC000853859228	EE	On-Demand	Anodyne	EPHX2	21	51
C#C[C@@H](NC(=O)Nc1ccc(C#N)cc1)C1CCOCC1	ZINC000853859229	CE	On-Demand	Mild	DHODH	16	43
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@H](C)n2ncnc21	ZINC000853859230	EE	On-Demand	Anodyne	EPHX2	21	51
COC(=O)CCCCCCCNC(=O)N[C@H]1C[C@H](C)n2ncnc21	ZINC000853859232	EE	On-Demand	Anodyne	EPHX2	21	51
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853859239	GH	On-Demand	Anodyne	GPBAR1	21	45
O=C(NCCc1ccc(Cl)nc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853859242	GH	On-Demand	Anodyne	GPBAR1	21	45
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	CA2	48	60
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	CASR	62	50
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	CA1	43	60
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	CA7	22	45
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	CA4	38	41
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	EPHX2	23	46
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	CA12	34	54
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	CA9	38	60
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	MTCA1	43	39
NS(=O)(=O)c1ccc(NC(=O)N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853859245	GC	On-Demand	Anodyne	P96878_MYCTU	55	39
COC(=O)CCCCCCCNC(=O)N1CC2CC1(C)C2	ZINC000853859248	CF	On-Demand	Anodyne	EPHX2	27	52
CC(C)(C)N1C[C@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853859260	FI	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)N1C[C@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853859260	FI	On-Demand	Anodyne	NAMPT	15	41
CC(C)(C)N1C[C@@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853859262	FI	On-Demand	Anodyne	EPHX2	15	42
CC(C)(C)N1C[C@@H](CNC(=O)Nc2ccc(-c3ccccc3)cc2)CC1=O	ZINC000853859262	FI	On-Demand	Anodyne	NAMPT	15	41
COC(=O)CCCCCCCNC(=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853859296	DF	On-Demand	Anodyne	EPHX2	33	54
COCCN(CCF)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000853859302	DE	On-Demand	Anodyne	HTR1A	18	47
COCCN(CCF)C(=O)N[C@@H]1CCc2c(OC)cccc21	ZINC000853859302	DE	On-Demand	Anodyne	ACKR3	45	31
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2NC(=O)CC[C@@H]2C1	ZINC000853859307	FD	On-Demand	Anodyne	ASAH1	51	33
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2NC(=O)CC[C@H]2C1	ZINC000853859308	FD	On-Demand	Anodyne	ASAH1	51	33
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2NC(=O)CC[C@@H]2C1	ZINC000853859309	FD	On-Demand	Anodyne	ASAH1	51	33
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2NC(=O)CC[C@H]2C1	ZINC000853859310	FD	On-Demand	Anodyne	ASAH1	51	33
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2C[C@H]2C1	ZINC000853859322	CF	On-Demand	Anodyne	EPHX2	23	45
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2C[C@H]2C1	ZINC000853859322	CF	On-Demand	Anodyne	ASAH1	63	34
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853859323	CF	On-Demand	Anodyne	EPHX2	23	45
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853859323	CF	On-Demand	Anodyne	ASAH1	63	34
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853859324	CF	On-Demand	Anodyne	EPHX2	23	45
COC(=O)CCCCCCCNC(=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853859324	CF	On-Demand	Anodyne	ASAH1	63	34
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853859325	CF	On-Demand	Anodyne	EPHX2	23	45
COC(=O)CCCCCCCNC(=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853859325	CF	On-Demand	Anodyne	ASAH1	63	34
COC(=O)CCCCCCCNC(=O)N1CCC(C2CCC2)CC1	ZINC000853859337	EH	On-Demand	Anodyne	EPHX2	16	51
COC(=O)CCCCCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853859341	DD	On-Demand	Anodyne	EPHX2	15	45
O=[N+]([O-])c1ccc(N2CC[C@@]3(O)C[C@H]3C2)c2nonc12	ZINC000853859351	CD	On-Demand	Bother	GSTM2	116	40
O=[N+]([O-])c1ccc(N2CC[C@@]3(O)C[C@H]3C2)c2nonc12	ZINC000853859351	CD	On-Demand	Bother	GSTP1	70	40
O=C(NCCCSc1nccs1)N(CCN1CCOCC1)CC1CC1	ZINC000853859386	GE	On-Demand	Clean	CASR	46	45
O=C(NCCc1ccc(O)nc1)Nc1cccnc1N1CCCC1	ZINC000853859410	EE	On-Demand	Anodyne	KCNQ2	42	33
CC(C)(C)N1C[C@H](CNC(=O)Nc2cccnc2Cl)CC1=O	ZINC000853859427	DF	On-Demand	Anodyne	G2YM83_BOTF4	68	37
CC(C)(C)N1C[C@@H](CNC(=O)Nc2cccnc2Cl)CC1=O	ZINC000853859429	DF	On-Demand	Anodyne	G2YM83_BOTF4	68	37
Cn1ccnc1C(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853859477	CC	On-Demand	Anodyne	CACNA1I	50	34
Cn1ccnc1C(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853859479	CC	On-Demand	Anodyne	CACNA1I	50	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](N(C)c3ccccc3)C2)CC1	ZINC000853859483	GG	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](N(C)c3ccccc3)C2)CC1	ZINC000853859483	GG	On-Demand	Anodyne	RBP4	56	38
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](N(C)c3ccccc3)C2)CC1	ZINC000853859484	GG	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](N(C)c3ccccc3)C2)CC1	ZINC000853859484	GG	On-Demand	Anodyne	RBP4	56	38
C#C[C@H](NC(=O)Nc1ccc(C(C)=O)cc1)C1CCOCC1	ZINC000853859485	DE	On-Demand	Mild	MTOR	42	36
C#C[C@@H](NC(=O)Nc1ccc(C(C)=O)cc1)C1CCOCC1	ZINC000853859486	DE	On-Demand	Mild	MTOR	42	36
O=C(NCCc1ccc(Cl)nc1)N(CCN1CCOCC1)CC1CC1	ZINC000853859494	FE	On-Demand	Anodyne	CASR	51	38
C#C[C@@H](NC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)C1CCOCC1	ZINC000853859499	FH	On-Demand	Mild	MTOR	64	36
C#C[C@H](NC(=O)Nc1ccc(-c2nc(C)c(C)o2)cc1)C1CCOCC1	ZINC000853859500	FH	On-Demand	Mild	MTOR	64	36
C#C[C@H](NC(=O)Nc1cccc2cccnc12)C1CCOCC1	ZINC000853859505	DF	On-Demand	Mild	WNT3	18	44
C#C[C@@H](NC(=O)Nc1cccc2cccnc12)C1CCOCC1	ZINC000853859506	DF	On-Demand	Mild	WNT3	18	44
C#C[C@@H](NC(=O)Nc1cccnc1)C1CCOCC1	ZINC000853859508	CD	On-Demand	Mild	MTOR	23	44
C#C[C@@H](NC(=O)Nc1cccnc1)C1CCOCC1	ZINC000853859508	CD	On-Demand	Mild	NAMPT	37	41
C#C[C@H](NC(=O)Nc1cccnc1)C1CCOCC1	ZINC000853859509	CD	On-Demand	Mild	MTOR	23	44
C#C[C@H](NC(=O)Nc1cccnc1)C1CCOCC1	ZINC000853859509	CD	On-Demand	Mild	NAMPT	37	41
C#C[C@H](NC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1)C1CCOCC1	ZINC000853859511	GF	On-Demand	Mild	NPY2R	51	42
C#C[C@H](NC(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1)C1CCOCC1	ZINC000853859512	GF	On-Demand	Mild	NPY2R	51	42
C#C[C@H](NC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCOCC1	ZINC000853859513	GF	On-Demand	Mild	NPY2R	51	42
C#C[C@@H](NC(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1)C1CCOCC1	ZINC000853859514	GF	On-Demand	Mild	NPY2R	51	42
C#CCNC(=O)c1ccc(N2CCc3cc(OC)ccc3C2)nc1	ZINC000853859522	DE	On-Demand	Mild	DRD4	45	35
O=C(NCCc1ccc(Cl)nc1)N[C@H]1C[C@H](O)C1	ZINC000853859544	CD	On-Demand	Anodyne	NACHRBETA2	40	34
Cc1nc(C(=O)N[C@H](c2ccccc2)[C@H](O)C(C)C)no1	ZINC000853859555	CD	On-Demand	Anodyne	TACR3	19	40
Cc1nc(C(=O)N[C@H](c2ccccc2)[C@@H](O)C(C)C)no1	ZINC000853859556	CD	On-Demand	Anodyne	TACR3	19	40
Cc1nc(C(=O)N[C@@H](c2ccccc2)[C@H](O)C(C)C)no1	ZINC000853859557	CD	On-Demand	Anodyne	TACR3	19	40
Cc1nc(C(=O)N[C@@H](c2ccccc2)[C@@H](O)C(C)C)no1	ZINC000853859558	CD	On-Demand	Anodyne	TACR3	19	40
O=C(NCC1CCC(O)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853859559	DI	On-Demand	Anodyne	CA1	31	44
O=C(NCC1CCC(O)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853859559	DI	On-Demand	Anodyne	CCR3	19	41
O=C(NCC1CCC(O)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853859559	DI	On-Demand	Anodyne	ROCK2	18	54
O=C(NCC1CCC(O)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853859559	DI	On-Demand	Anodyne	EPHX2	29	50
O=C(NCC1CCC(O)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853859559	DI	On-Demand	Anodyne	DGAT1	36	43
O=C(NCC1CCC(O)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853859559	DI	On-Demand	Anodyne	VCP	51	37
O=C(NCC1CCC(O)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853859559	DI	On-Demand	Anodyne	NAMPT	22	44
COC(=O)[C@@H]1CCN(C(=O)Nc2nc(C)c(-c3ccccc3)s2)C[C@@H]1C	ZINC000853859584	FH	On-Demand	Anodyne	PIK3CG	17	43
O=C(Nc1ccc(N2CCOCC2)cn1)N(CCN1CCOCC1)CC1CC1	ZINC000853859591	GD	On-Demand	Anodyne	CASR	62	49
O=C(Nc1ccc(N2CCOCC2)cn1)N(CCN1CCOCC1)CC1CC1	ZINC000853859591	GD	On-Demand	Anodyne	STAT6	60	34
COC(=O)CCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(=O)C2	ZINC000853859611	DE	On-Demand	Anodyne	ASAH1	70	33
COC(=O)[C@@H]1CCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000853859622	FE	On-Demand	Bother	CACNA1C	57	39
COC(=O)[C@@H]1CCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C[C@@H]1C	ZINC000853859622	FE	On-Demand	Bother	CACNA1D	87	36
COC(=O)CCCCCCCNC(=O)NC1CCC2(CC1)CC2(F)F	ZINC000853859628	FH	On-Demand	Anodyne	EPHX2	33	67
Nc1nc(Cl)cc(N2CC[C@@]3(O)C[C@H]3C2)n1	ZINC000853859629	BC	On-Demand	Anodyne	HRH4	45	36
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](N(C)C(=O)N(C)C)C2)CC1	ZINC000853859631	GD	On-Demand	Anodyne	KCNQ2	71	39
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](N(C)C(=O)N(C)C)C2)CC1	ZINC000853859632	GD	On-Demand	Anodyne	KCNQ2	71	39
O=C(NC[C@]1(CO)COCCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853859633	GE	On-Demand	Anodyne	NAMPT	36	43
O=C(NC[C@@]1(CO)COCCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853859634	GE	On-Demand	Anodyne	NAMPT	36	43
O=C(Nc1ccc(Cl)nc1)N(CCN1CCOCC1)CC1CC1	ZINC000853859640	EE	On-Demand	Anodyne	CASR	61	50
O=C(Nc1ccc(Cl)nc1)N(CCN1CCOCC1)CC1CC1	ZINC000853859640	EE	On-Demand	Anodyne	EPHX2	22	40
C#C[C@H](NC(=O)Nc1cccnc1N1CCCC1)C1CCOCC1	ZINC000853859670	EE	On-Demand	Mild	KCNQ2	46	33
C#C[C@@H](NC(=O)Nc1cccnc1N1CCCC1)C1CCOCC1	ZINC000853859672	EE	On-Demand	Mild	KCNQ2	46	33
CN1CCN(c2ccccc2NC(=O)N2CCC3(CCCC3=O)CC2)CC1	ZINC000853859700	FF	On-Demand	Anodyne	HTR1B	16	44
CN1CCN(c2ccccc2NC(=O)N2CCC3(CCCC3=O)CC2)CC1	ZINC000853859700	FF	On-Demand	Anodyne	KCNQ2	76	40
CN1CCN(c2ccccc2NC(=O)N2CCC3(CCCC3=O)CC2)CC1	ZINC000853859700	FF	On-Demand	Anodyne	NPY5R	36	41
CN(c1ccccc1)[C@H]1CCN(C(=O)C(F)(F)C(=O)N2CCOCC2)C1	ZINC000853859742	FD	On-Demand	Anodyne	ITGAL	50	37
CN(c1ccccc1)[C@H]1CCN(C(=O)C(F)(F)C(=O)N2CCOCC2)C1	ZINC000853859742	FD	On-Demand	Anodyne	SFRP1	44	37
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(F)(F)C(=O)N2CCOCC2)C1	ZINC000853859743	FD	On-Demand	Anodyne	ITGAL	50	37
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(F)(F)C(=O)N2CCOCC2)C1	ZINC000853859743	FD	On-Demand	Anodyne	SFRP1	44	37
COC(=O)c1cccc(N2CCc3cc(OC)ccc3C2)n1	ZINC000853859745	CE	On-Demand	Anodyne	DRD4	41	31
COC(=O)c1cccc(N2CCc3cc(OC)ccc3C2)n1	ZINC000853859745	CE	On-Demand	Anodyne	DRD5	19	41
COC(=O)c1cccc(N2CCc3cc(OC)ccc3C2)n1	ZINC000853859745	CE	On-Demand	Anodyne	AKR1C3	20	46
O=C(NCCCSc1nccs1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853859755	FG	On-Demand	Clean	CCR3	21	41
O=C(NCCCSc1nccs1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853859756	FG	On-Demand	Clean	CCR3	21	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1ccc(Cl)nc1	ZINC000853859758	GG	On-Demand	Anodyne	GPR119	38	44
O=C(NCCCSc1nccs1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853859836	FG	On-Demand	Clean	EPHX2	19	41
COC(=O)CCCCCCCNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853859872	EF	On-Demand	Anodyne	EPHX2	32	52
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853859873	EF	On-Demand	Anodyne	EPHX2	32	52
COC(=O)CCCCCCCNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853859874	EF	On-Demand	Anodyne	EPHX2	32	52
COC(=O)CCCCCCCNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853859875	EF	On-Demand	Anodyne	EPHX2	32	52
COC(=O)CCCCCCCNC(=O)N1CCNC(=O)[C@@H]1c1cccc(C)c1	ZINC000853859879	GF	On-Demand	Anodyne	ADRA1D	20	44
COC(=O)CCCCCCCNC(=O)N1CCNC(=O)[C@@H]1c1cccc(C)c1	ZINC000853859879	GF	On-Demand	Anodyne	ADRA1B	22	44
COC(=O)CCCCCCCNC(=O)N1CCNC(=O)[C@H]1c1cccc(C)c1	ZINC000853859880	GF	On-Demand	Anodyne	ADRA1D	20	44
COC(=O)CCCCCCCNC(=O)N1CCNC(=O)[C@H]1c1cccc(C)c1	ZINC000853859880	GF	On-Demand	Anodyne	ADRA1B	22	44
O=C(NC[C@]1(CO)COCCN1Cc1ccccc1)Nc1cccnc1Cl	ZINC000853859908	GE	On-Demand	Anodyne	G2YM83_BOTF4	66	33
O=C(NC[C@@]1(CO)COCCN1Cc1ccccc1)Nc1cccnc1Cl	ZINC000853859909	GE	On-Demand	Anodyne	G2YM83_BOTF4	66	33
COC(=O)CCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(C)C2	ZINC000853859913	DG	On-Demand	Anodyne	EPHX2	19	47
COC(=O)CCCCCCCNC(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853859914	EG	On-Demand	Anodyne	EPHX2	26	51
COC(=O)CCCCCCCNC(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853859915	EG	On-Demand	Anodyne	EPHX2	26	51
COC(=O)c1sc(N2CC[C@@]3(O)C[C@H]3C2)nc1Cl	ZINC000853859953	CD	On-Demand	Anodyne	PARE	69	33
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853859968	GE	On-Demand	Anodyne	HTR1A	27	40
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853859968	GE	On-Demand	Anodyne	DRD2	25	40
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853859968	GE	On-Demand	Anodyne	DRD3	41	38
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853859968	GE	On-Demand	Anodyne	PYGL	35	48
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853859968	GE	On-Demand	Anodyne	PYGM	30	48
COC(=O)CCCCCCCNC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853859968	GE	On-Demand	Anodyne	EPHX2	26	46
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853859969	GE	On-Demand	Anodyne	HTR1A	27	40
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853859969	GE	On-Demand	Anodyne	DRD2	25	40
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853859969	GE	On-Demand	Anodyne	DRD3	41	38
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853859969	GE	On-Demand	Anodyne	PYGL	35	48
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853859969	GE	On-Demand	Anodyne	PYGM	30	48
COC(=O)CCCCCCCNC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853859969	GE	On-Demand	Anodyne	EPHX2	26	46
Cc1nc(NC(=O)N2CC[C@@H]3COC[C@@H]3C2)sc1-c1ccccc1	ZINC000853859981	EH	On-Demand	Anodyne	PIK3CA	15	45
Cc1nc(NC(=O)N2CC[C@@H]3COC[C@@H]3C2)sc1-c1ccccc1	ZINC000853859981	EH	On-Demand	Anodyne	PIK3CG	25	45
Cc1nc(NC(=O)N2CC[C@H]3COC[C@@H]3C2)sc1-c1ccccc1	ZINC000853859982	EH	On-Demand	Anodyne	PIK3CA	15	45
Cc1nc(NC(=O)N2CC[C@H]3COC[C@@H]3C2)sc1-c1ccccc1	ZINC000853859982	EH	On-Demand	Anodyne	PIK3CG	25	45
Cc1nc(NC(=O)N2CC[C@@H]3COC[C@H]3C2)sc1-c1ccccc1	ZINC000853859983	EH	On-Demand	Anodyne	PIK3CA	15	45
Cc1nc(NC(=O)N2CC[C@@H]3COC[C@H]3C2)sc1-c1ccccc1	ZINC000853859983	EH	On-Demand	Anodyne	PIK3CG	25	45
Cc1nc(NC(=O)N2CC[C@H]3COC[C@H]3C2)sc1-c1ccccc1	ZINC000853859984	EH	On-Demand	Anodyne	PIK3CA	15	45
Cc1nc(NC(=O)N2CC[C@H]3COC[C@H]3C2)sc1-c1ccccc1	ZINC000853859984	EH	On-Demand	Anodyne	PIK3CG	25	45
O=C(NCC1SCCS1)Nc1ccc(N2CCOCC2)cn1	ZINC000853859987	ED	On-Demand	Anodyne	STAT6	55	34
O=C(NCC1SCCS1)Nc1ccc(Cl)cn1	ZINC000853860004	CF	On-Demand	Anodyne	F10	53	35
CON(C)CCNC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000853860011	ED	On-Demand	Anodyne	DRD4	23	43
CON(C)CCNC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853860012	ED	On-Demand	Anodyne	DRD4	23	43
CON(C)CCNC(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853860013	ED	On-Demand	Anodyne	DRD4	23	43
CN1CCN(c2ccccc2NC(=O)NCC(C)(C)[C@]2(O)CCCOC2)CC1	ZINC000853860016	GE	On-Demand	Anodyne	KCNQ2	75	39
CN1CCN(c2ccccc2NC(=O)NCC(C)(C)[C@@]2(O)CCCOC2)CC1	ZINC000853860017	GE	On-Demand	Anodyne	KCNQ2	75	39
CNC(=O)CC1(CNC(=O)c2nccn2C)CCCCC1	ZINC000853860032	CD	On-Demand	Anodyne	HCN1	50	31
CNC(=O)CC1(CNC(=O)c2nccn2C)CCCCC1	ZINC000853860032	CD	On-Demand	Anodyne	HCN4	48	31
O=C(NCC1SCCS1)Nc1ccc(Cl)cc1Cl	ZINC000853860035	DH	On-Demand	Anodyne	EPHX2	16	40
CS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853860036	EE	On-Demand	Anodyne	EPHX2	28	43
CS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853860036	EE	On-Demand	Anodyne	PRMT3	24	43
CS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853860036	EE	On-Demand	Anodyne	MTCA1	44	39
CS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853860036	EE	On-Demand	Anodyne	P96878_MYCTU	55	39
CS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853860036	EE	On-Demand	Anodyne	NAMPT	41	42
O=C(NCC1SCCS1)Nc1ccc(-c2ncon2)cc1	ZINC000853860048	DF	On-Demand	Anodyne	MTOR	64	38
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NCC1SCCS1	ZINC000853860053	GG	On-Demand	Anodyne	DRD4	20	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCC1SCCS1	ZINC000853860054	GG	On-Demand	Anodyne	DRD4	20	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCC1SCCS1	ZINC000853860055	GG	On-Demand	Anodyne	DRD4	20	40
O=C(NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)N[C@@H]1COC2(CCC2)C1	ZINC000853860060	GH	On-Demand	Anodyne	SSTR3	19	41
O=C(NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1)N[C@H]1COC2(CCC2)C1	ZINC000853860061	GH	On-Demand	Anodyne	SSTR3	19	41
O=C(N1CC[C@@H]2COC[C@H]2C1)C(F)(F)c1ccccc1F	ZINC000853860063	CE	On-Demand	Anodyne	RBP4	67	37
O=C(N1CC[C@@H]2COC[C@@H]2C1)C(F)(F)c1ccccc1F	ZINC000853860064	CE	On-Demand	Anodyne	RBP4	67	37
O=C(N1CC[C@H]2COC[C@@H]2C1)C(F)(F)c1ccccc1F	ZINC000853860065	CE	On-Demand	Anodyne	RBP4	67	37
O=C(N1CC[C@H]2COC[C@H]2C1)C(F)(F)c1ccccc1F	ZINC000853860066	CE	On-Demand	Anodyne	RBP4	67	37
O=C(NCCc1nsc2ccccc12)N1CCCCC1	ZINC000853860074	CG	On-Demand	Anodyne	HTR1A	18	42
O=C(NCCc1nsc2ccccc12)N1CCCCC1	ZINC000853860074	CG	On-Demand	Anodyne	DRD2	22	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NNC(=O)c1cn(C)nn1	ZINC000853860087	GC	On-Demand	Reactive	DRD4	20	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NNC(=O)c1cn(C)nn1	ZINC000853860088	GC	On-Demand	Reactive	DRD4	20	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NNC(=O)c1cn(C)nn1	ZINC000853860089	GC	On-Demand	Reactive	DRD4	20	41
O=C(NCC1SCCS1)Nc1cc(Cl)cc(Cl)c1	ZINC000853860101	DH	On-Demand	Anodyne	CACNA1I	41	33
O=C(NCC(F)(F)c1ccc(F)cc1)C(F)(F)C(=O)N1CCOCC1	ZINC000853860104	FD	On-Demand	Anodyne	MLYCD	21	40
COCCN(CCF)C(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853860115	FF	On-Demand	Anodyne	DRD4	27	45
COCCN(CCF)C(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853860116	FF	On-Demand	Anodyne	DRD4	27	45
COCCN(CCF)C(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000853860117	FF	On-Demand	Anodyne	DRD4	27	45
O=C(NCC(F)(F)c1ccc(F)cc1)N1CCCCC1	ZINC000853860129	CG	On-Demand	Anodyne	CACNA1G	42	44
O=C(NCC(F)(F)c1ccc(F)cc1)N1CCCCC1	ZINC000853860129	CG	On-Demand	Anodyne	MLYCD	18	40
O=C(NCC1SCCS1)Nc1ccc(Br)cc1	ZINC000853860143	EG	On-Demand	Anodyne	EPHX2	22	44
O=C(N[C@@H](c1cccc(Cl)c1)C1CCCCC1)N1CCC(CO)(CO)C1	ZINC000853860164	GG	On-Demand	Anodyne	CACNA1H	43	35
O=C(N[C@@H](c1cccc(Cl)c1)C1CCCCC1)N1CCC(CO)(CO)C1	ZINC000853860164	GG	On-Demand	Anodyne	CCKBR	17	41
O=C(N[C@H](c1cccc(Cl)c1)C1CCCCC1)N1CCC(CO)(CO)C1	ZINC000853860165	GG	On-Demand	Anodyne	CACNA1H	43	35
O=C(N[C@H](c1cccc(Cl)c1)C1CCCCC1)N1CCC(CO)(CO)C1	ZINC000853860165	GG	On-Demand	Anodyne	CCKBR	17	41
COC(=O)c1sc(Nc2ccc3c(c2)CCOC3)nc1Cl	ZINC000853860170	DG	On-Demand	Anodyne	DHODH	18	45
C#C[C@H](NC(=O)Nc1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000853860183	EG	On-Demand	Mild	EPHX2	38	47
C#C[C@@H](NC(=O)Nc1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000853860184	EG	On-Demand	Mild	EPHX2	38	47
CCn1cc(NC(=O)NC[C@H](O)c2ccc(Cl)c(Cl)c2)ccc1=O	ZINC000853860188	FG	On-Demand	Anodyne	F7	23	48
CCn1cc(NC(=O)NC[C@@H](O)c2ccc(Cl)c(Cl)c2)ccc1=O	ZINC000853860189	FG	On-Demand	Anodyne	F7	23	48
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)Nc1nc2c(s1)CCC2	ZINC000853860200	FH	On-Demand	Anodyne	SLC27A1	31	40
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)Nc1nc2c(s1)CCC2	ZINC000853860201	FH	On-Demand	Anodyne	SLC27A1	31	40
C#C[C@H](NC(=O)Nc1cccc(C(C)=O)c1)C1CCOCC1	ZINC000853860212	DE	On-Demand	Mild	CCR3	21	40
C#C[C@H](NC(=O)Nc1cccc(C(C)=O)c1)C1CCOCC1	ZINC000853860212	DE	On-Demand	Mild	EPHX2	15	44
C#C[C@H](NC(=O)Nc1cccc(C(C)=O)c1)C1CCOCC1	ZINC000853860212	DE	On-Demand	Mild	KCNK3	75	36
C#C[C@@H](NC(=O)Nc1cccc(C(C)=O)c1)C1CCOCC1	ZINC000853860213	DE	On-Demand	Mild	CCR3	21	40
C#C[C@@H](NC(=O)Nc1cccc(C(C)=O)c1)C1CCOCC1	ZINC000853860213	DE	On-Demand	Mild	EPHX2	15	44
C#C[C@@H](NC(=O)Nc1cccc(C(C)=O)c1)C1CCOCC1	ZINC000853860213	DE	On-Demand	Mild	KCNK3	75	36
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)C(=O)NC1CC1	ZINC000853860226	DD	On-Demand	Anodyne	ADRB3	21	46
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)C(=O)NC1CC1	ZINC000853860227	DD	On-Demand	Anodyne	ADRB3	21	46
C#C[C@H](NC(=O)Nc1cccc(C(=O)N(C)C)c1)C1CCOCC1	ZINC000853860230	ED	On-Demand	Mild	KCNK3	41	35
C#C[C@@H](NC(=O)Nc1cccc(C(=O)N(C)C)c1)C1CCOCC1	ZINC000853860231	ED	On-Demand	Mild	KCNK3	41	35
C#C[C@H](NC(=O)Nc1cccc(NC(C)=O)c1)C1CCOCC1	ZINC000853860247	DE	On-Demand	Mild	KCNK3	61	34
C#C[C@H](NC(=O)Nc1cccc(NC(C)=O)c1)C1CCOCC1	ZINC000853860247	DE	On-Demand	Mild	KCNK9	47	32
C#C[C@@H](NC(=O)Nc1cccc(NC(C)=O)c1)C1CCOCC1	ZINC000853860248	DE	On-Demand	Mild	KCNK3	61	34
C#C[C@@H](NC(=O)Nc1cccc(NC(C)=O)c1)C1CCOCC1	ZINC000853860248	DE	On-Demand	Mild	KCNK9	47	32
CON(C)CCNC(=O)NCCOc1ccc(C(F)(F)F)cn1	ZINC000853860259	ED	On-Demand	Anodyne	LIPE	20	41
O=C(NCC1SCCS1)Nc1ccccc1OC(F)(F)F	ZINC000853860281	EH	On-Demand	Anodyne	P2RY1	45	36
O=C(N1CC[C@@H]2COC[C@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853860320	EE	On-Demand	Bother	CACNA1D	48	32
O=C(N1CC[C@@H]2COC[C@@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853860322	EE	On-Demand	Bother	CACNA1D	48	32
O=C(N1CC[C@H]2COC[C@@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853860324	EE	On-Demand	Bother	CACNA1D	48	32
O=C(N1CC[C@H]2COC[C@H]2C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853860326	EE	On-Demand	Bother	CACNA1D	48	32
CCC(=O)c1ccc(N(C)Cc2cn(C)nn2)c(S(N)(=O)=O)c1	ZINC000853860327	EC	On-Demand	Anodyne	CA13	49	35
CC(C)c1ccccc1NC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860329	FJ	On-Demand	Anodyne	ADRB2	40	41
CC(C)c1ccccc1NC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860329	FJ	On-Demand	Anodyne	ADRB3	15	42
CC(C)c1ccccc1NC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860329	FJ	On-Demand	Anodyne	CXCL8	45	37
CC(C)c1ccccc1NC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860329	FJ	On-Demand	Anodyne	KCNQ2	24	44
CC(C)c1ccccc1NC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860329	FJ	On-Demand	Anodyne	SOAT1	48	42
CC(C)c1ccccc1NC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860331	FJ	On-Demand	Anodyne	ADRB2	40	41
CC(C)c1ccccc1NC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860331	FJ	On-Demand	Anodyne	ADRB3	15	42
CC(C)c1ccccc1NC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860331	FJ	On-Demand	Anodyne	CXCL8	45	37
CC(C)c1ccccc1NC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860331	FJ	On-Demand	Anodyne	KCNQ2	24	44
CC(C)c1ccccc1NC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860331	FJ	On-Demand	Anodyne	SOAT1	48	42
C[C@@H](O)C1(NC(=O)Nc2ccccc2N2CCN(C)CC2)CC1	ZINC000853860355	DD	On-Demand	Anodyne	KCNQ2	81	47
CN1CCN(c2ccccc2NC(=O)NCCc2nsc3ccccc23)CC1	ZINC000853860371	GG	On-Demand	Anodyne	HTR1A	32	46
CN1CCN(c2ccccc2NC(=O)NCCc2nsc3ccccc23)CC1	ZINC000853860371	GG	On-Demand	Anodyne	DRD2	35	44
CN1CCN(c2ccccc2NC(=O)NCCc2nsc3ccccc23)CC1	ZINC000853860371	GG	On-Demand	Anodyne	KCNQ2	71	38
CC(=O)Nc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853860373	DF	On-Demand	Anodyne	EPHX2	34	46
CC(=O)Nc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853860373	DF	On-Demand	Anodyne	PRMT3	44	31
CC(=O)Nc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853860373	DF	On-Demand	Anodyne	KCNK3	73	34
CC(=O)Nc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853860373	DF	On-Demand	Anodyne	KCNK9	44	34
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2ccc(F)cc2)CC1	ZINC000853860384	GG	On-Demand	Anodyne	HTR1A	24	42
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2ccc(F)cc2)CC1	ZINC000853860384	GG	On-Demand	Anodyne	DRD2	26	42
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2ccc(F)cc2)CC1	ZINC000853860384	GG	On-Demand	Anodyne	DRD4	17	40
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2ccc(F)cc2)CC1	ZINC000853860384	GG	On-Demand	Anodyne	DRD3	35	40
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2ccc(F)cc2)CC1	ZINC000853860384	GG	On-Demand	Anodyne	KCNQ2	81	48
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2ccc(F)cc2)CC1	ZINC000853860384	GG	On-Demand	Anodyne	P2RY1	50	37
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)c2ccc(F)cc2)CC1	ZINC000853860384	GG	On-Demand	Anodyne	CCR3	21	41
COCCN(CCF)C(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853860389	EH	On-Demand	Anodyne	CRTM	48	36
COCCN(CCF)C(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853860389	EH	On-Demand	Anodyne	HAO2	40	33
C#C[C@@H](NC(=O)Nc1ccc(Cl)cn1)C1CCOCC1	ZINC000853860399	CE	On-Demand	Mild	F10	47	31
C#C[C@H](NC(=O)Nc1ccc(Cl)cn1)C1CCOCC1	ZINC000853860400	CE	On-Demand	Mild	F10	47	31
O=C(NCC1SCCS1)Nc1nc2c(s1)CCCCC2	ZINC000853860401	EG	On-Demand	Anodyne	SLC27A1	32	41
C#C[C@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)C1CCOCC1	ZINC000853860407	EG	On-Demand	Mild	P2RY1	57	40
C#C[C@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)C1CCOCC1	ZINC000853860407	EG	On-Demand	Mild	CTSS	18	44
C#C[C@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)C1CCOCC1	ZINC000853860407	EG	On-Demand	Mild	EPHX2	70	49
C#C[C@@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)C1CCOCC1	ZINC000853860408	EG	On-Demand	Mild	P2RY1	57	40
C#C[C@@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)C1CCOCC1	ZINC000853860408	EG	On-Demand	Mild	CTSS	18	44
C#C[C@@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)C1CCOCC1	ZINC000853860408	EG	On-Demand	Mild	EPHX2	70	49
O=C(NCCc1cccc(-c2ccccc2)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853860423	GG	On-Demand	Anodyne	NPSR1	25	41
O=C(NCCc1cccc(-c2ccccc2)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853860425	GG	On-Demand	Anodyne	NPSR1	25	41
C#C[C@@H](NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1)C1CCOCC1	ZINC000853860450	GG	On-Demand	Mild	SCD	33	46
C#C[C@H](NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1)C1CCOCC1	ZINC000853860451	GG	On-Demand	Mild	SCD	33	46
C[C@@H](O)C1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853860488	CG	On-Demand	Anodyne	CA1	23	42
C[C@@H](O)C1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853860488	CG	On-Demand	Anodyne	PRNP	30	42
C[C@@H](O)C1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853860488	CG	On-Demand	Anodyne	SLC1A1	15	43
C[C@@H](O)C1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853860488	CG	On-Demand	Anodyne	EPHX2	22	42
C[C@@H](O)C1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853860488	CG	On-Demand	Anodyne	SLC1A2	26	43
C[C@@H](O)C1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CC1	ZINC000853860488	CG	On-Demand	Anodyne	DGAT1	24	41
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)Nc1ccc(N2CCCC2)nc1	ZINC000853860495	GH	On-Demand	Anodyne	KCNQ2	15	40
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)Nc1ccc(N2CCCC2)nc1	ZINC000853860496	GH	On-Demand	Anodyne	KCNQ2	15	40
C[C@@H](O)C1(NC(=O)Nc2cccnc2Cl)CC1	ZINC000853860499	CD	On-Demand	Anodyne	G2YM83_BOTF4	77	41
C#C[C@@H](NC(=O)Nc1cc(Cl)ccc1OC)C1CCOCC1	ZINC000853860502	DF	On-Demand	Mild	RBP4	18	41
C#C[C@H](NC(=O)Nc1cc(Cl)ccc1OC)C1CCOCC1	ZINC000853860503	DF	On-Demand	Mild	RBP4	18	41
CON(C)CCNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000853860537	FE	On-Demand	Anodyne	HTR1F	27	40
CON(C)CCNC(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000853860537	FE	On-Demand	Anodyne	ROCK2	17	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@@H]1C=CCC1	ZINC000853860566	EG	On-Demand	Anodyne	DRD4	33	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@@H]1C=CCC1	ZINC000853860566	EG	On-Demand	Anodyne	SIGMAR1	33	43
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1C=CCC1	ZINC000853860569	EG	On-Demand	Anodyne	DRD4	33	46
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1C=CCC1	ZINC000853860569	EG	On-Demand	Anodyne	SIGMAR1	33	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@H]1C=CCC1	ZINC000853860572	EG	On-Demand	Anodyne	DRD4	33	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@H]1C=CCC1	ZINC000853860572	EG	On-Demand	Anodyne	SIGMAR1	33	43
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1C=CCC1	ZINC000853860573	EG	On-Demand	Anodyne	DRD4	33	46
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1C=CCC1	ZINC000853860573	EG	On-Demand	Anodyne	SIGMAR1	33	43
CN1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)[C@@H]1c1cnn(C)c1	ZINC000853860593	FD	On-Demand	Bother	GSTM2	96	36
CN1CCO[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)[C@@H]1c1cnn(C)c1	ZINC000853860593	FD	On-Demand	Bother	GSTP1	56	36
O=C(NCC1SCCS1)Nc1cccc(Br)c1	ZINC000853860609	EG	On-Demand	Anodyne	EPHX2	26	45
C#C[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860617	EH	On-Demand	Mild	PIK3CA	27	40
C#C[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860617	EH	On-Demand	Mild	MTOR	59	40
C#C[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860617	EH	On-Demand	Mild	PIK3CG	25	40
C#C[C@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860617	EH	On-Demand	Mild	NR2E3	59	33
C#C[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860618	EH	On-Demand	Mild	PIK3CA	27	40
C#C[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860618	EH	On-Demand	Mild	MTOR	59	40
C#C[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860618	EH	On-Demand	Mild	PIK3CG	25	40
C#C[C@@H](NC(=O)Nc1ccc(-c2ccccc2)cc1)C1CCOCC1	ZINC000853860618	EH	On-Demand	Mild	NR2E3	59	33
Cc1nc(NC(=O)NC2([C@@H](C)O)CC2)sc1-c1ccccc1	ZINC000853860659	DG	On-Demand	Anodyne	PIK3CG	20	44
Cc1nc(NC(=O)NC2([C@@H](C)O)CC2)sc1-c1ccccc1	ZINC000853860659	DG	On-Demand	Anodyne	PI4KB	40	39
O=C(NCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853860660	DG	On-Demand	Anodyne	EPHX2	26	44
O=C(NCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853860660	DG	On-Demand	Anodyne	ERBB4	44	36
O=C(NCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853860660	DG	On-Demand	Anodyne	MCHR1	26	43
O=C(NCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853860660	DG	On-Demand	Anodyne	PRMT3	45	32
O=C(NCC1SCCS1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853860670	EF	On-Demand	Anodyne	PRMT3	45	33
Cc1nc(NC(=O)NC2([C@H](C)O)CC2)sc1-c1ccccc1	ZINC000853860676	DG	On-Demand	Anodyne	PIK3CG	20	44
Cc1nc(NC(=O)NC2([C@H](C)O)CC2)sc1-c1ccccc1	ZINC000853860676	DG	On-Demand	Anodyne	PI4KB	40	39
CN(C[C@@H]1OCCN(C)[C@H]1c1cnn(C)c1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853860708	GD	On-Demand	Bother	GSTM2	76	36
CN(C[C@@H]1OCCN(C)[C@H]1c1cnn(C)c1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853860708	GD	On-Demand	Bother	GSTP1	40	36
C#C[C@H](NC(=O)Nc1nc(C)c(-c2ccccc2)s1)C1CCOCC1	ZINC000853860751	FH	On-Demand	Mild	PIK3CG	21	42
C#C[C@@H](NC(=O)Nc1nc(C)c(-c2ccccc2)s1)C1CCOCC1	ZINC000853860752	FH	On-Demand	Mild	PIK3CG	21	42
CN1CCN(c2ccccc2NC(=O)NC(C)(C2CC2)C2CC2)CC1	ZINC000853860755	EG	On-Demand	Anodyne	HTR1A	18	41
CN1CCN(c2ccccc2NC(=O)NC(C)(C2CC2)C2CC2)CC1	ZINC000853860755	EG	On-Demand	Anodyne	HTR1B	17	41
CN1CCN(c2ccccc2NC(=O)NC(C)(C2CC2)C2CC2)CC1	ZINC000853860755	EG	On-Demand	Anodyne	HTR7	16	40
CN1CCN(c2ccccc2NC(=O)NC(C)(C2CC2)C2CC2)CC1	ZINC000853860755	EG	On-Demand	Anodyne	KCNQ2	82	44
C#CCCN(CCOC)C(=O)NCc1ccccc1-n1nc(C)cc1C	ZINC000853860761	FF	On-Demand	Mild	ADORA2A	15	41
CN1CCN(c2ccccc2NC(=O)N[C@]2(C)CC2(C)C)CC1	ZINC000853860770	DF	On-Demand	Anodyne	KCNQ2	90	48
CN1CCN(c2ccccc2NC(=O)N[C@]2(C)CC2(C)C)CC1	ZINC000853860770	DF	On-Demand	Anodyne	WDR5	33	40
CN1CCN(c2ccccc2NC(=O)N[C@@]2(C)CC2(C)C)CC1	ZINC000853860771	DF	On-Demand	Anodyne	KCNQ2	90	48
CN1CCN(c2ccccc2NC(=O)N[C@@]2(C)CC2(C)C)CC1	ZINC000853860771	DF	On-Demand	Anodyne	WDR5	33	40
CC(C)(C)OC(=O)C(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860772	EE	On-Demand	Anodyne	ADRB1	15	55
CC(C)(C)OC(=O)C(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860772	EE	On-Demand	Anodyne	ADRB3	19	41
CC(C)(C)OC(=O)C(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860773	EE	On-Demand	Anodyne	ADRB1	15	55
CC(C)(C)OC(=O)C(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853860773	EE	On-Demand	Anodyne	ADRB3	19	41
CC[C@@H](Nc1nccc(N2CCCC2)n1)C1CC1	ZINC000853860778	BF	On-Demand	Anodyne	HRH4	15	53
CC[C@@H](Nc1nccc(N2CCCC2)n1)C1CC1	ZINC000853860778	BF	On-Demand	Anodyne	SORD	67	35
CC[C@H](Nc1nccc(N2CCCC2)n1)C1CC1	ZINC000853860779	BF	On-Demand	Anodyne	HRH4	15	53
CC[C@H](Nc1nccc(N2CCCC2)n1)C1CC1	ZINC000853860779	BF	On-Demand	Anodyne	SORD	67	35
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1COC2(CCC2)C1	ZINC000853860802	FG	On-Demand	Anodyne	DRD4	18	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1COC2(CCC2)C1	ZINC000853860802	FG	On-Demand	Anodyne	SLC12A5	44	31
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1COC2(CCC2)C1	ZINC000853860803	FG	On-Demand	Anodyne	DRD4	18	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1COC2(CCC2)C1	ZINC000853860803	FG	On-Demand	Anodyne	SLC12A5	44	31
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@@H]1COC2(CCC2)C1	ZINC000853860804	FG	On-Demand	Anodyne	DRD4	18	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@@H]1COC2(CCC2)C1	ZINC000853860804	FG	On-Demand	Anodyne	SLC12A5	44	31
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@H]1COC2(CCC2)C1	ZINC000853860805	FG	On-Demand	Anodyne	DRD4	18	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)N[C@H]1COC2(CCC2)C1	ZINC000853860805	FG	On-Demand	Anodyne	SLC12A5	44	31
C[C@H](NC(=O)NCC1SCCS1)c1noc(-c2ccccc2)n1	ZINC000853860810	FF	On-Demand	Anodyne	PDE8B	40	33
C[C@@H](NC(=O)NCC1SCCS1)c1noc(-c2ccccc2)n1	ZINC000853860811	FF	On-Demand	Anodyne	PDE8B	40	33
CC(C)(CNC(=O)Nc1cccnc1Cl)[C@]1(O)CCCOC1	ZINC000853860827	EE	On-Demand	Anodyne	G2YM83_BOTF4	70	36
CC(C)(CNC(=O)Nc1cccnc1Cl)[C@@]1(O)CCCOC1	ZINC000853860828	EE	On-Demand	Anodyne	G2YM83_BOTF4	70	36
O=C(NCCc1ccc(I)cc1)N1CCCCC1	ZINC000853860831	FG	On-Demand	Anodyne	DPP7	54	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NCc1ncccn1	ZINC000853860857	FE	On-Demand	Anodyne	DRD4	25	43
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NCc1ncccn1	ZINC000853860857	FE	On-Demand	Anodyne	ACHE	15	40
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCc1ncccn1	ZINC000853860858	FE	On-Demand	Anodyne	DRD4	25	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCc1ncccn1	ZINC000853860858	FE	On-Demand	Anodyne	ACHE	15	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCc1ncccn1	ZINC000853860859	FE	On-Demand	Anodyne	DRD4	25	43
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCc1ncccn1	ZINC000853860859	FE	On-Demand	Anodyne	ACHE	15	40
CC(C)c1ccccc1NC(=O)NCC1SCCS1	ZINC000853860873	CH	On-Demand	Anodyne	SOAT1	46	41
O=C(NCC1SCCS1)Nc1ccc(C(F)(F)F)cc1	ZINC000853860875	DH	On-Demand	Anodyne	TRPV1	15	42
O=C(NCC1SCCS1)Nc1ccc(C(F)(F)F)cc1	ZINC000853860875	DH	On-Demand	Anodyne	EPHX2	54	45
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N1CCCCC1	ZINC000853860885	DG	On-Demand	Anodyne	TACR2	18	40
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N1CCCCC1	ZINC000853860886	DG	On-Demand	Anodyne	TACR2	18	40
C#C[C@@H](NC(=O)Nc1ccccc1C(F)(F)F)C1CCOCC1	ZINC000853860907	EG	On-Demand	Mild	RBP4	57	34
C#C[C@H](NC(=O)Nc1ccccc1C(F)(F)F)C1CCOCC1	ZINC000853860908	EG	On-Demand	Mild	RBP4	57	34
C#C[C@H](NC(=O)Nc1ccc(N2CCOCC2)cn1)C1CCOCC1	ZINC000853860931	ED	On-Demand	Mild	STAT6	51	31
C#C[C@@H](NC(=O)Nc1ccc(N2CCOCC2)cn1)C1CCOCC1	ZINC000853860932	ED	On-Demand	Mild	STAT6	51	31
C#C[C@H](NC(=O)Nc1ccc(-c2ncon2)cc1)C1CCOCC1	ZINC000853860936	EE	On-Demand	Mild	MTOR	81	36
C#C[C@@H](NC(=O)Nc1ccc(-c2ncon2)cc1)C1CCOCC1	ZINC000853860937	EE	On-Demand	Mild	MTOR	81	36
Cn1c(S)nnc1CCNC(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853860963	GF	On-Demand	Anodyne	CTSV	40	30
Cn1c(S)nnc1CCNC(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853860963	GF	On-Demand	Anodyne	HAO2	51	35
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@H]4COC[C@H]4C3)cc2F)C[C@@H](C)O1	ZINC000853861005	GF	On-Demand	Anodyne	NPY2R	70	40
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@H]4COC[C@@H]4C3)cc2F)C[C@@H](C)O1	ZINC000853861006	GF	On-Demand	Anodyne	NPY2R	70	40
O=C(NCCN1C[C@H]2CCCCN2C1=O)Nc1cccnc1Cl	ZINC000853861011	EE	On-Demand	Anodyne	G2YM83_BOTF4	45	33
O=C(NCCN1C[C@@H]2CCCCN2C1=O)Nc1cccnc1Cl	ZINC000853861012	EE	On-Demand	Anodyne	G2YM83_BOTF4	45	33
Cc1nc(NC(=O)NCCN2C[C@@H]3CCCCN3C2=O)sc1-c1ccccc1	ZINC000853861015	GH	On-Demand	Anodyne	PIK3CG	18	41
Cc1nc(NC(=O)NCCN2C[C@@H]3CCCCN3C2=O)sc1-c1ccccc1	ZINC000853861015	GH	On-Demand	Anodyne	PI4KB	37	41
Cc1nc(NC(=O)NCCN2C[C@H]3CCCCN3C2=O)sc1-c1ccccc1	ZINC000853861016	GH	On-Demand	Anodyne	PIK3CG	18	41
Cc1nc(NC(=O)NCCN2C[C@H]3CCCCN3C2=O)sc1-c1ccccc1	ZINC000853861016	GH	On-Demand	Anodyne	PI4KB	37	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NCCC1SCCS1	ZINC000853861023	GH	On-Demand	Anodyne	DRD4	20	41
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NCCC1SCCS1	ZINC000853861023	GH	On-Demand	Anodyne	ACHE	19	42
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCCC1SCCS1	ZINC000853861024	GH	On-Demand	Anodyne	DRD4	20	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NCCC1SCCS1	ZINC000853861024	GH	On-Demand	Anodyne	ACHE	19	42
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCCC1SCCS1	ZINC000853861025	GH	On-Demand	Anodyne	DRD4	20	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NCCC1SCCS1	ZINC000853861025	GH	On-Demand	Anodyne	ACHE	19	42
O=C(NCC1SCCS1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853861034	EH	On-Demand	Anodyne	P2RY1	66	44
O=C(NCC1SCCS1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853861034	EH	On-Demand	Anodyne	EPHX2	83	53
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853861035	GH	On-Demand	Anodyne	DRD4	25	44
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853861035	GH	On-Demand	Anodyne	SIGMAR1	31	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853861036	GH	On-Demand	Anodyne	DRD4	25	44
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853861036	GH	On-Demand	Anodyne	SIGMAR1	31	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853861037	GH	On-Demand	Anodyne	DRD4	25	44
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853861037	GH	On-Demand	Anodyne	SIGMAR1	31	40
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853861038	GH	On-Demand	Anodyne	DRD4	25	44
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853861038	GH	On-Demand	Anodyne	SIGMAR1	31	40
O=C(NCC1SCCS1)Nc1cccnc1N1CCCC1	ZINC000853861040	DF	On-Demand	Anodyne	KCNQ2	65	34
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853861106	GH	On-Demand	Anodyne	KCNQ2	69	48
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853861106	GH	On-Demand	Anodyne	TRPV1	16	42
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853861107	GH	On-Demand	Anodyne	KCNQ2	69	48
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)Nc1cccnc1N1CCCC1	ZINC000853861107	GH	On-Demand	Anodyne	TRPV1	16	42
C[C@H]1CN(c2ccc(NC(=O)NC3([C@@H](C)O)CC3)cc2F)C[C@@H](C)O1	ZINC000853861116	FE	On-Demand	Anodyne	NPY2R	64	35
C[C@H]1CN(c2ccc(NC(=O)NC3([C@H](C)O)CC3)cc2F)C[C@@H](C)O1	ZINC000853861119	FE	On-Demand	Anodyne	NPY2R	64	35
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N1CCc2ccccc2C1	ZINC000853861128	FH	On-Demand	Anodyne	MAPK1	54	42
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N1CCc2ccccc2C1	ZINC000853861128	FH	On-Demand	Anodyne	DPP8	19	40
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N1CCc2ccccc2C1	ZINC000853861129	FH	On-Demand	Anodyne	MAPK1	54	42
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N1CCc2ccccc2C1	ZINC000853861129	FH	On-Demand	Anodyne	DPP8	19	40
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N1CCOCC1	ZINC000853861152	DE	On-Demand	Anodyne	TACR2	19	41
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N1CCOCC1	ZINC000853861153	DE	On-Demand	Anodyne	TACR2	19	41
C#C[C@H](NC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1)C1CCOCC1	ZINC000853861158	FD	On-Demand	Mild	NPY1R	31	41
C#C[C@@H](NC(=O)Nc1cccc(CN2C(=O)CNC2=O)c1)C1CCOCC1	ZINC000853861159	FD	On-Demand	Mild	NPY1R	31	41
CN1CCN(c2ccccc2NC(=O)NCC2SCCS2)CC1	ZINC000853861206	FE	On-Demand	Anodyne	KCNQ2	81	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3COC[C@@H]3C2)CC1	ZINC000853861232	ED	On-Demand	Anodyne	HTR1B	19	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3COC[C@@H]3C2)CC1	ZINC000853861232	ED	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3COC[C@@H]3C2)CC1	ZINC000853861232	ED	On-Demand	Anodyne	RBP4	53	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3COC[C@@H]3C2)CC1	ZINC000853861233	ED	On-Demand	Anodyne	HTR1B	19	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3COC[C@@H]3C2)CC1	ZINC000853861233	ED	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3COC[C@@H]3C2)CC1	ZINC000853861233	ED	On-Demand	Anodyne	RBP4	53	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3COC[C@H]3C2)CC1	ZINC000853861234	ED	On-Demand	Anodyne	HTR1B	19	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3COC[C@H]3C2)CC1	ZINC000853861234	ED	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H]3COC[C@H]3C2)CC1	ZINC000853861234	ED	On-Demand	Anodyne	RBP4	53	34
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3COC[C@H]3C2)CC1	ZINC000853861235	ED	On-Demand	Anodyne	HTR1B	19	44
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3COC[C@H]3C2)CC1	ZINC000853861235	ED	On-Demand	Anodyne	KCNQ2	72	40
CN1CCN(c2ccccc2NC(=O)N2CC[C@H]3COC[C@H]3C2)CC1	ZINC000853861235	ED	On-Demand	Anodyne	RBP4	53	34
COC(=O)N(C)CCNC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000853861252	GE	On-Demand	Anodyne	DRD4	21	42
COC(=O)N(C)CCNC(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000853861252	GE	On-Demand	Anodyne	ACHE	16	40
COC(=O)N(C)CCNC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853861253	GE	On-Demand	Anodyne	DRD4	21	42
COC(=O)N(C)CCNC(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853861253	GE	On-Demand	Anodyne	ACHE	16	40
COC(=O)N(C)CCNC(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853861254	GE	On-Demand	Anodyne	DRD4	21	42
COC(=O)N(C)CCNC(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853861254	GE	On-Demand	Anodyne	ACHE	16	40
COCCN(CCF)C(=O)NCc1ccc(C(=O)Nc2ccc(F)cc2)cc1	ZINC000853861263	GG	On-Demand	Anodyne	NOD2	40	35
O=C(NCC1SCCS1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853861274	FE	On-Demand	Bother	CACNA1D	59	35
C#C[C@@H](NC(=O)Nc1cccc(OCC(C)C)c1)C1CCOCC1	ZINC000853861328	EG	On-Demand	Mild	EPHX2	23	42
C#C[C@H](NC(=O)Nc1cccc(OCC(C)C)c1)C1CCOCC1	ZINC000853861329	EG	On-Demand	Mild	EPHX2	23	42
C#C[C@@H](NC(=O)Nc1cccc(C)n1)C1CCOCC1	ZINC000853861345	CD	On-Demand	Mild	GRM5	15	41
C#C[C@H](NC(=O)Nc1cccc(C)n1)C1CCOCC1	ZINC000853861346	CD	On-Demand	Mild	GRM5	15	41
CON(C)CCNC(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853861359	EF	On-Demand	Anodyne	MTNR1A	58	39
CON(C)CCNC(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853861359	EF	On-Demand	Anodyne	MTNR1B	49	39
CON(C)CCNC(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853861359	EF	On-Demand	Anodyne	FAAH	20	50
CON(C)CCNC(=O)NCCc1cccc(-c2ccccc2)c1	ZINC000853861359	EF	On-Demand	Anodyne	HAO2	54	34
CN(Cc1cn(C)nn1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853861370	CC	On-Demand	Bother	GSTM2	106	43
CN(Cc1cn(C)nn1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853861370	CC	On-Demand	Bother	GSTP1	66	43
COc1ccc2c(NC[C@@H]3OCCN(C)[C@H]3c3cnn(C)c3)ccnc2c1	ZINC000853861397	FE	On-Demand	Anodyne	PDGFRB	19	41
COc1ccc2c(NC[C@@H]3OCCN(C)[C@H]3c3cnn(C)c3)ccnc2c1	ZINC000853861397	FE	On-Demand	Anodyne	HRP1_PLAFA	89	43
COc1ccc2c(NC[C@@H]3OCCN(C)[C@H]3c3cnn(C)c3)ccnc2c1	ZINC000853861397	FE	On-Demand	Anodyne	HNMT	58	34
O=C(NCC1SCCS1)Nc1ccc(F)c(F)c1	ZINC000853861414	CF	On-Demand	Anodyne	EPHX2	22	40
O=C(NCC1SCCS1)Nc1ccc(F)c(F)c1	ZINC000853861414	CF	On-Demand	Anodyne	PRMT3	61	33
CNC(=O)CC1(CNC(=O)Nc2cccnc2Cl)CCCCC1	ZINC000853861416	EF	On-Demand	Anodyne	G2YM83_BOTF4	72	37
Cc1cccc(NC(=O)NCC2SCCS2)n1	ZINC000853861420	CE	On-Demand	Anodyne	GRM5	19	47
Cc1cccc(NC(=O)NCC2SCCS2)n1	ZINC000853861420	CE	On-Demand	Anodyne	SORT1	16	40
Cc1nc(NC(=O)NCC(C)(C)[C@]2(O)CCCOC2)sc1-c1ccccc1	ZINC000853861429	GH	On-Demand	Anodyne	PIK3CG	18	44
Cc1nc(NC(=O)NCC(C)(C)[C@@]2(O)CCCOC2)sc1-c1ccccc1	ZINC000853861430	GH	On-Demand	Anodyne	PIK3CG	18	44
O=C(NCCCOc1ccc2ccccc2c1)N1CCC(N2CCOC2=O)CC1	ZINC000853861440	GG	On-Demand	Anodyne	CXCR4	43	32
O=C(N1CCCC1)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853861453	FF	On-Demand	Anodyne	EPHX2	22	41
O=C(Nc1ccc2oc(=O)ccc2c1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861455	GI	On-Demand	Anodyne	EPHX2	20	48
O=C(Nc1ccc2oc(=O)ccc2c1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861455	GI	On-Demand	Anodyne	TRPM8	33	60
O=C(NCC1SCCS1)Nc1ccc(Cl)c(Cl)c1	ZINC000853861456	DH	On-Demand	Anodyne	EPHX2	23	57
O=C(NCC1SCCS1)Nc1ccc(Cl)c(Cl)c1	ZINC000853861456	DH	On-Demand	Anodyne	PRMT3	64	35
O=C(NC[C@H]1CN(Cc2ccccc2)CC12CCC2)Nc1cccnc1Cl	ZINC000853861466	GI	On-Demand	Anodyne	G2YM83_BOTF4	50	31
O=C(NC[C@@H]1CN(Cc2ccccc2)CC12CCC2)Nc1cccnc1Cl	ZINC000853861467	GI	On-Demand	Anodyne	G2YM83_BOTF4	50	31
O=C(Nc1ccc(Cl)nc1)N1CCC[C@@H](C2CCC2)C1	ZINC000853861468	CH	On-Demand	Anodyne	EPHX2	15	40
O=C(Nc1ccc(Cl)nc1)N1CCC[C@H](C2CCC2)C1	ZINC000853861469	CH	On-Demand	Anodyne	EPHX2	15	40
O=C(N1CCC(c2ccon2)CC1)C(F)(F)c1ccccc1F	ZINC000853861514	DG	On-Demand	Anodyne	RBP4	42	39
O=C(N1CCC(c2ccon2)CC1)C(F)(F)c1ccccc1F	ZINC000853861514	DG	On-Demand	Anodyne	ETHR	52	36
Cc1nc(O)cc(-c2ccc(NC(=O)NCC3SCCS3)cc2)n1	ZINC000853861517	FG	On-Demand	Anodyne	MTOR	41	34
Cc1nc(O)cc(-c2ccc(NC(=O)NCC3SCCS3)cc2)n1	ZINC000853861517	FG	On-Demand	Anodyne	SMG1	56	32
O=C(N1CCOCC1)C(F)(F)C(=O)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861519	GD	On-Demand	Anodyne	EPHX2	20	60
O=C(N1CCOCC1)C(F)(F)C(=O)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861519	GD	On-Demand	Anodyne	TRPM8	29	56
O=C(NCCCOc1ccc2ccccc2c1)N[C@H]1COC2(CCC2)C1	ZINC000853861532	FH	On-Demand	Anodyne	HRH2	25	44
O=C(NCCCOc1ccc2ccccc2c1)N[C@@H]1COC2(CCC2)C1	ZINC000853861533	FH	On-Demand	Anodyne	HRH2	25	44
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccccc1Cl)C2	ZINC000853861536	FH	On-Demand	Anodyne	EPHB3	41	31
CC(=O)c1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853861550	FG	On-Demand	Anodyne	CCR3	33	43
CC(=O)c1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853861550	FG	On-Demand	Anodyne	EPHX2	33	51
CC(=O)c1ccc(NC(=O)NCC[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1	ZINC000853861566	GH	On-Demand	Anodyne	CTSK	16	43
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853861576	EJ	On-Demand	Mild	PIK3CG	21	44
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853861576	EJ	On-Demand	Mild	PI4KB	40	37
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccc(C#N)c1)C2	ZINC000853861605	FG	On-Demand	Mild	CCR3	25	44
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccc(C#N)c1)C2	ZINC000853861605	FG	On-Demand	Mild	EPHX2	22	43
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccc(C#N)c1)C2	ZINC000853861605	FG	On-Demand	Mild	MCHR1	36	46
Cc1nsc(C(=O)N2CC[C@@H](Oc3ccccc3)C2)n1	ZINC000853861612	CE	On-Demand	Anodyne	GRIN2B	16	42
O=C(Nc1ccc(O[C@@H]2CC2(F)F)cc1)N1CCCCC1	ZINC000853861627	CG	On-Demand	Anodyne	EPHX2	59	46
O=C(Nc1ccc(O[C@@H]2CC2(F)F)cc1)N1CCCCC1	ZINC000853861627	CG	On-Demand	Anodyne	TRPM8	28	40
O=C(Nc1ccc(O[C@H]2CC2(F)F)cc1)N1CCCCC1	ZINC000853861628	CG	On-Demand	Anodyne	EPHX2	59	46
O=C(Nc1ccc(O[C@H]2CC2(F)F)cc1)N1CCCCC1	ZINC000853861628	CG	On-Demand	Anodyne	TRPM8	28	40
C[C@H]1CN(c2ccc(NC(=O)NCC3SCCS3)cc2F)C[C@H](C)O1	ZINC000853861641	GG	On-Demand	Anodyne	NPY2R	64	37
C[C@H]1CN(c2ccc(NC(=O)NCC3SCCS3)cc2F)C[C@@H](C)O1	ZINC000853861642	GG	On-Demand	Anodyne	NPY2R	64	37
O=C(N1CC[C@@H](Oc2ccccc2)C1)n1ccnc1	ZINC000853861664	CE	On-Demand	Anodyne	EPHX2	16	44
N#Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861666	CE	On-Demand	Mild	CCR3	29	50
N#Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861666	CE	On-Demand	Mild	EPHX2	19	43
N#Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861666	CE	On-Demand	Mild	MCHR1	34	47
CC(C)(C)OC(=O)C(=O)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861667	EF	On-Demand	Anodyne	TRPM8	15	51
N#Cc1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853861670	CE	On-Demand	Mild	EPHX2	15	48
O=C(Nc1nccs1)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853861684	GG	On-Demand	Anodyne	MAP1	95	37
O=C(Nc1nccs1)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853861684	GG	On-Demand	Anodyne	RBP4	53	37
O=C(Nc1ccc(Cl)nc1)N1CCC(c2ccon2)CC1	ZINC000853861685	DG	On-Demand	Anodyne	SMO	23	43
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	PDGFRB	16	42
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	CCR3	38	48
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	MTNR1A	58	45
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	MTNR1B	52	48
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	ROCK2	23	46
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	EPHX2	41	58
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	FLT4	18	42
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	TAAR1	36	43
COc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853861687	CF	On-Demand	Anodyne	KCNK3	42	37
O=C(NCC1SCCS1)Nc1cccnc1	ZINC000853861701	CE	On-Demand	Anodyne	NAMPT	59	45
O=C(Nc1ccc2oc(=O)ccc2c1)N1CCC(c2ccon2)CC1	ZINC000853861718	EG	On-Demand	Anodyne	SMO	31	41
Cn1ncc2c(N3CCN(C(=O)COC(=O)c4cccc(-n5cnnn5)c4)CC3)ncnc21	ZINC000853861737	IB	On-Demand	Anodyne	KCNJ1	48	34
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853861743	FI	On-Demand	Mild	SCD1	38	42
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853861743	FI	On-Demand	Mild	SCD	36	49
Cn1cc(-c2cccc(NC(=O)N3CCCCC3)c2)nn1	ZINC000853861754	CE	On-Demand	Anodyne	HDAC10	21	44
Cn1cc(-c2cccc(NC(=O)N3CCCCC3)c2)nn1	ZINC000853861754	CE	On-Demand	Anodyne	HDAC3	26	44
Cn1cc(-c2cccc(NC(=O)N3CCCCC3)c2)nn1	ZINC000853861754	CE	On-Demand	Anodyne	HDAC6	18	44
Cn1cc(-c2cccc(NC(=O)N3CCCCC3)c2)nn1	ZINC000853861754	CE	On-Demand	Anodyne	P2RY14	47	35
C[C@]1(C#N)CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853861755	CF	On-Demand	Mild	G2YM83_BOTF4	74	39
C[C@@]1(C#N)CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853861756	CF	On-Demand	Mild	G2YM83_BOTF4	74	39
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc(F)cc1)C2	ZINC000853861773	EG	On-Demand	Anodyne	CCR3	40	37
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc(F)cc1)C2	ZINC000853861773	EG	On-Demand	Anodyne	EPHX2	39	42
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853861782	EG	On-Demand	Mild	KCNQ2	74	41
Cn1ccnc1C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861790	CD	On-Demand	Anodyne	GRIN2B	15	40
Cn1ccnc1C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861790	CD	On-Demand	Anodyne	EPHX2	21	45
O=C(Nc1ccc(Cl)nc1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861839	FI	On-Demand	Anodyne	NPY5R	29	42
O=C(Nc1ccc(Cl)nc1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861839	FI	On-Demand	Anodyne	EPHX2	35	53
O=C(Nc1ccc(Cl)nc1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853861839	FI	On-Demand	Anodyne	TRPM8	46	64
O=C(NCC1SCCS1)Nc1cccc([N+](=O)[O-])c1	ZINC000853861843	CF	On-Demand	Bother	CACNA1C	43	33
O=C(NCC1SCCS1)Nc1cccc([N+](=O)[O-])c1	ZINC000853861843	CF	On-Demand	Bother	CACNA1D	67	33
O=C(NCC1SCCS1)Nc1cccc([N+](=O)[O-])c1	ZINC000853861843	CF	On-Demand	Bother	EPHX2	18	46
O=C(NCC1SCCS1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853861845	FD	On-Demand	Anodyne	NPY1R	29	41
O=C(Nc1ccc(Cl)nc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861854	DG	On-Demand	Anodyne	EPHX2	52	47
O=C(Nc1ccc(Cl)nc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861854	DG	On-Demand	Anodyne	SCD1	19	53
O=C(NCC1SCCS1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853861859	FH	On-Demand	Anodyne	CDK5	46	35
O=C(NCC1SCCS1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853861861	FH	On-Demand	Anodyne	CDK5	43	35
O=C(NCC1SCCS1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853861861	FH	On-Demand	Anodyne	SCD	33	41
O=C(NCC1SCCS1)Nc1nc2c(s1)CCCC2	ZINC000853861874	DF	On-Demand	Anodyne	SLC27A1	32	42
C#CCCN(CCOC)C(=O)N[C@@H]1[C@@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853861875	FF	On-Demand	Mild	DRD4	20	43
C#CCCN(CCOC)C(=O)NC1[C@@H](C)CN(Cc2ccccc2)C[C@@H]1C	ZINC000853861876	FF	On-Demand	Mild	DRD4	20	43
C#CCCN(CCOC)C(=O)NC1[C@H](C)CN(Cc2ccccc2)C[C@H]1C	ZINC000853861877	FF	On-Demand	Mild	DRD4	20	43
O=C(Nc1nncs1)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853861892	GF	On-Demand	Anodyne	RBP4	45	33
Cc1nc(NC(=O)N2CCC3(CCc4ccccc4O3)CC2)sc1C	ZINC000853861895	FI	On-Demand	Anodyne	EPHX2	18	46
Cc1nc(NC(=O)N2CCC3(CCc4ccccc4O3)CC2)sc1C	ZINC000853861895	FI	On-Demand	Anodyne	SCD1	21	40
Cc1nc(NC(=O)N2CCC3(CCc4ccccc4O3)CC2)sc1C	ZINC000853861895	FI	On-Demand	Anodyne	TRPM8	32	56
O=C(N1CCCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861917	CF	On-Demand	Anodyne	CHRM3	30	45
O=C(N1CCCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861917	CF	On-Demand	Anodyne	HRH3	23	41
O=C(N1CCCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861917	CF	On-Demand	Anodyne	EPHX2	22	48
O=C(N1CCCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853861917	CF	On-Demand	Anodyne	L3MBTL3	49	36
O=C(NCC1SCCS1)Nc1cccc2cccnc12	ZINC000853861924	DG	On-Demand	Anodyne	WNT3	15	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](C3CCC3)C2)CC1	ZINC000853861925	FG	On-Demand	Anodyne	HTR1A	17	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](C3CCC3)C2)CC1	ZINC000853861925	FG	On-Demand	Anodyne	HTR1B	15	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](C3CCC3)C2)CC1	ZINC000853861925	FG	On-Demand	Anodyne	HTR7	16	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](C3CCC3)C2)CC1	ZINC000853861925	FG	On-Demand	Anodyne	KCNQ2	78	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@@H](C3CCC3)C2)CC1	ZINC000853861925	FG	On-Demand	Anodyne	RBP4	54	35
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](C3CCC3)C2)CC1	ZINC000853861926	FG	On-Demand	Anodyne	HTR1A	17	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](C3CCC3)C2)CC1	ZINC000853861926	FG	On-Demand	Anodyne	HTR1B	15	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](C3CCC3)C2)CC1	ZINC000853861926	FG	On-Demand	Anodyne	HTR7	16	41
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](C3CCC3)C2)CC1	ZINC000853861926	FG	On-Demand	Anodyne	KCNQ2	78	43
CN1CCN(c2ccccc2NC(=O)N2CCC[C@H](C3CCC3)C2)CC1	ZINC000853861926	FG	On-Demand	Anodyne	RBP4	54	35
C[C@@]1(C#N)CCN(C(=O)Nc2ccc(Cl)nc2)C1	ZINC000853861944	CF	On-Demand	Mild	EPHX2	34	42
O=C(C(=O)N1CC[C@@H](Oc2ccccc2)C1)C1CCSCC1	ZINC000853861945	DE	On-Demand	Anodyne	EPHX2	20	45
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1nccs1)C2	ZINC000853861962	EF	On-Demand	Anodyne	MAP1	105	35
CN1CCN(c2ccccc2NC(=O)N2CCC3(COC3)C2)CC1	ZINC000853861964	ED	On-Demand	Anodyne	HTR1B	15	42
CN1CCN(c2ccccc2NC(=O)N2CCC3(COC3)C2)CC1	ZINC000853861964	ED	On-Demand	Anodyne	KCNQ2	71	38
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccnc1Cl)C2	ZINC000853861968	FG	On-Demand	Anodyne	G2YM83_BOTF4	68	35
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccc([N+](=O)[O-])c1)C2	ZINC000853861973	GG	On-Demand	Bother	CACNA1C	55	36
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccc([N+](=O)[O-])c1)C2	ZINC000853861973	GG	On-Demand	Bother	CACNA1D	86	33
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccc([N+](=O)[O-])c1)C2	ZINC000853861973	GG	On-Demand	Bother	NMBR	62	38
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccc([N+](=O)[O-])c1)C2	ZINC000853861973	GG	On-Demand	Bother	EPHX2	24	42
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc(F)c(F)c1)C2	ZINC000853861985	FG	On-Demand	Anodyne	EPHX2	26	40
C=C(C)COCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853861998	EG	On-Demand	Reactive	CSNK1D	42	45
CC(=O)Nc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853862001	GG	On-Demand	Anodyne	EPHX2	30	46
Cc1nc(NC(=O)N2CCC3(COC3)C2)sc1-c1ccccc1	ZINC000853862024	EG	On-Demand	Anodyne	NPY5R	27	41
Cc1nc(NC(=O)N2CCC3(COC3)C2)sc1-c1ccccc1	ZINC000853862024	EG	On-Demand	Anodyne	PIK3CG	20	44
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccccc1C(F)(F)F)C2	ZINC000853862030	GI	On-Demand	Anodyne	RBP4	64	34
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc(Cl)cn1)C2	ZINC000853862031	FG	On-Demand	Anodyne	F10	50	33
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](CN3CCCC3=O)C2)CC1	ZINC000853862060	GD	On-Demand	Anodyne	KCNQ2	73	42
CN1CCN(c2ccccc2NC(=O)N2CC[C@H](CN3CCCC3=O)C2)CC1	ZINC000853862061	GD	On-Demand	Anodyne	KCNQ2	73	42
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862075	GE	On-Demand	Anodyne	CCR3	47	37
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862076	GE	On-Demand	Anodyne	CCR3	47	37
CON(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862081	EE	On-Demand	Anodyne	ALOX5	15	44
CON(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862081	EE	On-Demand	Anodyne	HRH2	26	41
CON(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862081	EE	On-Demand	Anodyne	LTA4H	21	40
CON(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862081	EE	On-Demand	Anodyne	MTNR1A	61	45
CON(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862081	EE	On-Demand	Anodyne	MTNR1B	44	45
O=C(NCC1SCCS1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853862083	FF	On-Demand	Anodyne	CCR3	37	42
O=C(NCC1SCCS1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853862083	FF	On-Demand	Anodyne	EPHX2	15	40
COCCN(CCF)C(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862095	EG	On-Demand	Anodyne	DRD3	16	40
O=C(Nc1cccc(N2CCOC2=O)c1)N1CCC(c2ccon2)CC1	ZINC000853862113	FG	On-Demand	Anodyne	SMO	20	40
O=C(NCC1SCCS1)Nc1ccc(Cl)nc1	ZINC000853862133	CF	On-Demand	Anodyne	EPHX2	15	40
O=C(NCCc1ccncc1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853862150	DD	On-Demand	Anodyne	CPT1A	84	39
O=C(NCCc1ccncc1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853862151	DD	On-Demand	Anodyne	CPT1A	84	39
O=C(NCC1(O)CCC(F)(F)CC1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853862157	GF	On-Demand	Bother	NMBR	47	31
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1Cl	ZINC000853862163	FH	On-Demand	Clean	KCNQ2	52	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1Cl	ZINC000853862163	FH	On-Demand	Clean	EPHB3	58	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1Cl	ZINC000853862163	FH	On-Demand	Clean	NAMPT	28	40
CCC(=O)N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C(C)C)C1	ZINC000853862166	FD	On-Demand	Anodyne	EPHX2	16	45
CCC(=O)N1CC[C@H](NC(=O)NCCc2nnc(S)n2C(C)C)C1	ZINC000853862167	FD	On-Demand	Anodyne	EPHX2	16	45
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000853862174	EE	On-Demand	Clean	PIK3CA	16	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000853862174	EE	On-Demand	Clean	CHRNA7	53	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000853862174	EE	On-Demand	Clean	MTOR	34	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000853862174	EE	On-Demand	Clean	CYP2C9	19	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000853862174	EE	On-Demand	Clean	STAT6	33	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000853862174	EE	On-Demand	Clean	ACHP_LYMST	25	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1	ZINC000853862174	EE	On-Demand	Clean	NAMPT	124	59
O=C(NCCc1ccncc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853862177	FD	On-Demand	Anodyne	SIGMAR1	17	42
O=C(NCCc1ccncc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853862177	FD	On-Demand	Anodyne	CCR3	24	41
O=C(NCCc1ccncc1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853862177	FD	On-Demand	Anodyne	MCHR1	23	40
O=C(NCCc1ccncc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853862179	FD	On-Demand	Anodyne	SIGMAR1	17	42
O=C(NCCc1ccncc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853862179	FD	On-Demand	Anodyne	CCR3	24	41
O=C(NCCc1ccncc1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853862179	FD	On-Demand	Anodyne	MCHR1	23	40
O=C(NCCc1ccncc1)NCc1cccnc1N1CCCC1	ZINC000853862181	EE	On-Demand	Anodyne	SCN2A	20	49
O=C(NCCc1ccncc1)NCc1cccnc1N1CCCC1	ZINC000853862181	EE	On-Demand	Anodyne	SCN10A	27	49
O=C(NCCc1ccncc1)NCc1cccnc1N1CCCC1	ZINC000853862181	EE	On-Demand	Anodyne	GPBAR1	15	44
O=C(NCCc1ccncc1)NCc1cccnc1N1CCCC1	ZINC000853862181	EE	On-Demand	Anodyne	NAMPT	26	40
COc1ncccc1NC(=O)NCC12CC(CN1C(=O)OC(C)(C)C)C2	ZINC000853862204	FF	On-Demand	Anodyne	P2RY1	42	38
COc1cccc(OC)c1CNC(=O)NCCc1ccncc1	ZINC000853862207	DE	On-Demand	Anodyne	CNR2	18	41
COc1cccc(OC)c1CNC(=O)NCCc1ccncc1	ZINC000853862207	DE	On-Demand	Anodyne	ROCK2	18	46
O=C(COC(=O)c1cccc(-n2cnnn2)c1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000853862220	JC	On-Demand	Anodyne	KCNJ1	55	35
O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)c1ccc(Cl)cc1	ZINC000853862237	FF	On-Demand	Clean	DRD4	16	41
O=C(NCCc1ccncc1)NCCS(=O)(=O)CC(F)(F)F	ZINC000853862253	EC	On-Demand	Anodyne	CA5B	17	45
O=C(NCCc1ccncc1)NCCS(=O)(=O)CC(F)(F)F	ZINC000853862253	EC	On-Demand	Anodyne	CA5A	15	45
CS(=O)(=O)C1CN(C(=O)NCCc2ccncc2)C1	ZINC000853862255	CC	On-Demand	Anodyne	CA5B	17	44
CS(=O)(=O)C1CN(C(=O)NCCc2ccncc2)C1	ZINC000853862255	CC	On-Demand	Anodyne	CA5A	15	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)cc1	ZINC000853862257	EG	On-Demand	Clean	CCR3	91	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)cc1	ZINC000853862257	EG	On-Demand	Clean	EPHX2	42	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)cc1	ZINC000853862257	EG	On-Demand	Clean	NAMPT	46	42
O=C(Nc1ccc(Cl)nc1)N1CCC2(COC2)C1	ZINC000853862291	CD	On-Demand	Anodyne	EPHX2	37	42
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc(-c3ncon3)cc1)C2	ZINC000853862306	GG	On-Demand	Anodyne	MTOR	94	40
CN1CCN(c2ccccc2NC(=O)Nc2cccc(-c3cn(C)nn3)c2)CC1	ZINC000853862321	GF	On-Demand	Anodyne	HTR1D	22	40
CN1CCN(c2ccccc2NC(=O)Nc2cccc(-c3cn(C)nn3)c2)CC1	ZINC000853862321	GF	On-Demand	Anodyne	HTR1B	34	40
CN1CCN(c2ccccc2NC(=O)Nc2cccc(-c3cn(C)nn3)c2)CC1	ZINC000853862321	GF	On-Demand	Anodyne	KCNQ2	70	36
CN1CCN(c2ccccc2NC(=O)Nc2cccc(-c3cn(C)nn3)c2)CC1	ZINC000853862321	GF	On-Demand	Anodyne	CCKBR	51	41
CN1CCN(c2ccccc2NC(=O)Nc2cccc(-c3cn(C)nn3)c2)CC1	ZINC000853862321	GF	On-Demand	Anodyne	FLT3	27	48
CN1CCN(c2ccccc2NC(=O)N2CC[C@](C)(C#N)C2)CC1	ZINC000853862326	EE	On-Demand	Mild	KCNQ2	69	37
CN1CCN(c2ccccc2NC(=O)N2CC[C@@](C)(C#N)C2)CC1	ZINC000853862327	EE	On-Demand	Mild	KCNQ2	69	37
COC(=O)c1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853862329	GF	On-Demand	Anodyne	EPHX2	31	52
COC(=O)c1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853862329	GF	On-Demand	Anodyne	HIF1A	15	45
Cn1ccnc1C(=O)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853862336	DE	On-Demand	Anodyne	ACACA	47	39
Cn1ccnc1C(=O)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853862336	DE	On-Demand	Anodyne	SCD1	16	40
O=C(NCC1SCCS1)Nc1ccc(Cl)cc1	ZINC000853862341	CG	On-Demand	Anodyne	EPHX2	33	47
O=C(NCC1SCCS1)Nc1cccnc1Cl	ZINC000853862342	CF	On-Demand	Anodyne	G2YM83_BOTF4	72	38
O=C(c1nc(Br)cs1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853862360	GH	On-Demand	Anodyne	ACACA	52	35
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](Oc3ccccc3)C2)CC1	ZINC000853862363	GG	On-Demand	Anodyne	HTR1A	18	43
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](Oc3ccccc3)C2)CC1	ZINC000853862363	GG	On-Demand	Anodyne	HTR1B	18	43
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](Oc3ccccc3)C2)CC1	ZINC000853862363	GG	On-Demand	Anodyne	HTR7	21	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](Oc3ccccc3)C2)CC1	ZINC000853862363	GG	On-Demand	Anodyne	KCNQ2	72	41
CN1CCN(c2ccccc2NC(=O)N2CC[C@@H](Oc3ccccc3)C2)CC1	ZINC000853862363	GG	On-Demand	Anodyne	EPHX2	21	44
O=C(NCC1SCCS1)Nc1nc2c(s1)CCC2	ZINC000853862364	DF	On-Demand	Anodyne	SLC27A1	31	40
O=C(N1CCCC1)N1CCC(c2ccon2)CC1	ZINC000853862365	BE	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NCC1SCCS1)Nc1ccc(N2CCCC2)nc1	ZINC000853862376	DF	On-Demand	Anodyne	DGAT1	41	41
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA2	63	58
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA1	57	48
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA7	42	35
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA5B	60	35
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA4	59	53
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA5A	64	35
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	EPHX2	22	42
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA12	43	58
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	CA9	45	58
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	TTK	21	40
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	NCE103	32	40
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	MTCA1	46	42
NS(=O)(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853862408	ED	On-Demand	Anodyne	P96878_MYCTU	57	42
O=C(NCC1SCCS1)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000853862418	FH	On-Demand	Anodyne	DDR2	17	42
C[C@H]1CN(Cc2ccccc2)C[C@H](C)C1NC(=O)NNC(=O)c1cccc(F)n1	ZINC000853862419	GE	On-Demand	Reactive	DRD4	21	41
C[C@@H]1CN(Cc2ccccc2)C[C@@H](C)C1NC(=O)NNC(=O)c1cccc(F)n1	ZINC000853862420	GE	On-Demand	Reactive	DRD4	21	41
C[C@H]1CN(Cc2ccccc2)C[C@@H](C)[C@@H]1NC(=O)NNC(=O)c1cccc(F)n1	ZINC000853862421	GE	On-Demand	Reactive	DRD4	21	41
O=C(N1CCCC1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853862422	DG	On-Demand	Anodyne	SCD	19	42
O=C(N1CCCC1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853862422	DG	On-Demand	Anodyne	TRPM8	21	55
O=C(N[C@H](CO)c1cccc(Cl)c1Cl)N1CCCCC1	ZINC000853862425	DG	On-Demand	Anodyne	DPP7	45	37
O=C(N[C@@H](CO)c1cccc(Cl)c1Cl)N1CCCCC1	ZINC000853862426	DG	On-Demand	Anodyne	DPP7	45	37
O=C(NCC1SCCS1)Nc1cccc(Cl)c1	ZINC000853862433	CG	On-Demand	Anodyne	PPIA	16	42
O=C(NCC1SCCS1)Nc1cccc(Cl)c1	ZINC000853862433	CG	On-Demand	Anodyne	EPHX2	32	64
O=C(NCC1SCCS1)Nc1cccc(Cl)c1	ZINC000853862433	CG	On-Demand	Anodyne	MCHR1	15	40
COC(=O)N(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862434	FF	On-Demand	Anodyne	HRH2	26	40
COC(=O)N(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862434	FF	On-Demand	Anodyne	MTNR1A	55	44
COC(=O)N(C)CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853862434	FF	On-Demand	Anodyne	MTNR1B	39	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCC1	ZINC000853862443	DD	On-Demand	Clean	EPHX2	18	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCC1	ZINC000853862443	DD	On-Demand	Clean	L3MBTL3	54	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCC1	ZINC000853862443	DD	On-Demand	Clean	NAMPT	31	45
O=C(NCCc1ccncc1)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853862445	FG	On-Demand	Anodyne	CCR3	18	40
O=C(NCCc1ccncc1)NC[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853862445	FG	On-Demand	Anodyne	GPBAR1	21	46
O=C(NCCc1ccncc1)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853862446	FG	On-Demand	Anodyne	CCR3	18	40
O=C(NCCc1ccncc1)NC[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853862446	FG	On-Demand	Anodyne	GPBAR1	21	46
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(F)cc(F)c1	ZINC000853862448	FG	On-Demand	Clean	CCR3	93	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(F)cc(F)c1	ZINC000853862448	FG	On-Demand	Clean	STAT6	40	34
CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853862449	FG	On-Demand	Clean	CCR3	77	50
CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853862449	FG	On-Demand	Clean	ROCK2	15	42
CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853862449	FG	On-Demand	Clean	EPHX2	36	46
CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853862449	FG	On-Demand	Clean	MCHR1	25	40
CCCn1nccc1NC(=O)NCC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000853862468	FG	On-Demand	Anodyne	CTSK	19	45
CCC(=O)N1CC[C@@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853862476	EB	On-Demand	Anodyne	EPHX2	15	47
CCC(=O)N1CC[C@H](NC(=O)NCCc2nnc(S)n2C)C1	ZINC000853862477	EB	On-Demand	Anodyne	EPHX2	15	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2c(s1)CCC2	ZINC000853862487	FF	On-Demand	Clean	SLC27A1	56	54
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc(C#N)cc1)C2	ZINC000853862492	FG	On-Demand	Mild	EPHX2	17	41
CCC(=O)N1CC[C@H](NC(=O)NCc2ccc([Si](C)(C)C)cc2)C1	ZINC000853862504	EE	On-Demand	Anodyne	EPHX2	35	50
CCC(=O)N1CC[C@@H](NC(=O)NCc2ccc([Si](C)(C)C)cc2)C1	ZINC000853862505	EE	On-Demand	Anodyne	EPHX2	35	50
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc2ccccc12	ZINC000853862507	GI	On-Demand	Clean	TRPV1	35	54
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853862509	ED	On-Demand	Reactive	EPHX2	21	40
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853862510	FI	On-Demand	Mild	NPY2R	66	35
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853862511	ED	On-Demand	Reactive	EPHX2	21	40
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853862512	FI	On-Demand	Mild	NPY2R	66	35
CCC(=O)N1CC[C@@H](NC(=O)NNc2cc(C#N)ccc2Br)C1	ZINC000853862513	GD	On-Demand	Reactive	EPHX2	18	44
CCC(=O)N1CC[C@H](NC(=O)NNc2cc(C#N)ccc2Br)C1	ZINC000853862514	GD	On-Demand	Reactive	EPHX2	18	44
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853862515	FI	On-Demand	Mild	NPY2R	66	35
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2c(s1)CCCC2	ZINC000853862516	GG	On-Demand	Clean	SLC27A1	56	55
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(Cl)cc2Br)C1	ZINC000853862520	GF	On-Demand	Reactive	EPHX2	28	52
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(Cl)cc2Br)C1	ZINC000853862522	GF	On-Demand	Reactive	EPHX2	28	52
CCC(=O)N1CC[C@H](NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)C1	ZINC000853862535	GF	On-Demand	Anodyne	CCR1	54	39
CCC(=O)N1CC[C@H](NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)C1	ZINC000853862535	GF	On-Demand	Anodyne	EPHX2	22	53
CCC(=O)N1CC[C@H](NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000853862537	GF	On-Demand	Anodyne	CCR1	54	39
CCC(=O)N1CC[C@H](NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000853862537	GF	On-Demand	Anodyne	EPHX2	22	53
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)C1	ZINC000853862538	GF	On-Demand	Anodyne	CCR1	54	39
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)C1	ZINC000853862538	GF	On-Demand	Anodyne	EPHX2	22	53
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000853862539	GF	On-Demand	Anodyne	CCR1	54	39
CCC(=O)N1CC[C@H](NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)C1	ZINC000853862539	GF	On-Demand	Anodyne	EPHX2	22	53
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000853862542	FF	On-Demand	Clean	CACNA1C	51	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000853862542	FF	On-Demand	Clean	CACNA1D	82	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000853862542	FF	On-Demand	Clean	CCR3	44	52
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000853862542	FF	On-Demand	Clean	EPHX2	16	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000853862542	FF	On-Demand	Clean	PRMT3	18	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1C(F)(F)F	ZINC000853862548	GH	On-Demand	Clean	TRPV1	28	45
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1C(F)(F)F	ZINC000853862548	GH	On-Demand	Clean	CCR3	18	50
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1C(F)(F)F	ZINC000853862548	GH	On-Demand	Clean	EPHX2	19	46
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1C(F)(F)F	ZINC000853862548	GH	On-Demand	Clean	RBP4	83	38
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1C(F)(F)F	ZINC000853862548	GH	On-Demand	Clean	SCD1	25	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1C(F)(F)F	ZINC000853862548	GH	On-Demand	Clean	SCD	30	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(Cl)ccc1Cl	ZINC000853862574	GI	On-Demand	Clean	P2RX7	26	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(Cl)ccc1Cl	ZINC000853862574	GI	On-Demand	Clean	RPA1	41	32
N#Cc1cc(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c[nH]1	ZINC000853862578	DD	On-Demand	Mild	NAMPT	22	42
O=C(NC/C=C/CO)NCCc1ccncc1	ZINC000853862584	BC	On-Demand	Anodyne	CA5B	17	44
O=C(NC/C=C/CO)NCCc1ccncc1	ZINC000853862584	BC	On-Demand	Anodyne	CA5A	15	44
O=C(NC/C=C\CO)NCCc1ccncc1	ZINC000853862585	BC	On-Demand	Anodyne	CA5B	17	44
O=C(NC/C=C\CO)NCCc1ccncc1	ZINC000853862585	BC	On-Demand	Anodyne	CA5A	15	44
CC(=O)c1ccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)cc1	ZINC000853862600	FG	On-Demand	Anodyne	EPHX2	27	46
O=C(N1CCC2(COC2)C1)C(F)(F)c1ccccc1F	ZINC000853862620	CE	On-Demand	Anodyne	EPHX2	22	41
O=C(COC(=O)c1cccc(-n2cnnn2)c1)NCc1ccc(C(=O)N2CCCC2)cc1	ZINC000853862621	ID	On-Demand	Anodyne	KCNJ1	54	35
COc1ncccc1NC(=O)NCC1SCCS1	ZINC000853862645	CE	On-Demand	Anodyne	P2RY1	43	38
CC(C)(C)OC(=O)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853862647	CE	On-Demand	Anodyne	CHRM2	19	42
CC(C)(C)OC(=O)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853862647	CE	On-Demand	Anodyne	CHRM3	30	47
CC(C)(C)OC(=O)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853862647	CE	On-Demand	Anodyne	EPHX2	20	44
CC(C)(C)OC(=O)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853862647	CE	On-Demand	Anodyne	GPR119	33	41
O=C(N1CCCCC1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853862658	DG	On-Demand	Anodyne	SCD	18	41
O=C(N1CCCCC1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853862658	DG	On-Demand	Anodyne	TRPM8	19	54
O=C(NCC1SCCS1)Nc1nccs1	ZINC000853862664	CE	On-Demand	Anodyne	MAP1	125	40
Cc1nc(NC(=O)N2CC[C@@H](CN3CCCC3=O)C2)sc1-c1ccccc1	ZINC000853862674	GH	On-Demand	Anodyne	PIK3CG	16	44
Cc1nc(NC(=O)N2CC[C@H](CN3CCCC3=O)C2)sc1-c1ccccc1	ZINC000853862675	GH	On-Demand	Anodyne	PIK3CG	16	44
Cc1nsc(C(=O)N2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853862688	EF	On-Demand	Anodyne	ACACA	66	38
Cc1nsc(C(=O)N2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853862688	EF	On-Demand	Anodyne	ACACB	42	37
CN1CCN(c2ccccc2NC(=O)N2CCC(c3ccon3)CC2)CC1	ZINC000853862701	FF	On-Demand	Anodyne	KCNQ2	67	37
CN1CCN(c2ccccc2NC(=O)N2CCC(c3ccon3)CC2)CC1	ZINC000853862701	FF	On-Demand	Anodyne	SMO	43	44
Cc1nc(C(=O)N2CC[C@H](c3ccccc3)[C@H](NC(=O)C(F)(F)F)C2)no1	ZINC000853862712	GE	On-Demand	Anodyne	EPHX2	16	42
O=C(NCC1SCCS1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853862715	DD	On-Demand	Anodyne	CASP2	18	43
O=C(NCC1SCCS1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853862715	DD	On-Demand	Anodyne	CASP6	15	43
O=C(NCC1SCCS1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853862715	DD	On-Demand	Anodyne	PRMT3	58	33
Cn1ccnc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853862737	DD	On-Demand	Clean	NAMPT	44	42
O=C(N1CCOCC1)N1CCOc2ccc(O)cc2C1	ZINC000853862740	CD	On-Demand	Anodyne	AKR1C3	20	45
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000853862741	FE	On-Demand	Anodyne	EPHX2	27	41
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000853862742	FE	On-Demand	Anodyne	EPHX2	27	41
O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853862743	FE	On-Demand	Anodyne	EPHX2	27	41
O=C(N[C@@H]1CCN(C(=O)C2CCCC2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853862744	FE	On-Demand	Anodyne	EPHX2	27	41
O=C(NCCc1ccncc1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853862749	FF	On-Demand	Anodyne	GPBAR1	24	48
O=C(NCCc1ccncc1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853862750	FF	On-Demand	Anodyne	GPBAR1	24	48
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc(Cl)c1	ZINC000853862758	FH	On-Demand	Clean	NPY1R	17	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc(Cl)c1	ZINC000853862758	FH	On-Demand	Clean	CCR3	61	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc(Cl)c1	ZINC000853862758	FH	On-Demand	Clean	EPHX2	47	52
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc(Cl)c1	ZINC000853862758	FH	On-Demand	Clean	MCHR1	41	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc(Cl)c1	ZINC000853862758	FH	On-Demand	Clean	CACNA1I	15	45
COc1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853862759	FF	On-Demand	Clean	HTR1A	32	41
COc1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853862759	FF	On-Demand	Clean	DRD2	30	41
COc1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853862759	FF	On-Demand	Clean	ADRA1D	17	41
COc1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853862759	FF	On-Demand	Clean	CCR3	33	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ncc(Br)s1	ZINC000853862761	GF	On-Demand	Clean	STAT6	22	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ncc(Br)s1	ZINC000853862761	GF	On-Demand	Clean	NAMPT	36	41
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)c3cccc(-n4cnnn4)c3)CC2)cc1	ZINC000853862762	JD	On-Demand	Anodyne	TRY2_BOVIN	41	41
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)c3cccc(-n4cnnn4)c3)CC2)cc1	ZINC000853862763	JD	On-Demand	Anodyne	TRY2_BOVIN	41	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCCC1	ZINC000853862764	DE	On-Demand	Clean	EPHX2	17	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCCC1	ZINC000853862764	DE	On-Demand	Clean	DPP7	46	35
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCCC1	ZINC000853862764	DE	On-Demand	Clean	L3MBTL3	54	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCCCC1	ZINC000853862764	DE	On-Demand	Clean	NAMPT	35	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(Cl)c1	ZINC000853862765	GH	On-Demand	Clean	NPY2R	50	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(Cl)c1	ZINC000853862765	GH	On-Demand	Clean	CCR3	48	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(Cl)c1	ZINC000853862765	GH	On-Demand	Clean	F2R	42	33
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(Cl)c1	ZINC000853862765	GH	On-Demand	Clean	EPHX2	38	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(Cl)c1	ZINC000853862765	GH	On-Demand	Clean	ERBB4	43	33
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(Cl)c1	ZINC000853862765	GH	On-Demand	Clean	MCHR1	43	43
CCC(=O)N1CC[C@H](NC(=O)N2CC(O)(c3ccc(Br)cc3)C2)C1	ZINC000853862766	GD	On-Demand	Anodyne	EPHX2	15	52
CCC(=O)N1CC[C@@H](NC(=O)N2CC(O)(c3ccc(Br)cc3)C2)C1	ZINC000853862767	GD	On-Demand	Anodyne	EPHX2	15	52
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(F)ccc1F	ZINC000853862776	FG	On-Demand	Clean	CCR3	64	36
O=C(NCC1(O)CCC(F)(F)CC1)Nc1cccnc1Cl	ZINC000853862795	DF	On-Demand	Anodyne	G2YM83_BOTF4	72	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1Cl	ZINC000853862797	GI	On-Demand	Clean	F10	18	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1Cl	ZINC000853862797	GI	On-Demand	Clean	P2RX7	26	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1Cl	ZINC000853862797	GI	On-Demand	Clean	EPHX2	22	42
CC(=O)c1cccc(NC(=O)NCC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000853862804	GH	On-Demand	Anodyne	CCKAR	16	45
CC(=O)c1cccc(NC(=O)NCC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1	ZINC000853862804	GH	On-Demand	Anodyne	CCR3	23	44
CS(=O)(=O)CC1(CCNC(=O)NCCc2ccncc2)CC1	ZINC000853862810	ED	On-Demand	Anodyne	CA5B	16	43
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccnc1Cl	ZINC000853862819	CG	On-Demand	Mild	G2YM83_BOTF4	71	40
CCC(=O)N1CC[C@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853862820	FF	On-Demand	Reactive	EPHX2	18	47
CCC(=O)N1CC[C@@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)C1	ZINC000853862823	FF	On-Demand	Reactive	EPHX2	18	47
CCC(=O)N1CC[C@H](NC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853862841	DD	On-Demand	Anodyne	EPHX2	35	54
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853862843	DD	On-Demand	Anodyne	EPHX2	35	54
CCC(=O)N1CC[C@H](NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853862845	DD	On-Demand	Anodyne	EPHX2	35	54
CCC(=O)N1CC[C@H](NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853862847	DD	On-Demand	Anodyne	EPHX2	35	54
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1Cl	ZINC000853862851	FG	On-Demand	Clean	NAMPT	40	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1Cl	ZINC000853862851	FG	On-Demand	Clean	G2YM83_BOTF4	67	34
O=C(Nc1ccc(O[C@H]2CC2(F)F)cc1)Nc1cccc(N2CCOC2=O)c1	ZINC000853862854	GI	On-Demand	Anodyne	EPHX2	44	38
O=C(Nc1ccc(O[C@@H]2CC2(F)F)cc1)Nc1cccc(N2CCOC2=O)c1	ZINC000853862856	GI	On-Demand	Anodyne	EPHX2	44	38
C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C[C@@H](C)O1	ZINC000853862864	ED	On-Demand	Clean	NPSR1	26	40
C[C@@H]1CN(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)C[C@@H](C)O1	ZINC000853862864	ED	On-Demand	Clean	NAMPT	20	41
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1cccc(-n2cnnn2)c1	ZINC000853862879	JG	On-Demand	Anodyne	KCNK3	84	37
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1cccc(-n2cnnn2)c1	ZINC000853862879	JG	On-Demand	Anodyne	KCNK9	48	34
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853862898	EF	On-Demand	Clean	GRM5	15	41
Cc1nc(C(=O)N2CCC3(CCc4ccccc4O3)CC2)no1	ZINC000853862937	DE	On-Demand	Anodyne	ACACA	62	37
COC(=O)c1sc(N2CC(Cc3ccc(C)cc3)C2)nc1Cl	ZINC000853862949	EH	On-Demand	Anodyne	PARE	67	31
O=C(c1nc(Br)cs1)N1CCC(c2ccon2)CC1	ZINC000853862950	EF	On-Demand	Anodyne	ETHR	46	33
C#C[C@H](NC(=O)NCCCOc1ccc2ccccc2c1)C1CCOCC1	ZINC000853862956	FG	On-Demand	Mild	MTNR1A	25	40
C#C[C@@H](NC(=O)NCCCOc1ccc2ccccc2c1)C1CCOCC1	ZINC000853862957	FG	On-Demand	Mild	MTNR1A	25	40
Cc1nc(NC(=O)N2CCC(c3ccon3)CC2)sc1-c1ccccc1	ZINC000853862964	FJ	On-Demand	Anodyne	PIK3CG	21	46
Cc1nc(NC(=O)N2CCC(c3ccon3)CC2)sc1-c1ccccc1	ZINC000853862964	FJ	On-Demand	Anodyne	SMO	40	42
O=C(NCC1SCCS1)Nc1ncc(Cc2ccccc2)s1	ZINC000853862980	FH	On-Demand	Anodyne	CDK5	49	44
O=C(NCC1SCCS1)Nc1ncc(Cc2ccccc2)s1	ZINC000853862980	FH	On-Demand	Anodyne	MGEA5	33	40
O=C(NCC1SCCS1)Nc1ccc(F)cc1	ZINC000853863020	CF	On-Demand	Anodyne	EPHX2	35	45
O=C(NCC1SCCS1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853863029	CF	On-Demand	Bother	NMBR	54	32
O=C(NCC1SCCS1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853863029	CF	On-Demand	Bother	PRMT3	24	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cn1	ZINC000853863043	FG	On-Demand	Clean	F10	49	33
Cc1cc(C)cc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863044	FH	On-Demand	Clean	CCR3	48	36
COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863045	GF	On-Demand	Clean	NPY1R	30	44
COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863045	GF	On-Demand	Clean	CCR3	74	45
COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863045	GF	On-Demand	Clean	ROCK2	23	41
COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863045	GF	On-Demand	Clean	EPHX2	42	48
COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863045	GF	On-Demand	Clean	MCHR1	20	40
CCC(=O)N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853863046	DD	On-Demand	Reactive	EPHX2	28	43
CCC(=O)N1CC[C@@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853863046	DD	On-Demand	Reactive	CCR8	40	38
CCC(=O)N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853863047	DD	On-Demand	Reactive	EPHX2	28	43
CCC(=O)N1CC[C@H](NC(=O)NNc2cc(F)ccc2C)C1	ZINC000853863047	DD	On-Demand	Reactive	CCR8	40	38
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863048	GF	On-Demand	Clean	NPY1R	24	40
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863048	GF	On-Demand	Clean	CCR3	77	41
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863048	GF	On-Demand	Clean	ROCK2	16	40
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863048	GF	On-Demand	Clean	MCHR1	35	41
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863048	GF	On-Demand	Clean	NAMPT	40	38
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1nc2cccnc2s1	ZINC000853863056	FF	On-Demand	Clean	STAT6	20	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1nc2cccnc2s1	ZINC000853863056	FF	On-Demand	Clean	NAMPT	46	42
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	HTR1A	19	50
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	DRD4	50	42
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	HRH2	20	47
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	MMP13	24	42
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	NPY1R	30	41
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	CCKAR	20	40
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	CCR3	91	52
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	ROCK1	28	41
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	MTNR1A	39	42
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	MTNR1B	43	42
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	ROCK2	43	49
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	SOAT1	21	48
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	CCKBR	23	41
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	EPHX2	46	47
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	FLT4	18	49
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	FLT3	15	49
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	MCHR1	39	46
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	TAAR1	38	42
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	LIMK2	27	42
COc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863073	FF	On-Demand	Clean	NAMPT	41	38
C[C@@]1(C#N)CCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853863081	EE	On-Demand	Mild	CACNA1C	43	35
C[C@@]1(C#N)CCN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)C1	ZINC000853863081	EE	On-Demand	Mild	CACNA1D	67	35
Cc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863088	EH	On-Demand	Anodyne	CCKAR	34	45
Cc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863088	EH	On-Demand	Anodyne	CCKBR	52	45
Cc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863088	EH	On-Demand	Anodyne	EPHX2	28	47
Cc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863088	EH	On-Demand	Anodyne	KCNK3	49	34
O=C1CCCN1C[C@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853863092	DE	On-Demand	Anodyne	G2YM83_BOTF4	66	36
O=C1CCCN1C[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C1	ZINC000853863094	DE	On-Demand	Anodyne	G2YM83_BOTF4	66	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cnns1	ZINC000853863104	DD	On-Demand	Clean	NAMPT	35	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1cc([N+](=O)[O-])c[nH]1	ZINC000853863111	ED	On-Demand	Clean	NAMPT	37	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCc2sccc2C1	ZINC000853863114	FF	On-Demand	Clean	NAMPT	25	48
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	F10	19	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	P2RX7	18	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	CCR3	19	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	MTOR	37	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	EPHX2	52	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	DPP7	27	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	MCHR1	17	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	STAT6	21	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)cc1	ZINC000853863124	FH	On-Demand	Clean	NAMPT	45	43
Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863132	CF	On-Demand	Anodyne	CCKAR	26	51
Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863132	CF	On-Demand	Anodyne	KDR	19	40
Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863132	CF	On-Demand	Anodyne	CCKBR	40	40
Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863132	CF	On-Demand	Anodyne	EPHX2	31	55
Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863132	CF	On-Demand	Anodyne	KCNK3	66	42
Cc1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863132	CF	On-Demand	Anodyne	KCNK9	51	42
CN1CCN(c2ccccc2NC(=O)N2CCOc3ccc(O)cc3C2)CC1	ZINC000853863139	GF	On-Demand	Anodyne	HTR1B	17	41
CN1CCN(c2ccccc2NC(=O)N2CCOc3ccc(O)cc3C2)CC1	ZINC000853863139	GF	On-Demand	Anodyne	KCNQ2	74	35
C=CCCNC(=O)NCCc1ccncc1	ZINC000853863152	BD	On-Demand	Mild	CA5B	16	45
C=CCCNC(=O)NCCc1ccncc1	ZINC000853863152	BD	On-Demand	Mild	CA5A	15	45
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCc2ccccc2C1	ZINC000853863161	FF	On-Demand	Clean	NAMPT	26	50
O=C(NCC1(O)CCC(F)(F)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853863169	FI	On-Demand	Anodyne	CA1	19	40
O=C(NCC1(O)CCC(F)(F)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853863169	FI	On-Demand	Anodyne	ROCK2	21	48
O=C(NCC1(O)CCC(F)(F)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853863169	FI	On-Demand	Anodyne	EPHX2	17	42
O=C(NCC1(O)CCC(F)(F)CC1)Nc1ccc(-c2ccccc2)cc1	ZINC000853863169	FI	On-Demand	Anodyne	DGAT1	16	40
CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863172	FG	On-Demand	Clean	CCR3	37	48
CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863172	FG	On-Demand	Clean	PRNP	46	38
CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863172	FG	On-Demand	Clean	MTOR	68	37
CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863172	FG	On-Demand	Clean	EPHX2	34	43
CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863172	FG	On-Demand	Clean	NAMPT	42	40
CN(C(=O)NCCc1ccncc1)[C@H](CO)Cc1ccccc1	ZINC000853863185	DD	On-Demand	Anodyne	MME	43	39
CN(C(=O)NCCc1ccncc1)[C@H](CO)Cc1ccccc1	ZINC000853863185	DD	On-Demand	Anodyne	NPY5R	20	42
CN(C(=O)NCCc1ccncc1)[C@H](CO)Cc1ccccc1	ZINC000853863185	DD	On-Demand	Anodyne	AMP1_PLAFQ	33	46
CN(C(=O)NCCc1ccncc1)[C@@H](CO)Cc1ccccc1	ZINC000853863187	DD	On-Demand	Anodyne	MME	43	39
CN(C(=O)NCCc1ccncc1)[C@@H](CO)Cc1ccccc1	ZINC000853863187	DD	On-Demand	Anodyne	NPY5R	20	42
CN(C(=O)NCCc1ccncc1)[C@@H](CO)Cc1ccccc1	ZINC000853863187	DD	On-Demand	Anodyne	AMP1_PLAFQ	33	46
O=C(NC1CC1)C(=O)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853863198	GD	On-Demand	Anodyne	EPHX2	33	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853863202	GH	On-Demand	Clean	TRPV1	23	45
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853863202	GH	On-Demand	Clean	CCR3	17	49
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853863202	GH	On-Demand	Clean	CCR2	40	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853863202	GH	On-Demand	Clean	EPHX2	61	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853863202	GH	On-Demand	Clean	MCHR1	36	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853863202	GH	On-Demand	Clean	TRPM8	51	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853863202	GH	On-Demand	Clean	NAMPT	44	39
CC(C)c1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853863206	FI	On-Demand	Clean	KCNQ2	56	35
CC(C)c1ccccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853863206	FI	On-Demand	Clean	SOAT1	46	43
COc1ncccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853863215	FE	On-Demand	Clean	P2RY1	41	43
COc1ncccc1NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853863215	FE	On-Demand	Clean	NAMPT	47	37
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(Cl)cc(Cl)c1	ZINC000853863217	GI	On-Demand	Clean	EPHX2	25	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(Cl)cc(Cl)c1	ZINC000853863217	GI	On-Demand	Clean	MCHR1	21	46
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cc(Cl)cc(Cl)c1	ZINC000853863217	GI	On-Demand	Clean	CACNA1I	49	35
O=C(NCc1ccc(N2CCC(O)CC2)cc1)C(=O)c1ccc(F)cc1	ZINC000853863243	FE	On-Demand	Clean	SSTR3	21	43
O=C(NCC1SCCS1)Nc1nc2ccccc2s1	ZINC000853863248	DG	On-Demand	Anodyne	LCK	28	41
O=C(NCC1SCCS1)Nc1nc2ccccc2s1	ZINC000853863248	DG	On-Demand	Anodyne	CSNK1D	42	52
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc2c(c1)OCCO2	ZINC000853863249	GF	On-Demand	Clean	NOS2	83	34
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc2c(c1)OCCO2	ZINC000853863249	GF	On-Demand	Clean	EPHX2	18	42
O=C1CCCN1C[C@H]1CCN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000853863258	GE	On-Demand	Bother	SLC27A4	41	30
CCC(=O)N1CC[C@H](NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)C1	ZINC000853863260	GE	On-Demand	Anodyne	EPHX2	19	43
O=C1CCCN1C[C@@H]1CCN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)C1	ZINC000853863261	GE	On-Demand	Bother	SLC27A4	41	30
CCC(=O)N1CC[C@@H](NC(=O)NCC2(NC(=O)OC(C)(C)C)CCCC2)C1	ZINC000853863263	GE	On-Demand	Anodyne	EPHX2	19	43
Cc1nc(NC(=O)NCC2SCCS2)sc1-c1ccccc1	ZINC000853863264	FI	On-Demand	Anodyne	PIK3CG	22	45
Cc1nc(NC(=O)NCC2SCCS2)sc1-c1ccccc1	ZINC000853863264	FI	On-Demand	Anodyne	PI4KB	42	42
Cc1cccc(NC(=O)N2CC[C@H]2c2ccc(Br)cc2)n1	ZINC000853863281	EI	On-Demand	Anodyne	GRM5	16	43
Cc1cccc(NC(=O)N2CC[C@H]2c2ccc(Br)cc2)n1	ZINC000853863281	EI	On-Demand	Anodyne	SORT1	22	47
Cc1cccc(NC(=O)N2CC[C@@H]2c2ccc(Br)cc2)n1	ZINC000853863284	EI	On-Demand	Anodyne	GRM5	16	43
Cc1cccc(NC(=O)N2CC[C@@H]2c2ccc(Br)cc2)n1	ZINC000853863284	EI	On-Demand	Anodyne	SORT1	22	47
Cc1nc(NC(=O)N2CC[C@@](C)(C#N)C2)sc1-c1ccccc1	ZINC000853863285	EH	On-Demand	Mild	PIK3CG	17	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc2c(c1)OCO2	ZINC000853863286	FF	On-Demand	Clean	NOS2	99	38
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc2c(c1)OCO2	ZINC000853863286	FF	On-Demand	Clean	MCHR1	22	46
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc2cccnc12	ZINC000853863290	GH	On-Demand	Clean	WNT3	18	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccc2cccnc12	ZINC000853863290	GH	On-Demand	Clean	TNKS	15	44
Cc1nc(NC(=O)N2CC[C@](C)(C#N)C2)sc1-c1ccccc1	ZINC000853863294	EH	On-Demand	Mild	PIK3CG	17	43
COc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863297	FG	On-Demand	Anodyne	DRD4	41	31
COc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863297	FG	On-Demand	Anodyne	CCKAR	15	47
COc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863297	FG	On-Demand	Anodyne	CCR3	30	45
COc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863297	FG	On-Demand	Anodyne	MTNR1A	34	40
COc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863297	FG	On-Demand	Anodyne	MTNR1B	37	41
COc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863297	FG	On-Demand	Anodyne	CCKBR	15	47
COc1cccc(NC(=O)NCC23CC(CN2C(=O)OC(C)(C)C)C3)c1	ZINC000853863297	FG	On-Demand	Anodyne	EPHX2	36	51
O=C(N1CCCCC1)N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853863317	GG	On-Demand	Anodyne	EPHX2	22	42
O=C(NCC1SCCS1)Nc1cccc2ccccc12	ZINC000853863321	DH	On-Demand	Anodyne	TRPV1	30	46
C[C@H]1CN(c2ccc(NC(=O)N3CCC4(COC4)C3)cc2F)C[C@H](C)O1	ZINC000853863332	FF	On-Demand	Anodyne	CACNA1H	40	39
C[C@H]1CN(c2ccc(NC(=O)N3CCC4(COC4)C3)cc2F)C[C@H](C)O1	ZINC000853863332	FF	On-Demand	Anodyne	NPY2R	62	35
C[C@H]1CN(c2ccc(NC(=O)N3CCC4(COC4)C3)cc2F)C[C@H](C)O1	ZINC000853863332	FF	On-Demand	Anodyne	EPHX2	32	40
C[C@H]1CN(c2ccc(NC(=O)N3CCC4(COC4)C3)cc2F)C[C@@H](C)O1	ZINC000853863334	FF	On-Demand	Anodyne	CACNA1H	40	39
C[C@H]1CN(c2ccc(NC(=O)N3CCC4(COC4)C3)cc2F)C[C@@H](C)O1	ZINC000853863334	FF	On-Demand	Anodyne	NPY2R	62	35
C[C@H]1CN(c2ccc(NC(=O)N3CCC4(COC4)C3)cc2F)C[C@@H](C)O1	ZINC000853863334	FF	On-Demand	Anodyne	EPHX2	32	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccn1	ZINC000853863336	EE	On-Demand	Clean	STAT6	17	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccn1	ZINC000853863336	EE	On-Demand	Clean	NAMPT	47	37
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2cccc(-n3cnnn3)c2)c1	ZINC000853863345	GD	On-Demand	Anodyne	KCNK3	48	32
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2cccc(-n3cnnn3)c2)c1	ZINC000853863347	GD	On-Demand	Anodyne	KCNK3	48	32
Cn1cc(C#N)cc1C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853863348	ED	On-Demand	Mild	CSF1R	25	40
O=C(NCCc1ccncc1)N1CCc2nc(-c3ccccc3)sc2C1	ZINC000853863361	FH	On-Demand	Anodyne	P2RY14	49	37
O=C(COC(=O)c1cccc(-n2cnnn2)c1)Nc1ccc(N2CCCCC2)nc1	ZINC000853863362	HD	On-Demand	Anodyne	DGAT1	37	41
N#Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863366	FF	On-Demand	Mild	CCR3	58	53
N#Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863366	FF	On-Demand	Mild	MCHR1	53	50
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000853863367	GG	On-Demand	Bother	NMBR	70	37
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C2	ZINC000853863367	GG	On-Demand	Bother	EPHX2	17	42
CC(C)(C)OC(=O)N1CC2CC1(CNC(=O)Nc1cccnc1)C2	ZINC000853863369	EF	On-Demand	Anodyne	NAMPT	48	44
CCC(=O)N1CC[C@H](NC(=O)NCCN(C)OC)C1	ZINC000853863371	CB	On-Demand	Anodyne	EPHX2	24	53
CCC(=O)N1CC[C@@H](NC(=O)NCCN(C)OC)C1	ZINC000853863373	CB	On-Demand	Anodyne	EPHX2	24	53
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000853863377	ED	On-Demand	Anodyne	BIRC2	16	40
Cn1c(S)nnc1[C@H]1CCCN(C(=O)NCCc2ccncc2)C1	ZINC000853863379	ED	On-Demand	Anodyne	BIRC2	16	40
O=C(NCC1(O)CCC(F)(F)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853863383	GF	On-Demand	Bother	CACNA1D	50	35
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2ccccc2s1	ZINC000853863385	GH	On-Demand	Clean	LTA4H	19	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2ccccc2s1	ZINC000853863385	GH	On-Demand	Clean	LCK	20	45
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2ccccc2s1	ZINC000853863385	GH	On-Demand	Clean	CSNK1D	36	46
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2ccccc2s1	ZINC000853863385	GH	On-Demand	Clean	ITK	18	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2ccccc2s1	ZINC000853863385	GH	On-Demand	Clean	STAT6	16	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc2ccccc2s1	ZINC000853863385	GH	On-Demand	Clean	SLC27A1	29	52
CCC(=O)N1CC[C@@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853863389	DD	On-Demand	Reactive	EPHX2	34	48
CCC(=O)N1CC[C@H](NC(=O)NNc2ccc(C)c(F)c2)C1	ZINC000853863391	DD	On-Demand	Reactive	EPHX2	34	48
O=C(N1CCOCC1)C(F)(F)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853863408	FD	On-Demand	Anodyne	ITGAL	65	38
O=C(N1CCOCC1)C(F)(F)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853863408	FD	On-Demand	Anodyne	EPHX2	29	43
O=C(N1CCC2(COC2)C1)C(F)(F)Oc1ccc([N+](=O)[O-])cc1	ZINC000853863424	ED	On-Demand	Bother	EPHX2	30	42
CCC(=O)N1CC[C@@H](NC(=O)NNc2cccc(C(=O)OC)c2C)C1	ZINC000853863436	ED	On-Demand	Reactive	EPHX2	26	45
CCC(=O)N1CC[C@@H](NC(=O)NNc2cccc(C(=O)OC)c2C)C1	ZINC000853863436	ED	On-Demand	Reactive	CCR8	70	40
CCC(=O)N1CC[C@H](NC(=O)NNc2cccc(C(=O)OC)c2C)C1	ZINC000853863437	ED	On-Demand	Reactive	EPHX2	26	45
CCC(=O)N1CC[C@H](NC(=O)NNc2cccc(C(=O)OC)c2C)C1	ZINC000853863437	ED	On-Demand	Reactive	CCR8	70	40
CCC(=O)N1CC[C@@H](NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853863455	FD	On-Demand	Anodyne	EPHX2	24	50
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@](C)(C#N)C3)cc2F)C[C@@H](C)O1	ZINC000853863456	FG	On-Demand	Mild	NPY2R	51	36
CCC(=O)N1CC[C@@H](NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853863458	FD	On-Demand	Anodyne	EPHX2	24	50
C[C@H]1CN(c2ccc(NC(=O)N3CC[C@@](C)(C#N)C3)cc2F)C[C@@H](C)O1	ZINC000853863460	FG	On-Demand	Mild	NPY2R	51	36
CCC(=O)N1CC[C@H](NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853863461	FD	On-Demand	Anodyne	EPHX2	24	50
CCC(=O)N1CC[C@H](NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853863464	FD	On-Demand	Anodyne	EPHX2	24	50
Cn1c(S)nnc1CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853863470	GF	On-Demand	Anodyne	HRH2	25	40
Cn1c(S)nnc1CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853863470	GF	On-Demand	Anodyne	MTNR1A	43	42
Cn1c(S)nnc1CCNC(=O)NCCCOc1ccc2ccccc2c1	ZINC000853863470	GF	On-Demand	Anodyne	MTNR1B	29	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853863477	GD	On-Demand	Clean	CASP2	16	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853863477	GD	On-Demand	Clean	CDK4	21	40
O=C(N1CCOCC1)C(F)(F)C(=O)N1CCC(c2ccon2)CC1	ZINC000853863483	EC	On-Demand	Anodyne	ETHR	62	34
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)cc1F	ZINC000853863513	FG	On-Demand	Clean	CCR3	65	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1F	ZINC000853863514	EG	On-Demand	Clean	KCNQ2	40	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccccc1F	ZINC000853863514	EG	On-Demand	Clean	CCR3	34	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(F)c1	ZINC000853863516	FG	On-Demand	Clean	CCR3	59	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(F)c1	ZINC000853863516	FG	On-Demand	Clean	F2R	40	31
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(F)c1	ZINC000853863516	FG	On-Demand	Clean	EPHX2	29	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(F)c1	ZINC000853863516	FG	On-Demand	Clean	MCHR1	21	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(F)c(F)c1	ZINC000853863516	FG	On-Demand	Clean	PRMT3	45	34
N#Cc1c[nH]c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863537	DD	On-Demand	Mild	CSF1R	27	52
N#Cc1c[nH]c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863537	DD	On-Demand	Mild	AXL	17	52
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA2	152	52
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA1	139	54
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA7	77	45
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA13	24	43
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA5B	65	45
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA4	111	52
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA5A	70	45
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA14	70	45
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	EPHX2	18	40
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA12	116	52
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CA9	116	52
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	CYNT	47	41
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	NCE103	50	52
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	MTCA1	67	54
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	P96878_MYCTU	83	54
NS(=O)(=O)c1ccc(NC(=O)NCC2SCCS2)cc1	ZINC000853863549	ED	On-Demand	Anodyne	NAMPT	40	42
Cc1ccc(CC2CN(c3cc(Cl)nc(N)n3)C2)cc1	ZINC000853863552	CF	On-Demand	Anodyne	HRH4	40	36
O=C(NCC1SCCS1)Nc1ncc(-c2ccccc2)s1	ZINC000853863560	EH	On-Demand	Anodyne	CDK5	45	38
O=C(NCC1SCCS1)Nc1ncc(-c2ccccc2)s1	ZINC000853863560	EH	On-Demand	Anodyne	CHEK1	41	30
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853863561	FF	On-Demand	Clean	NMBR	57	34
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853863561	FF	On-Demand	Clean	EPHX2	15	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853863561	FF	On-Demand	Clean	PRMT3	20	49
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853863561	FF	On-Demand	Clean	NAMPT	46	41
O=C(N1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853863571	CE	On-Demand	Anodyne	CHRM3	24	46
O=C(N1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853863571	CE	On-Demand	Anodyne	HRH3	24	42
O=C(N1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853863571	CE	On-Demand	Anodyne	EPHX2	23	49
O=C(N1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853863571	CE	On-Demand	Anodyne	L3MBTL3	53	37
COC(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863575	DE	On-Demand	Anodyne	CCR3	31	40
COC(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863575	DE	On-Demand	Anodyne	EPHX2	36	59
COC(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863575	DE	On-Demand	Anodyne	HIF1A	15	45
COC(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863575	DE	On-Demand	Anodyne	PRMT3	44	32
COC(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863575	DE	On-Demand	Anodyne	KCNK3	80	35
COC(=O)c1cccc(NC(=O)NCC2SCCS2)c1	ZINC000853863575	DE	On-Demand	Anodyne	KCNK9	52	33
O=C(NCC1SCCS1)Nc1ccccc1Cl	ZINC000853863584	CG	On-Demand	Anodyne	CXCL8	44	41
O=C(NCC1SCCS1)Nc1ccccc1Cl	ZINC000853863584	CG	On-Demand	Anodyne	EPHB3	54	33
O=C(NCC1SCCS1)Nc1ccccc1C(F)(F)F	ZINC000853863609	DH	On-Demand	Anodyne	TRPV1	16	46
O=C(NCC1SCCS1)Nc1ccccc1C(F)(F)F	ZINC000853863609	DH	On-Demand	Anodyne	RBP4	78	37
CCC(=O)N1CC[C@@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853863643	EE	On-Demand	Reactive	EPHX2	29	58
CCC(=O)N1CC[C@H](NC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853863644	EE	On-Demand	Reactive	EPHX2	29	58
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(N2CCCC2)nc1	ZINC000853863647	GF	On-Demand	Clean	STAT6	27	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(N2CCCC2)nc1	ZINC000853863647	GF	On-Demand	Clean	DGAT1	40	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(N2CCCC2)nc1	ZINC000853863647	GF	On-Demand	Clean	NAMPT	56	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nccs1	ZINC000853863652	EE	On-Demand	Clean	MAP1	104	37
O=C(NCCc1ccncc1)NCC1CCN(C2CCOCC2)CC1	ZINC000853863660	ED	On-Demand	Anodyne	NAMPT	17	41
CC(=O)c1c[nH]c(C(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863661	EE	On-Demand	Clean	NAMPT	22	41
CC(C)(C)OC(=O)C(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853863665	ED	On-Demand	Clean	GPR119	16	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(-c2ncon2)cc1	ZINC000853863666	GG	On-Demand	Clean	PIK3CA	53	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(-c2ncon2)cc1	ZINC000853863666	GG	On-Demand	Clean	MTOR	146	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(-c2ncon2)cc1	ZINC000853863666	GG	On-Demand	Clean	PIK3CG	36	40
CN1CCN(c2ccccc2NC(=O)NCC2(O)CCC(F)(F)CC2)CC1	ZINC000853863689	GF	On-Demand	Anodyne	KCNQ2	79	42
COc1cccc(C2(NC(=O)Nc3cccnc3Cl)CCC2)c1	ZINC000853863704	EH	On-Demand	Anodyne	G2YM83_BOTF4	71	37
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000853863708	FF	On-Demand	Reactive	EPHX2	24	40
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000853863709	FF	On-Demand	Reactive	EPHX2	24	40
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	DRD4	30	52
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	ACHE	17	42
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	HRH2	18	42
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	KCNH2	16	43
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	SIGMAR1	30	55
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	SSTR5	64	40
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	CCR3	26	41
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	UTS2R	20	51
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	SLC6A5	31	40
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	EPHX2	19	41
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	MCHR1	50	48
CON(C)CCNC(=O)NC1CCN(Cc2ccc(Br)cc2)CC1	ZINC000853863714	GE	On-Demand	Anodyne	CACNA1G	29	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)nc1	ZINC000853863725	FG	On-Demand	Clean	STAT6	37	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)nc1	ZINC000853863725	FG	On-Demand	Clean	NAMPT	46	48
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCOCC1	ZINC000853863727	DD	On-Demand	Clean	EPHX2	15	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCOCC1	ZINC000853863727	DD	On-Demand	Clean	AKR1C3	15	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCOCC1	ZINC000853863727	DD	On-Demand	Clean	L3MBTL3	32	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N1CCOCC1	ZINC000853863727	DD	On-Demand	Clean	NAMPT	33	44
O=C(Nc1nc2c(s1)CCC2)N1CC[C@H]1c1ccc(Br)cc1	ZINC000853863755	GI	On-Demand	Anodyne	SLC27A1	39	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1N1CCCC1	ZINC000853863768	GF	On-Demand	Clean	KCNQ2	47	34
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1N1CCCC1	ZINC000853863768	GF	On-Demand	Clean	TRPV1	15	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1cccnc1N1CCCC1	ZINC000853863768	GF	On-Demand	Clean	NAMPT	51	40
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000853863773	EE	On-Demand	Clean	F10	16	45
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000853863773	EE	On-Demand	Clean	MTNR1A	29	45
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000853863773	EE	On-Demand	Clean	MTNR1B	20	45
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccncc3)C2)cc1	ZINC000853863773	EE	On-Demand	Clean	MCHR1	17	51
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	TRPV1	17	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	CCR3	42	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	EPHX2	31	47
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	MCHR1	23	42
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	STAT6	22	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	PRMT3	48	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	NAMPT	55	39
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1ccc(Cl)c(Cl)c1	ZINC000853863779	GI	On-Demand	Clean	RPA1	73	37
COc1cccc(C2(NC(=O)Nc3ccccc3N3CCN(C)CC3)CCC2)c1	ZINC000853863785	GH	On-Demand	Anodyne	HTR1A	28	42
COc1cccc(C2(NC(=O)Nc3ccccc3N3CCN(C)CC3)CCC2)c1	ZINC000853863785	GH	On-Demand	Anodyne	DRD4	46	39
COc1cccc(C2(NC(=O)Nc3ccccc3N3CCN(C)CC3)CCC2)c1	ZINC000853863785	GH	On-Demand	Anodyne	HTR1B	20	42
COc1cccc(C2(NC(=O)Nc3ccccc3N3CCN(C)CC3)CCC2)c1	ZINC000853863785	GH	On-Demand	Anodyne	KCNQ2	75	49
COc1cccc(C2(NC(=O)Nc3ccccc3N3CCN(C)CC3)CCC2)c1	ZINC000853863785	GH	On-Demand	Anodyne	SOAT1	18	45
N#Cc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863788	FF	On-Demand	Mild	CCR3	22	48
N#Cc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863788	FF	On-Demand	Mild	EPHX2	19	44
N#Cc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863788	FF	On-Demand	Mild	MCHR1	15	41
N#Cc1ccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853863788	FF	On-Demand	Mild	NAMPT	42	39
O=C(Nc1ccc2nccn2c1)N1CCCCC1	ZINC000853863789	BE	On-Demand	Anodyne	PDGFRB	40	36
O=C(Nc1ccc2nccn2c1)N1CCCCC1	ZINC000853863789	BE	On-Demand	Anodyne	EPHX2	15	46
COc1cccc(C2(NC(=O)Nc3cccc(N4CCOC4=O)c3)CCC2)c1	ZINC000853863793	GH	On-Demand	Anodyne	EPHX2	20	44
Cc1nc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)sc1C	ZINC000853863795	FG	On-Demand	Clean	SLC27A1	27	51
Cc1ccncc1CCNC(=O)NCCc1ccncc1	ZINC000853863796	CD	On-Demand	Anodyne	CA5B	17	45
Cc1ccncc1CCNC(=O)NCCc1ccncc1	ZINC000853863796	CD	On-Demand	Anodyne	CA5A	15	45
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ncn(-c2ccccc2)n1	ZINC000853863801	GE	On-Demand	Clean	HTR1A	16	46
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ncn(-c2ccccc2)n1	ZINC000853863801	GE	On-Demand	Clean	DRD4	18	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)c1ncn(-c2ccccc2)n1	ZINC000853863801	GE	On-Demand	Clean	STAT6	19	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc(C2CC2)cs1	ZINC000853863802	FG	On-Demand	Clean	SPHK2	48	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)Nc1nc(C2CC2)cs1	ZINC000853863802	FG	On-Demand	Clean	SPHK1	42	40
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	KIT	19	40
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	NPY1R	26	41
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	CCKAR	32	44
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	CCR3	80	41
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	KDR	21	40
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	ROCK2	15	41
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	CCKBR	51	42
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	EPHX2	41	47
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	MCHR1	25	40
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	LIMK2	19	41
Cc1cccc(NC(=O)NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853863803	EG	On-Demand	Clean	KCNK3	46	36
Cc1nc(NC(=O)NCC2(O)CCC(F)(F)CC2)sc1-c1ccccc1	ZINC000853863805	GI	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)NCC2(O)CCC(F)(F)CC2)sc1-c1ccccc1	ZINC000853863805	GI	On-Demand	Anodyne	PI4KB	42	40
CCC(=O)N1CC[C@@H](NC(=O)NNc2cccc3c2OC(F)(F)O3)C1	ZINC000853863814	FD	On-Demand	Reactive	EPHX2	22	41
CCC(=O)N1CC[C@H](NC(=O)NNc2cccc3c2OC(F)(F)O3)C1	ZINC000853863815	FD	On-Demand	Reactive	EPHX2	22	41
CC(C)(C)N1CC[C@H](NC(=O)NCCc2ccncc2)C1	ZINC000853863816	CD	On-Demand	Anodyne	BIRC2	20	45
CC(C)(C)N1CC[C@@H](NC(=O)NCCc2ccncc2)C1	ZINC000853863817	CD	On-Demand	Anodyne	BIRC2	20	45
CN(c1ccccc1)[C@@H]1CCN(C(=O)NCCc2ccncc2)C1	ZINC000853863818	DF	On-Demand	Anodyne	OPRM1	18	43
CN(c1ccccc1)[C@@H]1CCN(C(=O)NCCc2ccncc2)C1	ZINC000853863818	DF	On-Demand	Anodyne	OPRD1	21	43
CN(c1ccccc1)[C@@H]1CCN(C(=O)NCCc2ccncc2)C1	ZINC000853863818	DF	On-Demand	Anodyne	MCHR1	21	49
CN(c1ccccc1)[C@H]1CCN(C(=O)NCCc2ccncc2)C1	ZINC000853863819	DF	On-Demand	Anodyne	OPRM1	18	43
CN(c1ccccc1)[C@H]1CCN(C(=O)NCCc2ccncc2)C1	ZINC000853863819	DF	On-Demand	Anodyne	OPRD1	21	43
CN(c1ccccc1)[C@H]1CCN(C(=O)NCCc2ccncc2)C1	ZINC000853863819	DF	On-Demand	Anodyne	MCHR1	21	49
O=C(NCCc1ccncc1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853863822	FG	On-Demand	Anodyne	KCNH2	43	44
O=C(NCCc1ccncc1)N1[C@H]2CC[C@H]1CC(Oc1ccccc1)C2	ZINC000853863822	FG	On-Demand	Anodyne	EPHX2	19	46
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3cccc(F)c3[N+](=O)[O-])O2)C1	ZINC000853863830	GG	On-Demand	Bother	GPR119	18	41
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3cccc(F)c3[N+](=O)[O-])O2)C1	ZINC000853863831	GG	On-Demand	Bother	GPR119	18	41
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccccn3)O2)C1	ZINC000853863858	DF	On-Demand	Anodyne	GRIN2B	16	44
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccccn3)O2)C1	ZINC000853863858	DF	On-Demand	Anodyne	GPR119	29	44
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccccn3)O2)C1	ZINC000853863859	DF	On-Demand	Anodyne	GRIN2B	16	44
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccccn3)O2)C1	ZINC000853863859	DF	On-Demand	Anodyne	GPR119	29	44
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853863863	GG	On-Demand	Anodyne	SCD1	39	42
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ncc(Cc3cccc(OC)c3)s2)C1	ZINC000853863863	GG	On-Demand	Anodyne	SCD	38	52
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2C[C@@H]3CCCC[C@@H]32)cc1	ZINC000853863882	GI	On-Demand	Anodyne	CACNA1B	15	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2C[C@@H]3CCCC[C@@H]32)cc1	ZINC000853863882	GI	On-Demand	Anodyne	REN	42	38
CC(C)c1ccccc1NC(=O)NCCC1SCCS1	ZINC000853863893	DI	On-Demand	Anodyne	SOAT1	42	38
O=C(NCCc1ccncc1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853863901	DC	On-Demand	Anodyne	L3MBTL3	57	32
O=C(NCCc1ccncc1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853863902	DC	On-Demand	Anodyne	L3MBTL3	57	32
O=C(NCCc1ccncc1)N[C@H]1CCc2ccccc2-n2ccnc21	ZINC000853863915	EF	On-Demand	Anodyne	NPY1R	27	42
O=C(NCCc1ccncc1)N[C@@H]1CCc2ccccc2-n2ccnc21	ZINC000853863916	EF	On-Demand	Anodyne	NPY1R	27	42
O=C(NCCc1ccncc1)N1CCC2(COC2)C1	ZINC000853863945	CD	On-Demand	Anodyne	EPHX2	16	43
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccc(S(C)(=O)=O)cc3)O2)C1	ZINC000853863946	GF	On-Demand	Anodyne	GPR119	55	48
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccc(S(C)(=O)=O)cc3)O2)C1	ZINC000853863947	GF	On-Demand	Anodyne	GPR119	55	48
Cc1cccc(NC(=O)NCCC2SCCS2)n1	ZINC000853863948	CF	On-Demand	Anodyne	GRM5	19	45
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCc2ccncc2)C1	ZINC000853863977	EE	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCc2ccncc2)C1	ZINC000853863978	EE	On-Demand	Anodyne	GPR119	22	42
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ncccn3)O2)C1	ZINC000853863981	DE	On-Demand	Anodyne	GRIN2B	17	43
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ncccn3)O2)C1	ZINC000853863981	DE	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ncccn3)O2)C1	ZINC000853863982	DE	On-Demand	Anodyne	GRIN2B	17	43
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ncccn3)O2)C1	ZINC000853863982	DE	On-Demand	Anodyne	GPR119	28	42
O=C(NCCC1SCCS1)Nc1ccc(Cl)cn1	ZINC000853864000	DG	On-Demand	Anodyne	F10	50	34
O=C(NCCc1ccncc1)N(CCN1CCOCC1)CC1CC1	ZINC000853864005	ED	On-Demand	Anodyne	CASR	54	42
O=C(NCCc1ccncc1)NCCc1ccoc1	ZINC000853864010	CD	On-Demand	Anodyne	CA5B	16	44
O=C(NCCc1ccncc1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853864011	EE	On-Demand	Anodyne	EPHX2	26	42
O=C(NCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853864035	DH	On-Demand	Anodyne	EPHX2	19	45
O=C(NCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853864035	DH	On-Demand	Anodyne	ERBB4	43	35
O=C(NCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853864035	DH	On-Demand	Anodyne	MCHR1	22	42
O=C(NCCC1SCCS1)Nc1ccc(F)c(Cl)c1	ZINC000853864035	DH	On-Demand	Anodyne	PRMT3	45	39
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853864039	GF	On-Demand	Anodyne	NPY2R	62	35
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)C1	ZINC000853864040	GF	On-Demand	Anodyne	NPY2R	62	35
COCCOc1ccc(NC(=O)NCCC2SCCS2)cn1	ZINC000853864044	EE	On-Demand	Anodyne	ADRB1	38	42
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccc(Cl)cn3)O2)C1	ZINC000853864053	FG	On-Demand	Anodyne	F10	47	31
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccc(Cl)cn3)O2)C1	ZINC000853864054	FG	On-Demand	Anodyne	F10	47	31
O=C(NCCC1SCCS1)Nc1cccnc1	ZINC000853864059	CE	On-Demand	Anodyne	CHRNA7	20	42
O=C(NCCC1SCCS1)Nc1cccnc1	ZINC000853864059	CE	On-Demand	Anodyne	NAMPT	53	43
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3nccc(N4CCCC4)n3)O2)C1	ZINC000853864072	GF	On-Demand	Anodyne	GPR119	24	46
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3nccc(N4CCCC4)n3)O2)C1	ZINC000853864073	GF	On-Demand	Anodyne	GPR119	24	46
O=C(NCCC1SCCS1)Nc1nc2ccccc2s1	ZINC000853864092	EH	On-Demand	Anodyne	LCK	25	45
O=C(NCCC1SCCS1)Nc1nc2ccccc2s1	ZINC000853864092	EH	On-Demand	Anodyne	CSNK1D	38	50
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA2	134	56
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA1	125	53
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA7	69	46
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA13	22	44
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA5B	67	44
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA4	97	53
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA5A	72	44
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA14	67	46
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA12	106	50
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CA9	104	50
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	CYNT	46	39
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	NCE103	49	56
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	MTCA1	65	52
NS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864095	ED	On-Demand	Anodyne	P96878_MYCTU	80	52
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ncccc3S(C)(=O)=O)O2)C1	ZINC000853864099	GE	On-Demand	Anodyne	GPR119	51	41
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ncccc3S(C)(=O)=O)O2)C1	ZINC000853864100	GE	On-Demand	Anodyne	GPR119	51	41
COc1ncccc1NC(=O)NCCC1SCCS1	ZINC000853864114	CE	On-Demand	Anodyne	P2RY1	41	39
Cc1nc(CCNC(=O)NNc2nc3ccc(Cl)cc3s2)sc1C	ZINC000853864118	GH	On-Demand	Reactive	CSNK1D	39	43
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)C1	ZINC000853864137	GF	On-Demand	Anodyne	NPY2R	62	35
O=C(NCCc1ccncc1)N1CCC[C@H](C2CCC2)C1	ZINC000853864164	CF	On-Demand	Anodyne	DPP7	19	40
O=C(NCCc1ccncc1)N1CCC[C@H](C2CCC2)C1	ZINC000853864164	CF	On-Demand	Anodyne	GPBAR1	22	40
O=C(NCCc1ccncc1)N1CCC[C@@H](C2CCC2)C1	ZINC000853864165	CF	On-Demand	Anodyne	DPP7	19	40
O=C(NCCc1ccncc1)N1CCC[C@@H](C2CCC2)C1	ZINC000853864165	CF	On-Demand	Anodyne	GPBAR1	22	40
O=C(NCCc1ccncc1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853864180	DE	On-Demand	Anodyne	SLC6A5	20	40
O=C(NCCc1ccncc1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853864180	DE	On-Demand	Anodyne	EPHX2	15	53
O=C(NCCc1ccncc1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853864181	DE	On-Demand	Anodyne	SLC6A5	20	40
O=C(NCCc1ccncc1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853864181	DE	On-Demand	Anodyne	EPHX2	15	53
O=C(NCCC1SCCS1)Nc1cccnc1N1CCCC1	ZINC000853864186	EF	On-Demand	Anodyne	KCNQ2	55	33
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853864187	GG	On-Demand	Anodyne	BCL2A1	42	33
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)c(Cl)c2)CC1	ZINC000853864187	GG	On-Demand	Anodyne	RPA1	78	33
O=C(NCCC1SCCS1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853864188	FH	On-Demand	Anodyne	P2RY1	64	43
O=C(NCCC1SCCS1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853864188	FH	On-Demand	Anodyne	EPHX2	78	51
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2cccnc2Cl)C1	ZINC000853864197	CE	On-Demand	Anodyne	G2YM83_BOTF4	71	38
O=C(NCCc1ccncc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853864213	GE	On-Demand	Anodyne	HTR1A	22	52
O=C(NCCc1ccncc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853864213	GE	On-Demand	Anodyne	DRD2	15	52
O=C(NCCc1ccncc1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853864213	GE	On-Demand	Anodyne	DRD3	18	42
O=C(NCCc1ccncc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853864275	ED	On-Demand	Anodyne	L3MBTL3	101	41
O=C(NCCc1ccncc1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853864275	ED	On-Demand	Anodyne	NAMPT	23	41
O=C(NCCc1ccncc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853864277	ED	On-Demand	Anodyne	L3MBTL3	101	41
O=C(NCCc1ccncc1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853864277	ED	On-Demand	Anodyne	NAMPT	23	41
CCN1CC[C@H](N(CC)C(=O)NCCc2ccncc2)C1	ZINC000853864316	CD	On-Demand	Anodyne	CCR5	21	45
CCN1CC[C@@H](N(CC)C(=O)NCCc2ccncc2)C1	ZINC000853864317	CD	On-Demand	Anodyne	CCR5	21	45
Cc1cc(C#N)cc(NC[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)n1	ZINC000853864320	FF	On-Demand	Mild	GPR119	17	41
COC[C@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864321	EE	On-Demand	Anodyne	NQO2	22	40
COC[C@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864321	EE	On-Demand	Anodyne	ROCK1	24	45
COC[C@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864321	EE	On-Demand	Anodyne	MTNR1A	72	41
COC[C@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864321	EE	On-Demand	Anodyne	MTNR1B	66	41
COC[C@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864321	EE	On-Demand	Anodyne	ROCK2	26	45
Cc1cc(C#N)cc(NC[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)n1	ZINC000853864322	FF	On-Demand	Mild	GPR119	17	41
COC[C@@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864323	EE	On-Demand	Anodyne	NQO2	22	40
COC[C@@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864323	EE	On-Demand	Anodyne	ROCK1	24	45
COC[C@@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864323	EE	On-Demand	Anodyne	MTNR1A	72	41
COC[C@@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864323	EE	On-Demand	Anodyne	MTNR1B	66	41
COC[C@@H](NC(=O)NCCc1ccncc1)c1cccc(OC)c1	ZINC000853864323	EE	On-Demand	Anodyne	ROCK2	26	45
O=C(NCCC1SCCS1)Nc1ccc(Cl)cc1	ZINC000853864324	DH	On-Demand	Anodyne	EPHX2	22	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1ccncc1	ZINC000853864343	FE	On-Demand	Anodyne	GPR119	38	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NC/C=C/CO)cc1	ZINC000853864349	FF	On-Demand	Anodyne	CTSK	15	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NC/C=C\CO)cc1	ZINC000853864350	FF	On-Demand	Anodyne	CTSK	15	42
CN1CCN(c2ccccc2NC(=O)NCCCc2ccco2)CC1	ZINC000853864355	EF	On-Demand	Anodyne	HTR1A	23	43
CN1CCN(c2ccccc2NC(=O)NCCCc2ccco2)CC1	ZINC000853864355	EF	On-Demand	Anodyne	DRD2	30	40
CN1CCN(c2ccccc2NC(=O)NCCCc2ccco2)CC1	ZINC000853864355	EF	On-Demand	Anodyne	DRD3	54	40
CN1CCN(c2ccccc2NC(=O)NCCCc2ccco2)CC1	ZINC000853864355	EF	On-Demand	Anodyne	KCNQ2	74	38
CS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864372	EE	On-Demand	Anodyne	CA2	16	42
CS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864372	EE	On-Demand	Anodyne	EPHX2	18	40
CS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864372	EE	On-Demand	Anodyne	PRMT3	19	42
CS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864372	EE	On-Demand	Anodyne	MTCA1	42	38
CS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864372	EE	On-Demand	Anodyne	P96878_MYCTU	54	38
CS(=O)(=O)c1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853864372	EE	On-Demand	Anodyne	NAMPT	40	36
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccc(C#N)cc3F)O2)C1	ZINC000853864377	FG	On-Demand	Mild	GPR119	28	42
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccc(C#N)cc3F)O2)C1	ZINC000853864378	FG	On-Demand	Mild	GPR119	28	42
O=C(NCCC1SCCS1)Nc1nc2c(s1)CCCCC2	ZINC000853864384	EH	On-Demand	Anodyne	SLC27A1	31	40
O=C(NCCC1SCCS1)c1nc2cc(Cl)ccc2s1	ZINC000853864393	EH	On-Demand	Anodyne	ALPL	41	35
O=C(NCCc1ccncc1)NC[C@H]1CCN1Cc1ccccc1	ZINC000853864394	DE	On-Demand	Anodyne	SIGMAR1	24	40
O=C(NCCc1ccncc1)NC[C@H]1CCN1Cc1ccccc1	ZINC000853864394	DE	On-Demand	Anodyne	CCR3	15	42
O=C(NCCc1ccncc1)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853864396	DE	On-Demand	Anodyne	SIGMAR1	24	40
O=C(NCCc1ccncc1)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853864396	DE	On-Demand	Anodyne	CCR3	15	42
O=C(NCCC1SCCS1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853864408	DF	On-Demand	Bother	NMBR	47	32
O=C(NCCC1SCCS1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853864408	DF	On-Demand	Bother	PRMT3	19	42
CS(=O)(=O)C1(CNC(=O)NCCc2ccncc2)CCCCC1	ZINC000853864413	ED	On-Demand	Anodyne	CA5B	16	43
CC[C@@H](O)CNC(=O)NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853864424	FF	On-Demand	Anodyne	CTSK	15	42
CC[C@@H](O)CNC(=O)NCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000853864425	FF	On-Demand	Anodyne	CTSK	15	42
O=C(NCCC1SCCS1)Nc1ncc(-c2ccccc2)s1	ZINC000853864428	FI	On-Demand	Anodyne	ADRB1	40	31
O=C(NCCC1SCCS1)Nc1ncc(-c2ccccc2)s1	ZINC000853864428	FI	On-Demand	Anodyne	CDK5	42	37
O=C(NCCC1SCCS1)Nc1ccccc1C(F)(F)F	ZINC000853864455	EI	On-Demand	Anodyne	RBP4	63	36
O=C(NCCC1SCCS1)Nc1cccc2ccccc12	ZINC000853864464	DI	On-Demand	Anodyne	TRPV1	28	46
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3cccnn3)O2)C1	ZINC000853864487	DE	On-Demand	Anodyne	NPY5R	16	40
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3cccnn3)O2)C1	ZINC000853864488	DE	On-Demand	Anodyne	NPY5R	16	40
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3cnc(C#N)cn3)O2)C1	ZINC000853864500	ED	On-Demand	Mild	CHEK1	15	41
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3cnc(C#N)cn3)O2)C1	ZINC000853864501	ED	On-Demand	Mild	CHEK1	15	41
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccc(C#N)nc3)O2)C1	ZINC000853864521	EF	On-Demand	Mild	GPR119	28	40
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccc(C#N)nc3)O2)C1	ZINC000853864522	EF	On-Demand	Mild	GPR119	28	40
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccc(F)cc3C#N)O2)C1	ZINC000853864524	FG	On-Demand	Mild	GPR119	23	42
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccc(F)cc3C#N)O2)C1	ZINC000853864525	FG	On-Demand	Mild	GPR119	23	42
O=C(NCCC1SCCS1)Nc1ncc(Cc2ccccc2)s1	ZINC000853864534	FI	On-Demand	Anodyne	CDK5	48	42
O=C(NCCC1SCCS1)Nc1ccc(F)cc1	ZINC000853864535	CG	On-Demand	Anodyne	ADRB1	36	42
O=C(NCCC1SCCS1)Nc1ccc(F)cc1	ZINC000853864535	CG	On-Demand	Anodyne	CCR3	36	42
O=C(NCCC1SCCS1)Nc1ccc(F)cc1	ZINC000853864535	CG	On-Demand	Anodyne	EPHX2	22	42
O=C(NCCc1ccncc1)N[C@@H]1C[C@@H](Oc2ccccc2)C1	ZINC000853864540	DF	On-Demand	Anodyne	EPHX2	29	53
O=C(NCCC1SCCS1)Nc1ccc(-c2ncon2)cc1	ZINC000853864549	EG	On-Demand	Anodyne	MTOR	55	36
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ncc([N+](=O)[O-])cc3F)O2)C1	ZINC000853864556	GF	On-Demand	Bother	GPR119	20	40
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ncc([N+](=O)[O-])cc3F)O2)C1	ZINC000853864558	GF	On-Demand	Bother	GPR119	20	40
O=C(NCCc1ccncc1)N1CCN([C@H]2CCOC2)CC1	ZINC000853864560	DC	On-Demand	Anodyne	NAMPT	18	43
O=C(NCCc1ccncc1)N1CCN([C@@H]2CCOC2)CC1	ZINC000853864562	DC	On-Demand	Anodyne	NAMPT	18	43
O=C(NCCC1SCCS1)Nc1ccc(N2CCOCC2)cn1	ZINC000853864569	FE	On-Demand	Anodyne	STAT6	55	33
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3cc(C#N)ccn3)O2)C1	ZINC000853864574	EF	On-Demand	Mild	MAP3K12	48	36
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3cc(C#N)ccn3)O2)C1	ZINC000853864575	EF	On-Demand	Mild	MAP3K12	48	36
O=C(NCCc1ccncc1)NCCc1ccc(I)cc1	ZINC000853864578	GF	On-Demand	Anodyne	CA5B	18	50
O=C(NCCc1ccncc1)NCCc1ccc(I)cc1	ZINC000853864578	GF	On-Demand	Anodyne	CA5A	16	50
O=C(NCCc1ccncc1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853864595	FG	On-Demand	Anodyne	SCD1	22	46
O=C(NCCc1ccncc1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853864595	FG	On-Demand	Anodyne	SCD	34	42
O=C(NCCc1ccncc1)N1CCC2(CCc3ccccc3O2)CC1	ZINC000853864595	FG	On-Demand	Anodyne	TRPM8	21	53
O=C(NCCc1ccncc1)NCC1CCN(CC2CC2)CC1	ZINC000853864601	DE	On-Demand	Anodyne	CCR3	41	44
O=C(NCCc1ccncc1)NCC1CCN(CC2CC2)CC1	ZINC000853864601	DE	On-Demand	Anodyne	CACNA1I	60	38
O=C(NCCC1SCCS1)Nc1ccccc1OC(F)(F)F	ZINC000853864604	FH	On-Demand	Anodyne	P2RY1	41	35
O=C(NCCC1SCCS1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853864606	FF	On-Demand	Bother	CACNA1D	46	34
COC(=O)c1cnc([C@H]2CCCN(C(=O)NCCc3ccncc3)C2)s1	ZINC000853864612	FE	On-Demand	Anodyne	BIRC2	16	41
COC(=O)c1cnc([C@@H]2CCCN(C(=O)NCCc3ccncc3)C2)s1	ZINC000853864613	FE	On-Demand	Anodyne	BIRC2	16	41
O=C(NCCC1SCCS1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853864626	FG	On-Demand	Anodyne	CCR3	25	42
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ncccc3F)O2)C1	ZINC000853864646	EF	On-Demand	Anodyne	NPY5R	40	34
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ncccc3F)O2)C1	ZINC000853864647	EF	On-Demand	Anodyne	NPY5R	40	34
Cc1cc(C#N)nc(NC[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)n1	ZINC000853864677	FE	On-Demand	Mild	GPR119	17	41
Cc1cc(C#N)nc(NC[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)n1	ZINC000853864678	FE	On-Demand	Mild	GPR119	17	41
O=C(NCCC1SCCS1)Nc1cnc(-c2ccccc2)nc1	ZINC000853864683	EG	On-Demand	Anodyne	ADRB1	45	35
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3nc(O)c4ccccc4n3)O2)C1	ZINC000853864691	GF	On-Demand	Anodyne	TNKS	60	34
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3nc(O)c4ccccc4n3)O2)C1	ZINC000853864692	GF	On-Demand	Anodyne	TNKS	60	34
N#Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864702	CF	On-Demand	Mild	ADRB1	44	37
N#Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864702	CF	On-Demand	Mild	CCR3	36	55
N#Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864702	CF	On-Demand	Mild	MCHR1	30	45
Cc1nc(C(=O)NCc2cc(F)ccc2OC(F)F)no1	ZINC000853864713	DE	On-Demand	Anodyne	P2RX7	33	40
Cc1nc(NC(=O)NCCC2SCCS2)sc1-c1ccccc1	ZINC000853864740	FI	On-Demand	Anodyne	PIK3CG	23	48
Cc1nc(NC(=O)NCCC2SCCS2)sc1-c1ccccc1	ZINC000853864740	FI	On-Demand	Anodyne	PI4KB	41	45
O=C(NCCc1ccncc1)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853864760	FE	On-Demand	Clean	NAMPT	48	40
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3cnccn3)O2)C1	ZINC000853864763	DE	On-Demand	Anodyne	GPR119	21	44
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3cnccn3)O2)C1	ZINC000853864764	DE	On-Demand	Anodyne	GPR119	21	44
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2nc(C)c(-c3ccccc3)s2)C1	ZINC000853864769	FH	On-Demand	Anodyne	PIK3CG	19	42
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2nc(C)c(-c3ccccc3)s2)C1	ZINC000853864769	FH	On-Demand	Anodyne	PI4KB	40	42
COc1cccc(C2(NC(=O)NCCc3ccncc3)CCC2)c1	ZINC000853864785	EG	On-Demand	Anodyne	MTNR1A	67	38
COc1cccc(C2(NC(=O)NCCc3ccncc3)CCC2)c1	ZINC000853864785	EG	On-Demand	Anodyne	MTNR1B	60	38
O=C(NCCc1ccncc1)N1CCC(C2CCC2)CC1	ZINC000853864792	CF	On-Demand	Anodyne	EPHX2	16	41
CC(=O)Nc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864811	EF	On-Demand	Anodyne	CCR3	35	40
CC(=O)Nc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864811	EF	On-Demand	Anodyne	KCNK3	57	33
CC(=O)Nc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864811	EF	On-Demand	Anodyne	KCNK9	47	33
O=C(NCCc1ccncc1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853864818	FE	On-Demand	Anodyne	DRD4	24	42
O=C(NCCc1ccncc1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853864818	FE	On-Demand	Anodyne	ACHE	43	53
O=C(NCCc1ccncc1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853864818	FE	On-Demand	Anodyne	HTR4	39	42
O=C(NCCc1ccncc1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853864818	FE	On-Demand	Anodyne	SIGMAR1	37	49
O=C(NCCc1ccncc1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853864818	FE	On-Demand	Anodyne	SSTR5	54	37
O=C(NCCc1ccncc1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853864818	FE	On-Demand	Anodyne	CCR3	44	45
O=C(NCCc1ccncc1)NCC1CCN(Cc2ccncc2)CC1	ZINC000853864818	FE	On-Demand	Anodyne	CACNA1I	70	45
O=C(NCCc1ccncc1)NC1CCC(C2CCC2)CC1	ZINC000853864826	DG	On-Demand	Anodyne	EPHX2	16	58
C[C@H]1CN(c2ccc(NC(=O)NCCCc3ccco3)cc2F)C[C@@H](C)O1	ZINC000853864842	GH	On-Demand	Anodyne	NPY2R	55	36
C[C@H]1CN(c2ccc(NC(=O)NCCCc3ccco3)cc2F)C[C@H](C)O1	ZINC000853864843	GH	On-Demand	Anodyne	NPY2R	55	36
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3cnccc3C#N)O2)C1	ZINC000853864854	EF	On-Demand	Mild	GPR119	24	41
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3cnccc3C#N)O2)C1	ZINC000853864855	EF	On-Demand	Mild	GPR119	24	41
CCCn1nccc1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853864860	CF	On-Demand	Reactive	FPR2	18	40
O=C(NCCC1SCCS1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853864870	GG	On-Demand	Anodyne	CCR3	43	40
O=C(NCCC1SCCS1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853864870	GG	On-Demand	Anodyne	PRMT3	32	41
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CC3CC2(C)C3)cc1	ZINC000853864880	FH	On-Demand	Anodyne	CTSK	22	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CC3CC2(C)C3)cc1	ZINC000853864880	FH	On-Demand	Anodyne	FPR1	41	32
COC(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864895	EF	On-Demand	Anodyne	CCR3	41	41
COC(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864895	EF	On-Demand	Anodyne	EPHX2	25	54
COC(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864895	EF	On-Demand	Anodyne	HIF1A	15	44
COC(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864895	EF	On-Demand	Anodyne	KCNK3	62	33
COC(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853864895	EF	On-Demand	Anodyne	KCNK9	47	32
O=C(NCCC1SCCS1)Nc1ccc(C(F)(F)F)cc1	ZINC000853864909	EI	On-Demand	Anodyne	TRPV1	17	40
O=C(NCCC1SCCS1)Nc1ccc(C(F)(F)F)cc1	ZINC000853864909	EI	On-Demand	Anodyne	EPHX2	44	54
O=C(NCCC1SCCS1)Nc1ccc(-c2ccccc2)cc1	ZINC000853864928	EJ	On-Demand	Anodyne	CA1	20	40
O=C(NCCC1SCCS1)Nc1ccc(-c2ccccc2)cc1	ZINC000853864928	EJ	On-Demand	Anodyne	CCR3	15	43
O=C(NCCC1SCCS1)Nc1ccc(-c2ccccc2)cc1	ZINC000853864928	EJ	On-Demand	Anodyne	ROCK2	15	45
O=C(NCCC1SCCS1)Nc1ccc(-c2ccccc2)cc1	ZINC000853864928	EJ	On-Demand	Anodyne	EPHX2	16	40
O=C(NCCC1SCCS1)Nc1ccc(-c2ccccc2)cc1	ZINC000853864928	EJ	On-Demand	Anodyne	DGAT1	15	40
Cn1cc(CCNC(=O)NCCc2ccncc2)c2ccccc21	ZINC000853864943	DF	On-Demand	Anodyne	MTNR1A	18	44
O=C(NCCc1ccncc1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853864950	FF	On-Demand	Anodyne	ADRB1	28	46
O=C(NCCc1ccncc1)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853864950	FF	On-Demand	Anodyne	ADRB3	49	39
O=C(NCCc1ccncc1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853864951	FF	On-Demand	Anodyne	ADRB1	28	46
O=C(NCCc1ccncc1)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853864951	FF	On-Demand	Anodyne	ADRB3	49	39
O=C(NCCc1ccncc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853864978	DE	On-Demand	Anodyne	GRIN2B	29	40
O=C(NCCc1ccncc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853864978	DE	On-Demand	Anodyne	EPHX2	30	51
O=C(NCCc1ccncc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853864978	DE	On-Demand	Anodyne	SCD1	19	42
O=C(NCCc1ccncc1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853864978	DE	On-Demand	Anodyne	SCD	21	41
COc1cccc([C@]2(C)CCN(C(=O)NCCc3ccncc3)C2)c1	ZINC000853864985	EG	On-Demand	Anodyne	DRD4	43	32
COc1cccc([C@]2(C)CCN(C(=O)NCCc3ccncc3)C2)c1	ZINC000853864985	EG	On-Demand	Anodyne	MTNR1A	59	38
COc1cccc([C@]2(C)CCN(C(=O)NCCc3ccncc3)C2)c1	ZINC000853864985	EG	On-Demand	Anodyne	MTNR1B	57	38
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NCC[C@@H](C)N(C)C)cc1	ZINC000853864987	GG	On-Demand	Anodyne	CTSK	20	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)NCC[C@H](C)N(C)C)cc1	ZINC000853864988	GG	On-Demand	Anodyne	CTSK	20	43
C[C@@H](CCNC(=O)NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1)N(C)C	ZINC000853864990	GG	On-Demand	Anodyne	CTSK	20	43
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCc1ccncc1	ZINC000853864997	FI	On-Demand	Anodyne	MME	62	39
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCc1ccncc1	ZINC000853864997	FI	On-Demand	Anodyne	AMP1_PLAFQ	38	46
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCc1ccncc1	ZINC000853864997	FI	On-Demand	Anodyne	GPR142	63	42
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	CNR1	65	44
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	DRD3	20	41
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	CNR2	22	40
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	MC4R	65	37
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	NPY2R	37	40
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	CXCR3	22	54
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	DPP8	19	41
O=C(NCCc1ccncc1)N1CCN(c2ccc(Cl)cc2Cl)CC1	ZINC000853865002	GG	On-Demand	Anodyne	MRGPRX1	42	37
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ccc(C#N)cn3)O2)C1	ZINC000853865010	EF	On-Demand	Mild	GPR119	26	40
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ccc(C#N)cn3)O2)C1	ZINC000853865011	EF	On-Demand	Mild	GPR119	26	40
O=C(NCCc1ccncc1)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853865020	FF	On-Demand	Anodyne	SSTR3	36	51
O=C(NCCc1ccncc1)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853865020	FF	On-Demand	Anodyne	KDM4E	21	44
O=C(NCCc1ccncc1)N1CCC[C@@H](C2CCCCC2)C1	ZINC000853865025	DH	On-Demand	Anodyne	DPP7	24	42
O=C(NCCc1ccncc1)N1CCC[C@@H](C2CCCCC2)C1	ZINC000853865025	DH	On-Demand	Anodyne	GPBAR1	20	40
O=C(NCCc1ccncc1)N1CCC[C@@H](C2CCCCC2)C1	ZINC000853865025	DH	On-Demand	Anodyne	BIRC2	19	40
O=C(NCCc1ccncc1)N1CCC[C@H](C2CCCCC2)C1	ZINC000853865026	DH	On-Demand	Anodyne	DPP7	24	42
O=C(NCCc1ccncc1)N1CCC[C@H](C2CCCCC2)C1	ZINC000853865026	DH	On-Demand	Anodyne	GPBAR1	20	40
O=C(NCCc1ccncc1)N1CCC[C@H](C2CCCCC2)C1	ZINC000853865026	DH	On-Demand	Anodyne	BIRC2	19	40
O=C(NCCC1SCCS1)Nc1ccc(Cl)c(Cl)c1	ZINC000853865062	EI	On-Demand	Anodyne	RAF1	16	43
O=C(NCCC1SCCS1)Nc1ccc(Cl)c(Cl)c1	ZINC000853865062	EI	On-Demand	Anodyne	PRMT3	64	43
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	DRD4	43	33
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	HRH2	20	49
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	CCR3	46	52
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	MTNR1A	60	44
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	MTNR1B	53	46
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	ROCK2	20	44
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	EPHX2	31	53
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	FLT4	18	41
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	TAAR1	36	42
COc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865077	CG	On-Demand	Anodyne	KCNK3	42	36
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865080	GE	On-Demand	Anodyne	HRH2	24	42
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865080	GE	On-Demand	Anodyne	CCR3	51	38
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865081	GE	On-Demand	Anodyne	HRH2	24	42
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865081	GE	On-Demand	Anodyne	CCR3	51	38
COc1ccc([C@@H]2CCCN2C(=O)NCCc2ccncc2)cc1F	ZINC000853865082	EG	On-Demand	Anodyne	CNR2	27	40
N#Cc1ccc(NC(=O)NCCC2SCCS2)cc1	ZINC000853865083	CF	On-Demand	Mild	ADRB1	46	38
O=C(NCCc1ccncc1)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853865100	DE	On-Demand	Anodyne	CCR3	72	41
O=C(NCCc1ccncc1)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853865102	DE	On-Demand	Anodyne	CCR3	72	41
CC(C)(C)OC(=O)N1CC2(CC[C@H](CNc3ncccc3S(N)(=O)=O)O2)C1	ZINC000853865107	GD	On-Demand	Anodyne	GPR119	40	37
CC(C)(C)OC(=O)N1CC2(CC[C@@H](CNc3ncccc3S(N)(=O)=O)O2)C1	ZINC000853865109	GD	On-Demand	Anodyne	GPR119	40	37
O=C(NCCC1SCCS1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853865110	ED	On-Demand	Anodyne	CASP2	18	43
O=C(NCCC1SCCS1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853865110	ED	On-Demand	Anodyne	CASP6	15	43
O=C(NCCC1SCCS1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853865110	ED	On-Demand	Anodyne	PRMT3	45	39
CN(CC(=O)N1CCCC1)C(=O)NCCc1ccncc1	ZINC000853865111	CC	On-Demand	Anodyne	DPP7	23	40
Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865112	CG	On-Demand	Anodyne	CCKAR	26	49
Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865112	CG	On-Demand	Anodyne	EPHX2	20	50
Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865112	CG	On-Demand	Anodyne	KCNK3	62	40
Cc1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865112	CG	On-Demand	Anodyne	KCNK9	50	40
O=C(NCCC1SCCS1)Nc1cccc(Cl)c1	ZINC000853865114	DH	On-Demand	Anodyne	PPIA	16	40
O=C(NCCC1SCCS1)Nc1cccc(Cl)c1	ZINC000853865114	DH	On-Demand	Anodyne	EPHX2	22	55
O=C(NCCC1SCCS1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853865171	GI	On-Demand	Anodyne	CDK5	40	34
O=C(NCCC1SCCS1)Nc1nccs1	ZINC000853865185	CE	On-Demand	Anodyne	MAP1	121	38
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853865194	FD	On-Demand	Anodyne	HTR1A	17	41
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853865194	FD	On-Demand	Anodyne	HTR1B	15	41
COC(=O)[C@@H]1C[C@H](N(C)C(=O)Nc2ccccc2N2CCN(C)CC2)C1	ZINC000853865194	FD	On-Demand	Anodyne	KCNQ2	76	41
O=C(NCCC1SCCS1)Nc1ccc(F)c(F)c1	ZINC000853865198	DG	On-Demand	Anodyne	CCR3	26	44
O=C(NCCC1SCCS1)Nc1ccc(F)c(F)c1	ZINC000853865198	DG	On-Demand	Anodyne	PRMT3	48	41
O=C(NCCC1SCCS1)Nc1cccc2cccnc12	ZINC000853865236	DH	On-Demand	Anodyne	WNT3	15	40
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA2	58	55
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA1	55	46
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA7	40	36
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CCR3	23	40
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA5B	62	36
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA4	54	51
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA5A	66	36
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA14	21	41
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA12	43	55
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	CA9	43	55
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	NCE103	19	44
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	MTCA1	44	40
NS(=O)(=O)c1cccc(NC(=O)NCCC2SCCS2)c1	ZINC000853865264	ED	On-Demand	Anodyne	P96878_MYCTU	57	40
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)cc1	ZINC000853865280	GG	On-Demand	Anodyne	CMA1	29	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)cc1	ZINC000853865280	GG	On-Demand	Anodyne	CACNA1B	15	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CCC[C@@H]2[C@@H](C)O)cc1	ZINC000853865280	GG	On-Demand	Anodyne	REN	40	36
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)cc1	ZINC000853865282	GG	On-Demand	Anodyne	CMA1	29	43
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)cc1	ZINC000853865282	GG	On-Demand	Anodyne	CACNA1B	15	42
C[C@H](NC(=O)OC(C)(C)C)c1ccc(CNC(=O)N2CCC[C@@H]2[C@H](C)O)cc1	ZINC000853865282	GG	On-Demand	Anodyne	REN	40	36
CN1CCN(c2ccccc2NC(=O)NCCC2SCCS2)CC1	ZINC000853865286	FF	On-Demand	Anodyne	KCNQ2	78	40
O=C(NCCC1SCCS1)Nc1ccccc1Cl	ZINC000853865296	DH	On-Demand	Anodyne	EPHB3	45	32
O=C(NCCC1SCCS1)Nc1ccc(Cl)cc1Cl	ZINC000853865302	EI	On-Demand	Anodyne	ALPL	40	34
O=C(NCCC1SCCS1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853865352	GE	On-Demand	Anodyne	NPY1R	28	40
C[C@H]1CN(c2ccc(NC(=O)NCCC3SCCS3)cc2F)C[C@@H](C)O1	ZINC000853865355	GH	On-Demand	Anodyne	NPY2R	60	36
C[C@H]1CN(c2ccc(NC(=O)NCCC3SCCS3)cc2F)C[C@H](C)O1	ZINC000853865357	GH	On-Demand	Anodyne	NPY2R	60	36
O=C(NCCC1SCCS1)Nc1cccnc1Cl	ZINC000853865398	DG	On-Demand	Anodyne	G2YM83_BOTF4	70	37
O=C(NCCC1SCCS1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853865421	GI	On-Demand	Anodyne	SCD	32	40
O=C(NCCC1SCCS1)Nc1cccc([N+](=O)[O-])c1	ZINC000853865425	DF	On-Demand	Bother	CCR3	21	50
O=C(NCCC1SCCS1)Nc1nc2c(s1)CCCC2	ZINC000853865426	EG	On-Demand	Anodyne	SLC27A1	31	40
O=C(NCCC1SCCS1)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000853865447	FI	On-Demand	Anodyne	DDR2	16	41
CCn1c(=O)c(N(C)CCN(C)C(=O)OC)nc2ccccc21	ZINC000853865483	DD	On-Demand	Anodyne	PYGM	18	40
O=C(N1C[C@H]2CC[C@@H](C2)C1)C(F)(F)c1ccccc1F	ZINC000853865562	CG	On-Demand	Anodyne	RBP4	51	35
Cc1nc(NC(=O)N2C[C@H]3CC[C@@H](C3)C2)sc1-c1ccccc1	ZINC000853865588	EI	On-Demand	Anodyne	PIK3CG	21	45
Cc1nc(NC(=O)N2C[C@H]3CC[C@@H](C3)C2)sc1-c1ccccc1	ZINC000853865588	EI	On-Demand	Anodyne	PI4KB	40	38
Cc1nc(NC(=O)N2CCC[C@H](C(=O)NC(C)C)C2)sc1-c1ccccc1	ZINC000853865606	GH	On-Demand	Anodyne	SSTR2	41	40
Cc1nc(NC(=O)N2CCC[C@H](C(=O)NC(C)C)C2)sc1-c1ccccc1	ZINC000853865606	GH	On-Demand	Anodyne	PIK3CG	16	48
Cc1nc(NC(=O)N2CCC[C@@H](C(=O)NC(C)C)C2)sc1-c1ccccc1	ZINC000853865607	GH	On-Demand	Anodyne	SSTR2	41	40
Cc1nc(NC(=O)N2CCC[C@@H](C(=O)NC(C)C)C2)sc1-c1ccccc1	ZINC000853865607	GH	On-Demand	Anodyne	PIK3CG	16	48
CCNS(=O)(=O)c1ccc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853865758	GD	On-Demand	Anodyne	KCNA5	20	42
CCNS(=O)(=O)c1ccc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853865759	GD	On-Demand	Anodyne	KCNA5	20	42
CCNS(=O)(=O)c1ccc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)cc1	ZINC000853865760	GD	On-Demand	Anodyne	KCNA5	20	42
CCNS(=O)(=O)c1ccc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)cc1	ZINC000853865761	GD	On-Demand	Anodyne	KCNA5	20	42
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H]4CC[C@@H](C4)C3)cc2F)C[C@@H](C)O1	ZINC000853865763	FH	On-Demand	Anodyne	NPY2R	62	36
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H]4CC[C@@H](C4)C3)cc2F)C[C@H](C)O1	ZINC000853865764	FH	On-Demand	Anodyne	NPY2R	62	36
CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853865834	GI	On-Demand	Anodyne	NPY2R	60	35
CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853865835	GI	On-Demand	Anodyne	NPY2R	60	35
CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853865836	GI	On-Demand	Anodyne	NPY2R	60	35
O=C(Nc1cccc(N2CCOC2=O)c1)N1CCc2nccnc2C1	ZINC000853865885	EE	On-Demand	Anodyne	P2RY14	51	36
CN1CCN(c2ccccc2NC(=O)N2CCc3nccnc3C2)CC1	ZINC000853865959	FD	On-Demand	Anodyne	HTR1A	17	42
CN1CCN(c2ccccc2NC(=O)N2CCc3nccnc3C2)CC1	ZINC000853865959	FD	On-Demand	Anodyne	HTR1D	15	42
CN1CCN(c2ccccc2NC(=O)N2CCc3nccnc3C2)CC1	ZINC000853865959	FD	On-Demand	Anodyne	HTR1B	30	42
CN1CCN(c2ccccc2NC(=O)N2CCc3nccnc3C2)CC1	ZINC000853865959	FD	On-Demand	Anodyne	KCNQ2	73	40
CN1CCN(c2ccccc2NC(=O)N2CCc3nccnc3C2)CC1	ZINC000853865959	FD	On-Demand	Anodyne	P2RY14	42	31
C[C@H]1CN(c2ccc(NC(=O)N3CCc4nccnc4C3)cc2F)C[C@H](C)O1	ZINC000853866045	GF	On-Demand	Anodyne	NPY2R	66	35
C[C@H]1CN(c2ccc(NC(=O)N3CCc4nccnc4C3)cc2F)C[C@H](C)O1	ZINC000853866045	GF	On-Demand	Anodyne	P2RY14	46	33
C[C@H]1CN(c2ccc(NC(=O)N3CCc4nccnc4C3)cc2F)C[C@@H](C)O1	ZINC000853866048	GF	On-Demand	Anodyne	NPY2R	66	35
C[C@H]1CN(c2ccc(NC(=O)N3CCc4nccnc4C3)cc2F)C[C@@H](C)O1	ZINC000853866048	GF	On-Demand	Anodyne	P2RY14	46	33
CN1CCN(c2ccccc2NC(=O)N2C[C@H]3CC[C@@H](C3)C2)CC1	ZINC000853866069	EF	On-Demand	Anodyne	HTR1B	16	44
CN1CCN(c2ccccc2NC(=O)N2C[C@H]3CC[C@@H](C3)C2)CC1	ZINC000853866069	EF	On-Demand	Anodyne	KCNQ2	75	42
CN1CCN(c2ccccc2NC(=O)N2C[C@H]3CC[C@@H](C3)C2)CC1	ZINC000853866069	EF	On-Demand	Anodyne	RBP4	55	36
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@]1(C)CO	ZINC000853866194	CE	On-Demand	Anodyne	G2YM83_BOTF4	76	39
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@]1(C)CO	ZINC000853866195	CE	On-Demand	Anodyne	G2YM83_BOTF4	76	39
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@]1(C)CO	ZINC000853866196	CE	On-Demand	Anodyne	G2YM83_BOTF4	76	39
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@]1(C)CO	ZINC000853866197	CE	On-Demand	Anodyne	G2YM83_BOTF4	76	39
CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853866200	EG	On-Demand	Anodyne	HTR1A	21	44
CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853866200	EG	On-Demand	Anodyne	HTR1B	15	44
CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853866200	EG	On-Demand	Anodyne	KCNQ2	74	41
Cc1nc(NC(=O)N2CCc3nccnc3C2)sc1C	ZINC000853866222	CE	On-Demand	Anodyne	P2RY14	41	31
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@]1(C)CO	ZINC000853866288	ED	On-Demand	Anodyne	HTR1B	15	42
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@]1(C)CO	ZINC000853866288	ED	On-Demand	Anodyne	KCNQ2	73	40
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@]1(C)CO	ZINC000853866289	ED	On-Demand	Anodyne	HTR1B	15	42
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@]1(C)CO	ZINC000853866289	ED	On-Demand	Anodyne	KCNQ2	73	40
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@]1(C)CO	ZINC000853866290	ED	On-Demand	Anodyne	HTR1B	15	42
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@]1(C)CO	ZINC000853866290	ED	On-Demand	Anodyne	KCNQ2	73	40
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@]1(C)CO	ZINC000853866291	ED	On-Demand	Anodyne	HTR1B	15	42
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@]1(C)CO	ZINC000853866291	ED	On-Demand	Anodyne	KCNQ2	73	40
CC1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccnc1Cl	ZINC000853866310	CH	On-Demand	Anodyne	G2YM83_BOTF4	78	45
O=C(N1CCC(N2CC[C@H](O)C2)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853866363	GD	On-Demand	Bother	CACNA1D	54	33
O=C(N1CCC(N2CC[C@@H](O)C2)CC1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853866364	GD	On-Demand	Bother	CACNA1D	54	33
C[C@H]1CN(c2ccc(NC(=O)NC[C@H]3CCOC3(C)C)cc2F)C[C@@H](C)O1	ZINC000853866373	GG	On-Demand	Anodyne	NPY2R	55	36
C[C@H]1CN(c2ccc(NC(=O)NC[C@@H]3CCOC3(C)C)cc2F)C[C@@H](C)O1	ZINC000853866375	GG	On-Demand	Anodyne	NPY2R	55	36
O=C(N1CCC(N2CC[C@@H](O)C2)CC1)C(F)(F)c1ccccc1F	ZINC000853866378	ED	On-Demand	Anodyne	L3MBTL3	53	37
O=C(N1CCC(N2CC[C@H](O)C2)CC1)C(F)(F)c1ccccc1F	ZINC000853866379	ED	On-Demand	Anodyne	L3MBTL3	53	37
O=C(c1nc(Br)cs1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853866395	FD	On-Demand	Anodyne	L3MBTL3	73	38
O=C(c1nc(Br)cs1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853866396	FD	On-Demand	Anodyne	L3MBTL3	73	38
CN1CCN(c2ccccc2NC(=O)N2CCC(N3CC[C@@H](O)C3)CC2)CC1	ZINC000853866413	GD	On-Demand	Anodyne	KCNQ2	69	40
CN1CCN(c2ccccc2NC(=O)N2CCC(N3CC[C@@H](O)C3)CC2)CC1	ZINC000853866413	GD	On-Demand	Anodyne	L3MBTL3	42	35
CN1CCN(c2ccccc2NC(=O)N2CCC(N3CC[C@H](O)C3)CC2)CC1	ZINC000853866415	GD	On-Demand	Anodyne	KCNQ2	69	40
CN1CCN(c2ccccc2NC(=O)N2CCC(N3CC[C@H](O)C3)CC2)CC1	ZINC000853866415	GD	On-Demand	Anodyne	L3MBTL3	42	35
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccc(F)cn1	ZINC000853866426	FE	On-Demand	Clean	STAT6	42	32
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ccc(F)cn1	ZINC000853866426	FE	On-Demand	Clean	SLC27A1	50	33
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H](C)[C@](C)(CO)C3)cc2F)C[C@@H](C)O1	ZINC000853866478	GF	On-Demand	Anodyne	NPY2R	64	35
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866483	GF	On-Demand	Anodyne	HTR1A	18	41
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866483	GF	On-Demand	Anodyne	DRD2	15	41
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866483	GF	On-Demand	Anodyne	HTR1D	15	41
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866483	GF	On-Demand	Anodyne	MC4R	49	38
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866483	GF	On-Demand	Anodyne	KCNQ2	85	46
CN1CCN(c2ccccc2NC(=O)N[C@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866483	GF	On-Demand	Anodyne	NPY2R	60	41
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H](C)[C@@](C)(CO)C3)cc2F)C[C@@H](C)O1	ZINC000853866484	GF	On-Demand	Anodyne	NPY2R	64	35
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866485	GF	On-Demand	Anodyne	HTR1A	18	41
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866485	GF	On-Demand	Anodyne	DRD2	15	41
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866485	GF	On-Demand	Anodyne	HTR1D	15	41
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866485	GF	On-Demand	Anodyne	MC4R	49	38
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866485	GF	On-Demand	Anodyne	KCNQ2	85	46
CN1CCN(c2ccccc2NC(=O)N[C@@H](CO)c2ccc(F)cc2F)CC1	ZINC000853866485	GF	On-Demand	Anodyne	NPY2R	60	41
COCc1cc([N+](=O)[O-])ccc1N(C)CCN(C)C(=O)OC	ZINC000853866536	DD	On-Demand	Bother	CACNA1D	46	35
Cc1nc(NC(=O)N2C[C@H](C)[C@@](C)(CO)C2)sc1-c1ccccc1	ZINC000853866552	EH	On-Demand	Anodyne	PIK3CG	19	41
Cc1nc(NC(=O)N2C[C@@H](C)[C@@](C)(CO)C2)sc1-c1ccccc1	ZINC000853866553	EH	On-Demand	Anodyne	PIK3CG	19	41
Cc1nc(NC(=O)N2C[C@H](C)[C@](C)(CO)C2)sc1-c1ccccc1	ZINC000853866554	EH	On-Demand	Anodyne	PIK3CG	19	41
Cc1nc(NC(=O)N2C[C@@H](C)[C@](C)(CO)C2)sc1-c1ccccc1	ZINC000853866555	EH	On-Demand	Anodyne	PIK3CG	19	41
O=C(N1CCCCC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853866605	CD	On-Demand	Anodyne	L3MBTL3	85	43
O=C(N1CCCCC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853866606	CD	On-Demand	Anodyne	L3MBTL3	85	43
O=C(Nc1ccc(N2CCOCC2)cn1)N1CCCC[C@H]1CC1CCC1	ZINC000853866616	FG	On-Demand	Anodyne	STAT6	52	32
O=C(Nc1ccc(N2CCOCC2)cn1)N1CCCC[C@@H]1CC1CCC1	ZINC000853866617	FG	On-Demand	Anodyne	STAT6	52	32
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	HTR2A	42	44
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	HTR2C	18	44
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	PDGFRB	44	40
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	FLT4	29	40
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	PDGFRA	50	38
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	FLT3	24	40
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	CSF1R	17	40
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	QPCT	25	42
COCCn1cc(NC(=O)Nc2ccc3cc(OC)c(OC)cc3c2)cn1	ZINC000853866679	FG	On-Demand	Anodyne	ENPP1	72	37
Cc1nc(NC(=O)N2CCC(N3CC[C@H](O)C3)CC2)sc1-c1ccccc1	ZINC000853866691	GG	On-Demand	Anodyne	PIK3CG	17	45
Cc1nc(NC(=O)N2CCC(N3CC[C@@H](O)C3)CC2)sc1-c1ccccc1	ZINC000853866692	GG	On-Demand	Anodyne	PIK3CG	17	45
COc1ccc(N2CC[C@H](NC(=O)NCc3ccc(F)cn3)C2)cc1	ZINC000853866723	EE	On-Demand	Clean	NPBWR1	60	33
Cc1nsc(C(=O)N2CCC[C@@]2(C)Cc2ccccc2C(F)(F)F)n1	ZINC000853866782	FI	On-Demand	Anodyne	SLC16A1	49	36
Cc1nsc(C(=O)N2CCC[C@]2(C)Cc2ccccc2C(F)(F)F)n1	ZINC000853866784	FI	On-Demand	Anodyne	SLC16A1	49	36
O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NCc1ccc(F)cn1	ZINC000853866785	GD	On-Demand	Clean	STAT6	41	31
O=C(NCc1ccc(N2CCS(=O)(=O)CC2)cc1)NCc1ccc(F)cn1	ZINC000853866785	GD	On-Demand	Clean	SLC27A1	48	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(F)cn1	ZINC000853866788	FF	On-Demand	Anodyne	GPR119	47	41
CN1CCN(c2ccccc2NC(=O)N(CCC2CC2)CC2CC2)CC1	ZINC000853866814	FG	On-Demand	Anodyne	DRD2	15	43
CN1CCN(c2ccccc2NC(=O)N(CCC2CC2)CC2CC2)CC1	ZINC000853866814	FG	On-Demand	Anodyne	DRD3	15	43
CN1CCN(c2ccccc2NC(=O)N(CCC2CC2)CC2CC2)CC1	ZINC000853866814	FG	On-Demand	Anodyne	KCNQ2	74	39
CN1CCN(c2ccccc2NC(=O)N2CCCC[C@H]2CC2CCC2)CC1	ZINC000853866830	FI	On-Demand	Anodyne	KCNQ2	81	43
CN1CCN(c2ccccc2NC(=O)N2CCCC[C@@H]2CC2CCC2)CC1	ZINC000853866832	FI	On-Demand	Anodyne	KCNQ2	81	43
N#Cc1cc(C(=O)N2CCC(N3CCOC3=O)CC2)c[nH]1	ZINC000853866840	CC	On-Demand	Mild	L3MBTL3	73	36
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)C(C)(C)C)CC1	ZINC000853866859	FG	On-Demand	Anodyne	KCNQ2	84	44
CN1CCN(c2ccccc2NC(=O)NCC(F)(F)C(C)(C)C)CC1	ZINC000853866859	FG	On-Demand	Anodyne	P2RY1	45	39
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853866868	FH	On-Demand	Anodyne	MME	48	37
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853866869	FH	On-Demand	Anodyne	MME	48	37
O=C(N[C@@H](Cc1ccccc1)C(F)(F)F)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853866871	FH	On-Demand	Anodyne	MME	48	37
O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853866885	FH	On-Demand	Anodyne	NPY5R	23	43
O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853866885	FH	On-Demand	Anodyne	MTOR	68	36
O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853866885	FH	On-Demand	Anodyne	EPHX2	27	43
O=C(Nc1ccc(-c2ccccc2)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853866885	FH	On-Demand	Anodyne	SMO	23	46
O=C(Nc1cccc(N2CCOC2=O)c1)NC1CCC(C2CCC2)CC1	ZINC000853866967	FI	On-Demand	Anodyne	EPHX2	42	43
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCOC2(C)C)CC1	ZINC000853867011	EE	On-Demand	Anodyne	KCNQ2	73	38
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCOC2(C)C)CC1	ZINC000853867012	EE	On-Demand	Anodyne	KCNQ2	73	38
Cc1nc(NC(=O)NC[C@@H]2CCOC2(C)C)sc1-c1ccccc1	ZINC000853867013	EI	On-Demand	Anodyne	PIK3CG	22	43
Cc1nc(NC(=O)NC[C@@H]2CCOC2(C)C)sc1-c1ccccc1	ZINC000853867013	EI	On-Demand	Anodyne	PI4KB	44	44
Cc1nc(NC(=O)NC[C@H]2CCOC2(C)C)sc1-c1ccccc1	ZINC000853867014	EI	On-Demand	Anodyne	PIK3CG	22	43
Cc1nc(NC(=O)NC[C@H]2CCOC2(C)C)sc1-c1ccccc1	ZINC000853867014	EI	On-Demand	Anodyne	PI4KB	44	44
CC(C)(C)C(F)(F)CNC(=O)Nc1cccnc1Cl	ZINC000853867112	CH	On-Demand	Anodyne	P2RY1	44	37
CC(C)(C)C(F)(F)CNC(=O)Nc1cccnc1Cl	ZINC000853867112	CH	On-Demand	Anodyne	G2YM83_BOTF4	71	36
C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)c3nccn3C)cc2F)C[C@@H](C)O1	ZINC000853867114	GG	On-Demand	Anodyne	NPY2R	71	38
C[C@H]1CN(c2ccc(NC(=O)N[C@@H](C)c3nccn3C)cc2F)C[C@@H](C)O1	ZINC000853867117	GG	On-Demand	Anodyne	NPY2R	71	38
CC(=O)c1cc(C(=O)N2CCC(N3CCOC3=O)CC2)n(C)c1	ZINC000853867141	DD	On-Demand	Anodyne	L3MBTL3	41	32
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	CA2	74	49
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	CA1	66	49
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	CA7	40	39
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	CA4	69	49
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	CA12	49	40
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	CA9	49	48
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	F13A1	47	36
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	MTCA1	49	48
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@H]2CC2CCC2)cc1	ZINC000853867206	FF	On-Demand	Anodyne	P96878_MYCTU	60	48
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	CA2	74	49
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	CA1	66	49
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	CA7	40	39
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	CA4	69	49
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	CA12	49	40
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	CA9	49	48
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	F13A1	47	36
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	MTCA1	49	48
NS(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H]2CC2CCC2)cc1	ZINC000853867207	FF	On-Demand	Anodyne	P96878_MYCTU	60	48
C[C@@H]1[C@@H](c2cccc(Cl)c2)OCCN1c1nccc2c1C(=O)OC2(C)C	ZINC000853867233	FI	On-Demand	Anodyne	MDM2	102	34
O=C(Nc1cccc(Cl)c1Cl)N1CCC(N2CCOC2=O)CC1	ZINC000853867274	FG	On-Demand	Anodyne	SMO	24	46
O=C(Nc1ccc(F)c(F)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853867277	EE	On-Demand	Anodyne	CACNA1H	39	42
CN1C[C@H](CNc2ccnc3c(F)cccc23)CC1=O	ZINC000853867288	CE	On-Demand	Anodyne	HRP1_PLAFA	90	36
CN1C[C@H](CNc2ccnc3c(F)cccc23)CC1=O	ZINC000853867288	CE	On-Demand	Anodyne	HNMT	40	32
CN1C[C@@H](CNc2ccnc3c(F)cccc23)CC1=O	ZINC000853867289	CE	On-Demand	Anodyne	HRP1_PLAFA	90	36
CN1C[C@@H](CNc2ccnc3c(F)cccc23)CC1=O	ZINC000853867289	CE	On-Demand	Anodyne	HNMT	40	32
C[C@H](NC(=O)Nc1cccnc1Cl)c1nccn1C	ZINC000853867308	CE	On-Demand	Anodyne	G2YM83_BOTF4	59	34
O=C(Nc1cccc(Br)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853867313	FF	On-Demand	Anodyne	SCD1	18	47
O=C(Nc1cccc(Br)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853867313	FF	On-Demand	Anodyne	LIMK2	19	43
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853867314	FG	On-Demand	Anodyne	P2RY1	43	44
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853867314	FG	On-Demand	Anodyne	CTSS	15	40
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853867314	FG	On-Demand	Anodyne	EPHX2	78	49
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853867314	FG	On-Demand	Anodyne	TRPM8	32	48
O=C(Nc1ccc(OC(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853867314	FG	On-Demand	Anodyne	TRAR	26	42
O=C(Nc1ccc(N2CCOCC2)cn1)N1CCC(N2CCOC2=O)CC1	ZINC000853867350	GD	On-Demand	Anodyne	STAT6	42	30
O=C(N[C@H]1CCCCc2cc(Br)ccc21)n1ccnc1	ZINC000853867354	EH	On-Demand	Anodyne	BDKRB1	46	34
O=C(N[C@@H]1CCCCc2cc(Br)ccc21)n1ccnc1	ZINC000853867355	EH	On-Demand	Anodyne	BDKRB1	46	34
O=C(N1CCCC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853867378	CC	On-Demand	Anodyne	L3MBTL3	86	41
O=C(N1CCCC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853867379	CC	On-Demand	Anodyne	L3MBTL3	86	41
CN1CCN(c2ccccc2NC(=O)N[C@H]2[C@@H]3c4ccc(F)cc4C[C@H]32)CC1	ZINC000853867416	GG	On-Demand	Anodyne	KCNQ2	75	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]32)CC1	ZINC000853867417	GG	On-Demand	Anodyne	KCNQ2	75	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@H]32)CC1	ZINC000853867418	GG	On-Demand	Anodyne	KCNQ2	75	43
CN1CCN(c2ccccc2NC(=O)N[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)CC1	ZINC000853867419	GG	On-Demand	Anodyne	KCNQ2	75	43
CN1C[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853867467	CD	On-Demand	Bother	GSTM2	114	43
CN1C[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853867467	CD	On-Demand	Bother	GSTP1	70	43
CN1C[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853867467	CD	On-Demand	Bother	EPAS1	52	31
CN1C[C@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853867468	CD	On-Demand	Bother	GSTM2	114	43
CN1C[C@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853867468	CD	On-Demand	Bother	GSTP1	70	43
CN1C[C@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853867468	CD	On-Demand	Bother	EPAS1	52	31
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NCc2ccc(F)cn2)C3)cn1	ZINC000853867496	FD	On-Demand	Anodyne	MAPK1	42	39
O=C(C(=O)N1CCC(N2CC[C@H](O)C2)CC1)C1CCSCC1	ZINC000853867509	EC	On-Demand	Anodyne	L3MBTL3	42	33
O=C(C(=O)N1CCC(N2CC[C@@H](O)C2)CC1)C1CCSCC1	ZINC000853867510	EC	On-Demand	Anodyne	L3MBTL3	42	33
CC[C@@H]1CN(S(C)(=O)=O)CC[C@@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853867514	FD	On-Demand	Reactive	CCR3	36	42
CC[C@@H]1CN(S(C)(=O)=O)CC[C@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853867515	FD	On-Demand	Reactive	CCR3	36	42
C#CCNC(=O)c1ccc(N[C@@H](C)CN2CCC(C)CC2)nc1	ZINC000853867611	DD	On-Demand	Mild	CACNA1I	60	37
C#CCNC(=O)c1ccc(N[C@H](C)CN2CCC(C)CC2)nc1	ZINC000853867612	DD	On-Demand	Mild	CACNA1I	60	37
C#Cc1cnc(N[C@H](C)CN2CCC(C)CC2)nc1	ZINC000853867640	CD	On-Demand	Mild	EBP	16	42
C#Cc1cnc(N[C@@H](C)CN2CCC(C)CC2)nc1	ZINC000853867641	CD	On-Demand	Mild	EBP	16	42
O=C1OCCN1C1CCN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000853867647	GE	On-Demand	Bother	SLC27A4	43	33
O=C(Nc1cc(F)cc(F)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853867677	EE	On-Demand	Anodyne	CACNA1H	33	44
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	ACE	32	40
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	MME	104	40
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	ANPEP	65	34
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	PAPA1_CARPA	42	35
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	CPA1	42	39
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	CAPNS1	42	31
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	CAPN1	40	36
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	CAPN2	45	31
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	ACE2	74	39
CC[C@H](C)N(CC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867693	DH	On-Demand	Anodyne	NPR	40	34
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	ACE	32	40
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	MME	104	40
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	ANPEP	65	34
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	PAPA1_CARPA	42	35
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	CPA1	42	39
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	CAPNS1	42	31
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	CAPN1	40	36
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	CAPN2	45	31
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	ACE2	74	39
CC[C@H](C)N(CC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867694	DH	On-Demand	Anodyne	NPR	40	34
C=C[C@H](CO)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853867713	DD	On-Demand	Mild	KCNQ2	86	46
CC(=O)Nc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853867719	EE	On-Demand	Anodyne	SCD1	19	48
O=C(N[C@H](CO)c1ccc(F)cc1F)N1CCOCC1	ZINC000853867722	CD	On-Demand	Anodyne	MAPK1	45	41
O=C(N[C@@H](CO)c1ccc(F)cc1F)N1CCOCC1	ZINC000853867723	CD	On-Demand	Anodyne	MAPK1	45	41
C#CCCN(CCOC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867727	EF	On-Demand	Mild	PAPA1_CARPA	41	38
C#CCCN(CCOC)C(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867727	EF	On-Demand	Mild	CTRB_BOVIN	43	29
C#CCCN(CCOC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867728	EF	On-Demand	Mild	PAPA1_CARPA	41	38
C#CCCN(CCOC)C(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867728	EF	On-Demand	Mild	CTRB_BOVIN	43	29
CN1CCN(c2ccccc2NC(=O)N2CCC(N3CCOC3=O)CC2)CC1	ZINC000853867746	GD	On-Demand	Anodyne	KCNQ2	67	39
COc1ccc2c(NC[C@H]3CC(=O)N(C)C3)ccnc2c1	ZINC000853867765	CE	On-Demand	Anodyne	HRP1_PLAFA	134	46
COc1ccc2c(NC[C@H]3CC(=O)N(C)C3)ccnc2c1	ZINC000853867765	CE	On-Demand	Anodyne	HNMT	65	38
COc1ccc2c(NC[C@@H]3CC(=O)N(C)C3)ccnc2c1	ZINC000853867766	CE	On-Demand	Anodyne	HRP1_PLAFA	134	46
COc1ccc2c(NC[C@@H]3CC(=O)N(C)C3)ccnc2c1	ZINC000853867766	CE	On-Demand	Anodyne	HNMT	65	38
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)n1	ZINC000853867821	DD	On-Demand	Anodyne	GRM5	15	43
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)n1	ZINC000853867821	DD	On-Demand	Anodyne	SORT1	16	40
O=C(Nc1ccc(-c2ncon2)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853867822	FE	On-Demand	Anodyne	MTOR	81	38
O=C(Nc1ccc2c(c1)OCCO2)N1CCC(N2CCOC2=O)CC1	ZINC000853867823	ED	On-Demand	Anodyne	SCD1	15	41
O=C(Nc1ccc(Cl)cn1)N1CCC(N2CCOC2=O)CC1	ZINC000853867864	DE	On-Demand	Anodyne	F10	36	40
O=C(Nc1ccc(Cl)cn1)N1CCC(N2CCOC2=O)CC1	ZINC000853867864	DE	On-Demand	Anodyne	NPY5R	15	52
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867876	DD	On-Demand	Anodyne	MME	65	38
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867876	DD	On-Demand	Anodyne	PAPA1_CARPA	59	39
CON(C)CCNC(=O)N[C@H](Cc1ccccc1)C(F)(F)F	ZINC000853867876	DD	On-Demand	Anodyne	CTSF	43	32
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867877	DD	On-Demand	Anodyne	MME	65	38
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867877	DD	On-Demand	Anodyne	PAPA1_CARPA	59	39
CON(C)CCNC(=O)N[C@@H](Cc1ccccc1)C(F)(F)F	ZINC000853867877	DD	On-Demand	Anodyne	CTSF	43	32
COCCN(CCF)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853867913	FF	On-Demand	Anodyne	CTSG	24	41
COCCN(CCF)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853867913	FF	On-Demand	Anodyne	CTRB1	37	41
COCCN(CCF)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853867913	FF	On-Demand	Anodyne	AMY2	54	31
COCCN(CCF)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853867913	FF	On-Demand	Anodyne	CELA2A	21	41
O=C(Nc1cccc2ccccc12)N1CCC(N2CCOC2=O)CC1	ZINC000853867915	EG	On-Demand	Anodyne	CCR8	67	36
COC(=O)c1sccc1NC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853867920	FD	On-Demand	Anodyne	FAS	27	40
CCOC(=O)CC1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CCOCC1	ZINC000853867922	GH	On-Demand	Anodyne	PIK3CA	20	41
CCOC(=O)CC1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CCOCC1	ZINC000853867922	GH	On-Demand	Anodyne	MTOR	52	41
CCOC(=O)CC1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CCOCC1	ZINC000853867922	GH	On-Demand	Anodyne	SLC1A1	22	40
CCOC(=O)CC1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CCOCC1	ZINC000853867922	GH	On-Demand	Anodyne	EPHX2	18	41
CCOC(=O)CC1(NC(=O)Nc2ccc(-c3ccccc3)cc2)CCOCC1	ZINC000853867922	GH	On-Demand	Anodyne	SLC1A2	38	40
Cn1ccnc1C(=O)NCC1(CC(N)=O)CCCCC1	ZINC000853867923	CC	On-Demand	Anodyne	HCN1	51	32
Cn1ccnc1C(=O)NCC1(CC(N)=O)CCCCC1	ZINC000853867923	CC	On-Demand	Anodyne	HCN4	49	32
Cc1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1Cl	ZINC000853867940	EG	On-Demand	Anodyne	EPHX2	19	44
Cc1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1Cl	ZINC000853867940	EG	On-Demand	Anodyne	SCD1	18	42
CC(C)(C)OC(=O)C1(CNC(=O)Nc2cccnc2Cl)CCC1	ZINC000853867962	EG	On-Demand	Anodyne	G2YM83_BOTF4	71	37
O=C(Nc1cccc(N2CCNC2=O)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853867967	FD	On-Demand	Anodyne	SCD1	16	40
COC(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853867989	ED	On-Demand	Anodyne	EPHX2	16	42
COC(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853867989	ED	On-Demand	Anodyne	SCD1	18	51
COC(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853867989	ED	On-Demand	Anodyne	KCNK3	61	33
COC(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853867989	ED	On-Demand	Anodyne	KCNK9	42	32
O=C(C(=O)N1CCC(N2CCOC2=O)CC1)c1ccc(F)cc1	ZINC000853868000	DD	On-Demand	Anodyne	L3MBTL3	52	34
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1C	ZINC000853868055	DF	On-Demand	Anodyne	CCR8	41	32
C=C[C@H](CO)NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853868091	EE	On-Demand	Mild	ROCK1	27	41
C=C[C@H](CO)NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853868091	EE	On-Demand	Mild	SCD1	41	45
C=C[C@H](CO)NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853868091	EE	On-Demand	Mild	SCD	39	49
O=C1NC(=O)c2cc(NC(=O)N3CCC(N4CCOC4=O)CC3)ccc21	ZINC000853868120	FD	On-Demand	Anodyne	CASP2	15	41
COc1ccccc1NC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853868122	DE	On-Demand	Anodyne	RBP4	31	42
COc1ccccc1NC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853868122	DE	On-Demand	Anodyne	SCD1	15	40
COc1ccccc1NC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853868122	DE	On-Demand	Anodyne	SMO	26	49
Cc1nc(NC(=O)N2CCC(N3CCOC3=O)CC2)sc1-c1ccccc1	ZINC000853868169	GH	On-Demand	Anodyne	PIK3CG	20	43
CCOC(=O)[C@@]1(C)CCC[C@H]1NC(=O)Nc1cccnc1Cl	ZINC000853868201	EF	On-Demand	Anodyne	G2YM83_BOTF4	73	36
CCOC(=O)[C@@]1(C)CCC[C@@H]1NC(=O)Nc1cccnc1Cl	ZINC000853868203	EF	On-Demand	Anodyne	G2YM83_BOTF4	73	36
O=C(N1CCCC1)N1CCOc2cc(Br)ccc2C1	ZINC000853868207	EF	On-Demand	Anodyne	AKR1C3	15	43
Cc1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1C	ZINC000853868232	DF	On-Demand	Anodyne	SCD1	17	41
O=C(C(=O)N1CCC(N2CCOC2=O)CC1)c1ccc(Cl)cc1	ZINC000853868244	ED	On-Demand	Anodyne	L3MBTL3	44	34
O=C(Nc1ccc(F)c(Cl)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868251	EF	On-Demand	Anodyne	CACNA1H	44	41
O=C(Nc1ccc(F)c(Cl)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868251	EF	On-Demand	Anodyne	EPHX2	26	41
O=C(Nc1ccc(F)c(Cl)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868251	EF	On-Demand	Anodyne	SCD1	18	41
CN1C[C@@H](CNc2nccc(N3CCCC3)n2)CC1=O	ZINC000853868255	CC	On-Demand	Anodyne	SORD	62	33
CN1C[C@@H](CNc2nccc(N3CCCC3)n2)CC1=O	ZINC000853868255	CC	On-Demand	Anodyne	MRGPRX1	42	36
CN1C[C@H](CNc2nccc(N3CCCC3)n2)CC1=O	ZINC000853868256	CC	On-Demand	Anodyne	SORD	62	33
CN1C[C@H](CNc2nccc(N3CCCC3)n2)CC1=O	ZINC000853868256	CC	On-Demand	Anodyne	MRGPRX1	42	36
CC(C)c1ccccc1NC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853868273	EG	On-Demand	Anodyne	SMO	23	50
NC(=O)CC1(CNC(=O)Nc2cccnc2Cl)CCCCC1	ZINC000853868281	DF	On-Demand	Anodyne	G2YM83_BOTF4	71	36
CCOC(=O)CC1(NC(=O)Nc2cccnc2Cl)CCOCC1	ZINC000853868285	EE	On-Demand	Anodyne	G2YM83_BOTF4	72	38
O=C(Nc1ccc(Cl)c(Cl)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868288	FG	On-Demand	Anodyne	CCR2	15	54
O=C(Nc1ccc(Cl)c(Cl)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868288	FG	On-Demand	Anodyne	SCD1	21	41
OC(CNc1nc(-c2cccnc2)nc2ccccc12)(C1CC1)C1CC1	ZINC000853868297	EH	On-Demand	Anodyne	PKN2	22	42
OC(CNc1nc(-c2cccnc2)nc2ccccc12)(C1CC1)C1CC1	ZINC000853868297	EH	On-Demand	Anodyne	PKN1	17	42
O=C(Nc1ccc2c(c1)OCO2)N1CCC(N2CCOC2=O)CC1	ZINC000853868308	ED	On-Demand	Anodyne	TRPC6	26	40
O=C(Nc1ccc2c(c1)OCO2)N1CCC(N2CCOC2=O)CC1	ZINC000853868308	ED	On-Demand	Anodyne	TRPC3	29	40
Cc1cccc(NC(=O)N2CC(O)(c3ccc(Br)cc3)C2)n1	ZINC000853868336	FF	On-Demand	Anodyne	GRM5	16	44
Cc1cccc(NC(=O)N2CC(O)(c3ccc(Br)cc3)C2)n1	ZINC000853868336	FF	On-Demand	Anodyne	SORT1	21	45
O=C(N1CCCC1)N1CCC(N2CCOC2=O)CC1	ZINC000853868343	CD	On-Demand	Anodyne	L3MBTL3	56	36
Cc1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868348	DE	On-Demand	Anodyne	MTOR	58	33
Cc1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868348	DE	On-Demand	Anodyne	EPHX2	26	41
Cc1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868348	DE	On-Demand	Anodyne	TRPM8	16	43
O=C(Nc1cccc(-c2nnc3n2CCC3)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868352	GE	On-Demand	Anodyne	SCD1	16	40
CC(=O)c1c[nH]c(C(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868353	DD	On-Demand	Anodyne	L3MBTL3	67	34
CN(C[C@@H]1CCc2ccccc21)C(=O)Nc1cccnc1Cl	ZINC000853868355	DH	On-Demand	Anodyne	G2YM83_BOTF4	77	44
O=C(Nc1ncc(-c2ccccc2)s1)N1CCC(N2CCOC2=O)CC1	ZINC000853868356	FG	On-Demand	Anodyne	NPY5R	21	55
O=C(NCc1nc(C2CC2)cs1)NNc1nc2ccc(Cl)cc2s1	ZINC000853868362	GI	On-Demand	Reactive	CSNK1D	33	42
O=C(Nc1nc2ccccc2s1)N1CCC(N2CCOC2=O)CC1	ZINC000853868368	EF	On-Demand	Anodyne	LTA4H	20	52
O=C(Nc1nc2ccccc2s1)N1CCC(N2CCOC2=O)CC1	ZINC000853868368	EF	On-Demand	Anodyne	BCL2L1	52	33
Cc1cccc2c1CCC[C@@H]2NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853868374	FI	On-Demand	Anodyne	CCKBR	41	38
Cc1cccc2c1CCC[C@H]2NC(=O)Nc1cccc(N2CCOC2=O)c1	ZINC000853868375	FI	On-Demand	Anodyne	CCKBR	41	38
O=C(Nc1cccc2cccnc12)N1CCC(N2CCOC2=O)CC1	ZINC000853868382	EF	On-Demand	Anodyne	WNT3	19	47
O=C(Nc1cccc2cccnc12)N1CCC(N2CCOC2=O)CC1	ZINC000853868382	EF	On-Demand	Anodyne	TNKS	17	46
O=C(Nc1ncc(Cc2ccccc2)s1)N1CCC(N2CCOC2=O)CC1	ZINC000853868386	GG	On-Demand	Anodyne	CDK5	35	40
O=C(Nc1ncc(Cc2ccccc2)s1)N1CCC(N2CCOC2=O)CC1	ZINC000853868386	GG	On-Demand	Anodyne	MGEA5	34	41
COC(=O)/C=C\c1ccc(NCC(O)(C2CC2)C2CC2)c([N+](=O)[O-])c1	ZINC000853868416	EF	On-Demand	Bother	NR1H4	45	37
O=C(Nc1cccc(N2CCOC2=O)c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868439	FE	On-Demand	Anodyne	SCD1	17	43
O=C(Nc1ccc(F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853868455	DE	On-Demand	Anodyne	HTR1F	20	47
O=C(Nc1ccc(F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853868455	DE	On-Demand	Anodyne	SCD1	18	40
O=C(Nc1ccc(F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853868455	DE	On-Demand	Anodyne	TRPM8	46	37
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868480	DE	On-Demand	Anodyne	CCKAR	20	40
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868480	DE	On-Demand	Anodyne	CCKBR	28	40
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868480	DE	On-Demand	Anodyne	SCD1	18	47
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868480	DE	On-Demand	Anodyne	LIMK2	19	44
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868480	DE	On-Demand	Anodyne	KCNK3	65	38
Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868480	DE	On-Demand	Anodyne	KCNK9	48	38
O=C(Nc1ccccc1C(F)(F)F)N1CCC(N2CCOC2=O)CC1	ZINC000853868482	FG	On-Demand	Anodyne	RBP4	98	51
O=C(Nc1ccccc1C(F)(F)F)N1CCC(N2CCOC2=O)CC1	ZINC000853868482	FG	On-Demand	Anodyne	SMO	18	49
O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868491	EE	On-Demand	Bother	SCD1	15	43
O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC(N2CCOC2=O)CC1	ZINC000853868491	EE	On-Demand	Bother	LUXR	16	41
CN1CCN(c2ccccc2NC(=O)NCC2(CC(N)=O)CCCCC2)CC1	ZINC000853868494	GE	On-Demand	Anodyne	KCNQ2	79	41
NS(=O)(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868499	FC	On-Demand	Anodyne	CA2	49	44
NS(=O)(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868499	FC	On-Demand	Anodyne	CA1	44	44
NS(=O)(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868499	FC	On-Demand	Anodyne	CA4	37	41
NS(=O)(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868499	FC	On-Demand	Anodyne	CA12	40	36
NS(=O)(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868499	FC	On-Demand	Anodyne	CA9	39	44
NS(=O)(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868499	FC	On-Demand	Anodyne	MTCA1	46	42
NS(=O)(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868499	FC	On-Demand	Anodyne	P96878_MYCTU	58	42
N#Cc1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868544	DE	On-Demand	Mild	TRPM8	15	47
O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853868545	FG	On-Demand	Anodyne	TRPV1	18	53
O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853868545	FG	On-Demand	Anodyne	EPHX2	54	46
O=C(Nc1ccc(C(F)(F)F)cc1)N1CCC(N2CCOC2=O)CC1	ZINC000853868545	FG	On-Demand	Anodyne	TRPM8	75	48
N#Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868594	DE	On-Demand	Mild	CCR3	19	41
N#Cc1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868594	DE	On-Demand	Mild	SCD1	17	43
C#CCCN(CCOC)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868595	FF	On-Demand	Mild	CTSG	21	41
C#CCCN(CCOC)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868595	FF	On-Demand	Mild	CTRB1	33	41
C#CCCN(CCOC)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868595	FF	On-Demand	Mild	AMY2	51	30
C#CCCN(CCOC)C(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868595	FF	On-Demand	Mild	CELA2A	18	41
C#CCCN(CCOC)C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868596	FF	On-Demand	Mild	CTSG	21	41
C#CCCN(CCOC)C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868596	FF	On-Demand	Mild	CTRB1	33	41
C#CCCN(CCOC)C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868596	FF	On-Demand	Mild	AMY2	51	30
C#CCCN(CCOC)C(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868596	FF	On-Demand	Mild	CELA2A	18	41
COC(=O)N(C)CCNC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868597	FD	On-Demand	Anodyne	CTSG	25	42
COC(=O)N(C)CCNC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868597	FD	On-Demand	Anodyne	CTRB1	38	42
COC(=O)N(C)CCNC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868597	FD	On-Demand	Anodyne	AMY2	52	30
COC(=O)N(C)CCNC(=O)N[C@@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868597	FD	On-Demand	Anodyne	CELA2A	22	42
COC(=O)N(C)CCNC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868598	FD	On-Demand	Anodyne	CTSG	25	42
COC(=O)N(C)CCNC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868598	FD	On-Demand	Anodyne	CTRB1	38	42
COC(=O)N(C)CCNC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868598	FD	On-Demand	Anodyne	AMY2	52	30
COC(=O)N(C)CCNC(=O)N[C@H](c1ccccc1)C(C)(C)C(=O)OC	ZINC000853868598	FD	On-Demand	Anodyne	CELA2A	22	42
O=C(N1CCCCC1)N1CCC(N2CCOC2=O)CC1	ZINC000853868602	CD	On-Demand	Anodyne	L3MBTL3	49	36
CC(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868616	EE	On-Demand	Anodyne	SCD1	19	53
CC(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868616	EE	On-Demand	Anodyne	KCNK3	66	33
O=C(Nc1ccccc1Cl)N1CCC(N2CCOC2=O)CC1	ZINC000853868627	DF	On-Demand	Anodyne	EPHB3	50	35
O=C(Nc1ccccc1Cl)N1CCC(N2CCOC2=O)CC1	ZINC000853868627	DF	On-Demand	Anodyne	SMO	38	47
O=C(Nc1nccs1)N1CCC(N2CCOC2=O)CC1	ZINC000853868663	CD	On-Demand	Anodyne	MAP1	77	38
COc1ncccc1NC(=O)N1CCC(N2CCOC2=O)CC1	ZINC000853868673	DD	On-Demand	Anodyne	CALCRL	38	41
O=C(Nc1nc2c(s1)CCC2)N1CC(O)(c2ccc(Br)cc2)C1	ZINC000853868720	GG	On-Demand	Anodyne	SLC27A1	37	41
O=C(Nc1ccc(N2CCCC2)nc1)N1CCC(N2CCOC2=O)CC1	ZINC000853868721	FE	On-Demand	Anodyne	DGAT1	41	43
O=C(N1CCOCC1)N1CC(O)(c2ccc(Br)cc2)C1	ZINC000853868723	ED	On-Demand	Anodyne	AKR1C3	18	64
CCOC(=O)[C@@]1(C)CCC[C@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853868744	GF	On-Demand	Anodyne	KCNQ2	75	39
CCOC(=O)[C@@]1(C)CCC[C@@H]1NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853868745	GF	On-Demand	Anodyne	KCNQ2	75	39
CC(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868794	EE	On-Demand	Anodyne	MTOR	48	34
CC(=O)c1ccc(NC(=O)N2CCC(N3CCOC3=O)CC2)cc1	ZINC000853868794	EE	On-Demand	Anodyne	EPHX2	19	41
Cc1nc(O)cc(-c2ccc(NC(=O)N3CCC(N4CCOC4=O)CC3)cc2)n1	ZINC000853868797	GF	On-Demand	Anodyne	MTOR	78	35
NS(=O)(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868813	FC	On-Demand	Anodyne	CA2	17	45
NS(=O)(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868813	FC	On-Demand	Anodyne	CA4	19	45
NS(=O)(=O)c1cccc(NC(=O)N2CCC(N3CCOC3=O)CC2)c1	ZINC000853868813	FC	On-Demand	Anodyne	SCD1	15	42
O=C(Nc1ccc(Cl)nc1)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853868823	FH	On-Demand	Anodyne	SSTR3	36	50
O=C(Nc1ccc(Cl)nc1)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853868823	FH	On-Demand	Anodyne	EPHX2	20	45
COc1ccccc1NC(=O)NCc1ccc(N2CCCNC2=O)cc1	ZINC000853868824	FF	On-Demand	Anodyne	MBTPS1	45	35
CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853868838	FG	On-Demand	Anodyne	CCR3	51	45
CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853868838	FG	On-Demand	Anodyne	ROCK2	18	40
CC(=O)c1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853868838	FG	On-Demand	Anodyne	EPHX2	16	40
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1ccc(N2CCCC2)nc1	ZINC000853868849	GF	On-Demand	Anodyne	NAMPT	52	41
Cc1nc(C(=O)NC[C@H]2CN(C)CCN2Cc2ccccc2)no1	ZINC000853868880	EC	On-Demand	Anodyne	SIGMAR1	25	44
Cc1nc(C(=O)NC[C@H]2CN(C)CCN2Cc2ccccc2)no1	ZINC000853868880	EC	On-Demand	Anodyne	PDE8B	51	31
Cc1nc(C(=O)NC[C@@H]2CN(C)CCN2Cc2ccccc2)no1	ZINC000853868881	EC	On-Demand	Anodyne	SIGMAR1	25	44
Cc1nc(C(=O)NC[C@@H]2CN(C)CCN2Cc2ccccc2)no1	ZINC000853868881	EC	On-Demand	Anodyne	PDE8B	51	31
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853868884	GF	On-Demand	Anodyne	CCR3	48	36
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853868884	GF	On-Demand	Anodyne	ROCK2	16	40
CC(=O)Nc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853868884	GF	On-Demand	Anodyne	NAMPT	36	40
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1cccnc1N1CCCC1	ZINC000853868886	GF	On-Demand	Anodyne	KCNQ2	45	35
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1nccs1	ZINC000853868888	EE	On-Demand	Anodyne	MAP1	86	37
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1ccc2c(c1)OCO2	ZINC000853868891	FF	On-Demand	Anodyne	NOS2	87	34
CN1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)CCC1=O	ZINC000853868905	ED	On-Demand	Bother	WDR5	37	41
Cc1cccc(NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)n1	ZINC000853868909	EH	On-Demand	Anodyne	GRM5	18	48
Cc1cccc(NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)n1	ZINC000853868909	EH	On-Demand	Anodyne	SORT1	16	44
Cc1cccc(NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)n1	ZINC000853868910	EH	On-Demand	Anodyne	GRM5	18	48
Cc1cccc(NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)n1	ZINC000853868910	EH	On-Demand	Anodyne	SORT1	16	44
Cc1cccc(NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)n1	ZINC000853868911	EH	On-Demand	Anodyne	GRM5	18	48
Cc1cccc(NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)n1	ZINC000853868911	EH	On-Demand	Anodyne	SORT1	16	44
Cc1cccc(NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)n1	ZINC000853868912	EH	On-Demand	Anodyne	GRM5	18	48
Cc1cccc(NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)n1	ZINC000853868912	EH	On-Demand	Anodyne	SORT1	16	44
Cc1nnc(NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)s1	ZINC000853868914	FG	On-Demand	Anodyne	FFAR2	25	42
Cc1nnc(NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)s1	ZINC000853868915	FG	On-Demand	Anodyne	FFAR2	25	42
Cc1nnc(NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)s1	ZINC000853868916	FG	On-Demand	Anodyne	FFAR2	25	42
Cc1nnc(NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)s1	ZINC000853868917	FG	On-Demand	Anodyne	FFAR2	25	42
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(=O)N(C)CC1	ZINC000853868951	DC	On-Demand	Bother	WDR5	40	44
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1nc2c(s1)CCCCC2	ZINC000853868952	GH	On-Demand	Anodyne	SLC27A1	38	48
CN1CCN(c2nc(-c3cccnc3)nc3ccccc23)CCC1=O	ZINC000853868964	EE	On-Demand	Anodyne	METAP1	33	41
Cc1nc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)no1	ZINC000853868994	ED	On-Demand	Anodyne	ADAM17	34	41
Cc1nc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)no1	ZINC000853868994	ED	On-Demand	Anodyne	SSTR3	33	50
CN1CCN(c2nccc(N3CCCC3)n2)CCC1=O	ZINC000853869038	CC	On-Demand	Anodyne	SORD	83	42
CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)CCC1=O	ZINC000853869061	CD	On-Demand	Bother	WDR5	38	46
Cc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869093	EG	On-Demand	Anodyne	CCKAR	26	41
Cc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869093	EG	On-Demand	Anodyne	CCR3	44	36
Cc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869093	EG	On-Demand	Anodyne	KDR	21	40
Cc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869093	EG	On-Demand	Anodyne	ROCK2	16	40
Cc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869093	EG	On-Demand	Anodyne	CCKBR	42	41
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1nc2c(s1)CCC2	ZINC000853869108	FF	On-Demand	Anodyne	SLC27A1	38	46
COc1ccc2c(NC[C@H](CO)CC3CC3)ccnc2c1	ZINC000853869148	CG	On-Demand	Anodyne	HRP1_PLAFA	112	43
COc1ccc2c(NC[C@H](CO)CC3CC3)ccnc2c1	ZINC000853869148	CG	On-Demand	Anodyne	KDR	47	41
COc1ccc2c(NC[C@H](CO)CC3CC3)ccnc2c1	ZINC000853869148	CG	On-Demand	Anodyne	HNMT	44	35
COc1ccc2c(NC[C@@H](CO)CC3CC3)ccnc2c1	ZINC000853869149	CG	On-Demand	Anodyne	HRP1_PLAFA	112	43
COc1ccc2c(NC[C@@H](CO)CC3CC3)ccnc2c1	ZINC000853869149	CG	On-Demand	Anodyne	KDR	47	41
COc1ccc2c(NC[C@@H](CO)CC3CC3)ccnc2c1	ZINC000853869149	CG	On-Demand	Anodyne	HNMT	44	35
CC(C)(C)OC(=O)C(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853869171	EE	On-Demand	Anodyne	AMY2	46	31
CC(C)(C)OC(=O)C(=O)N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853869171	EE	On-Demand	Anodyne	SSTR3	33	46
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	DRD4	42	34
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	HRH2	20	46
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	CCR3	53	47
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	ROCK1	27	40
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	ROCK2	42	48
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	EPHX2	22	42
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	FLT4	18	49
COc1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869207	FF	On-Demand	Anodyne	MCHR1	17	40
CN1CCN(c2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000853869257	BD	On-Demand	Bother	SSTR1	40	39
CN1CCN(c2ccc([N+](=O)[O-])cc2)CCC1=O	ZINC000853869257	BD	On-Demand	Bother	KCNJ1	27	40
CN(CCCC(=O)N1CCC(NC(=O)C(C)(F)F)CC1)C(=O)OC(C)(C)C	ZINC000853869278	GE	On-Demand	Anodyne	EPHX2	15	41
CN1CCN(c2nc(C(F)(F)F)nc3ccccc23)CCC1=O	ZINC000853869284	DE	On-Demand	Anodyne	HTR3A	18	40
O=C(NC[C@H]1CCCS1(=O)=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853869292	FE	On-Demand	Reactive	CSNK1D	28	40
CC(=O)Nc1cccc(NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)c1	ZINC000853869297	GI	On-Demand	Anodyne	IMDH_CRYPV	15	51
CC(=O)Nc1cccc(NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)c1	ZINC000853869298	GI	On-Demand	Anodyne	IMDH_CRYPV	15	51
CC(=O)Nc1cccc(NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)c1	ZINC000853869299	GI	On-Demand	Anodyne	IMDH_CRYPV	15	51
CC(=O)Nc1cccc(NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)c1	ZINC000853869300	GI	On-Demand	Anodyne	IMDH_CRYPV	15	51
Cc1nsc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)n1	ZINC000853869303	EE	On-Demand	Anodyne	ADAM17	31	43
Cc1nsc(C(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)n1	ZINC000853869303	EE	On-Demand	Anodyne	SSTR3	33	47
CN1CCN(c2ccc([N+](=O)[O-])c3nonc23)CCC1=O	ZINC000853869334	CC	On-Demand	Bother	GSTM2	112	46
CN1CCN(c2ccc([N+](=O)[O-])c3nonc23)CCC1=O	ZINC000853869334	CC	On-Demand	Bother	GSTP1	67	42
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCN(C2CCCCC2)C1=O	ZINC000853869339	FE	On-Demand	Anodyne	BIRC3	49	37
O=C(N[C@@H]1CCN(C2CCCCC2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853869340	FE	On-Demand	Anodyne	BIRC3	49	37
O=C(N[C@@H]1CCN(C2CCCCC2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853869341	FE	On-Demand	Anodyne	BIRC3	49	37
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCN(C2CCCCC2)C1=O	ZINC000853869342	FE	On-Demand	Anodyne	BIRC3	49	37
CC(=O)c1cccc(NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)c1	ZINC000853869349	FI	On-Demand	Anodyne	AKR1C3	15	43
CC(=O)c1cccc(NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)c1	ZINC000853869349	FI	On-Demand	Anodyne	KCNK3	43	40
CC(=O)c1cccc(NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)c1	ZINC000853869350	FI	On-Demand	Anodyne	AKR1C3	15	43
CC(=O)c1cccc(NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)c1	ZINC000853869350	FI	On-Demand	Anodyne	KCNK3	43	40
CC(=O)c1cccc(NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)c1	ZINC000853869351	FI	On-Demand	Anodyne	AKR1C3	15	43
CC(=O)c1cccc(NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)c1	ZINC000853869351	FI	On-Demand	Anodyne	KCNK3	43	40
CC(=O)c1cccc(NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)c1	ZINC000853869352	FI	On-Demand	Anodyne	AKR1C3	15	43
CC(=O)c1cccc(NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)c1	ZINC000853869352	FI	On-Demand	Anodyne	KCNK3	43	40
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1nc2c(s1)CCCC2	ZINC000853869363	GG	On-Demand	Anodyne	SLC27A1	41	47
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1ccccc1C(F)(F)F	ZINC000853869368	GH	On-Demand	Anodyne	RBP4	45	34
CN1CCN(c2nc(-c3ccncc3)nc3ccccc23)CCC1=O	ZINC000853869373	EE	On-Demand	Anodyne	METAP1	40	44
Cc1nc(NC(=O)N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)sc1C	ZINC000853869377	FH	On-Demand	Anodyne	SSTR3	31	44
COc1ccc2c(N3CCC(=O)N(C)CC3)ccnc2c1	ZINC000853869406	CD	On-Demand	Anodyne	HTR1A	16	42
COc1ccc2c(N3CCC(=O)N(C)CC3)ccnc2c1	ZINC000853869406	CD	On-Demand	Anodyne	DRD4	40	32
COc1ccc2c(N3CCC(=O)N(C)CC3)ccnc2c1	ZINC000853869406	CD	On-Demand	Anodyne	PDGFRB	37	43
CC(C)c1ccccc1NC(=O)NCc1ccc(N2CCCNC2=O)cc1	ZINC000853869415	FI	On-Demand	Anodyne	KCNQ2	56	35
O=[N+]([O-])c1ccc(NC[C@H](CO)CC2CC2)c2nonc12	ZINC000853869429	CD	On-Demand	Bother	GSTM2	122	48
O=[N+]([O-])c1ccc(NC[C@H](CO)CC2CC2)c2nonc12	ZINC000853869429	CD	On-Demand	Bother	GSTP1	75	48
O=[N+]([O-])c1ccc(NC[C@@H](CO)CC2CC2)c2nonc12	ZINC000853869430	CD	On-Demand	Bother	GSTM2	122	48
O=[N+]([O-])c1ccc(NC[C@@H](CO)CC2CC2)c2nonc12	ZINC000853869430	CD	On-Demand	Bother	GSTP1	75	48
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853869443	GH	On-Demand	Anodyne	EPHX2	33	44
O=C(NCc1ccc(N2CCCNC2=O)cc1)Nc1ccc(C(F)(F)F)cc1	ZINC000853869443	GH	On-Demand	Anodyne	NAMPT	42	38
OC[C@@H](CNc1nccc(N2CCCC2)n1)CC1CC1	ZINC000853869444	CD	On-Demand	Anodyne	SORD	52	38
OC[C@H](CNc1nccc(N2CCCC2)n1)CC1CC1	ZINC000853869445	CD	On-Demand	Anodyne	SORD	52	38
O=C(Nc1ccc(Cl)nc1)N1CCC2(C=Cc3ccccc3O2)CC1	ZINC000853869462	FI	On-Demand	Anodyne	NPY5R	30	41
O=C(Nc1ccc(Cl)nc1)N1CCC2(C=Cc3ccccc3O2)CC1	ZINC000853869462	FI	On-Demand	Anodyne	TRPM8	29	40
Cc1nc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)sc1C	ZINC000853869477	FG	On-Demand	Anodyne	SLC27A1	15	43
COCCOc1ccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)cn1	ZINC000853869484	GE	On-Demand	Anodyne	NAMPT	37	40
CC(=O)c1ccc(N2CCC(=O)N(C)CC2)c([N+](=O)[O-])c1	ZINC000853869509	CD	On-Demand	Bother	TAAR1	20	47
CC(=O)c1ccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)cc1	ZINC000853869517	FG	On-Demand	Anodyne	NAMPT	42	42
O=C(N[C@@H]1CCCC[C@H]1NC(=O)N1CCCCC1)c1ccccc1	ZINC000853869599	EF	On-Demand	Anodyne	PREP	51	45
O=C(N[C@@H]1CCCC[C@H]1NC(=O)N1CCCCC1)c1ccccc1	ZINC000853869599	EF	On-Demand	Anodyne	SSTR3	33	49
O=C(N[C@@H]1CCCC[C@H]1NC(=O)N1CCCCC1)c1ccccc1	ZINC000853869599	EF	On-Demand	Anodyne	EPHX2	36	53
O=C(N[C@@H]1CCCC[C@H]1NC(=O)N1CCCCC1)c1ccccc1	ZINC000853869599	EF	On-Demand	Anodyne	DPP7	34	44
O=C(N[C@@H]1CCCC[C@H]1NC(=O)N1CCCCC1)c1ccccc1	ZINC000853869599	EF	On-Demand	Anodyne	L3MBTL3	41	35
CON(C)C(=O)[C@H](CCSC)NC(=O)N[C@@H](c1ccccc1)[C@H](C)O	ZINC000853869616	FD	On-Demand	Anodyne	FPR1	40	40
CON(C)C(=O)[C@H](CCSC)NC(=O)N[C@H](c1ccccc1)[C@H](C)O	ZINC000853869617	FD	On-Demand	Anodyne	FPR1	40	40
CON(C)C(=O)[C@H](CCSC)NC(=O)N[C@H](c1ccccc1)[C@@H](C)O	ZINC000853869618	FD	On-Demand	Anodyne	FPR1	40	40
CON(C)C(=O)[C@H](CCSC)NC(=O)N[C@@H](c1ccccc1)[C@@H](C)O	ZINC000853869619	FD	On-Demand	Anodyne	FPR1	40	40
COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869624	GF	On-Demand	Anodyne	CCR3	45	41
COC(=O)c1cccc(NC(=O)NCc2ccc(N3CCCNC3=O)cc2)c1	ZINC000853869624	GF	On-Demand	Anodyne	EPHX2	16	43
CON(C)CCNC(=O)NCCc1ccc(-c2ccccc2)cc1	ZINC000853869627	EF	On-Demand	Anodyne	MMP3	16	45
CON(C)CCNC(=O)NCCc1ccc(-c2ccccc2)cc1	ZINC000853869627	EF	On-Demand	Anodyne	FAAH	28	41
CON(C)CCNC(=O)NCCc1ccc(-c2ccccc2)cc1	ZINC000853869627	EF	On-Demand	Anodyne	PLM2_PLAFA	18	41
O=C(NOCC1CCC1)Nc1ncc(Cc2ccccc2Cl)s1	ZINC000853869688	FI	On-Demand	Anodyne	CDK5	49	39
O=C(NOCC1CCC1)Nc1ccc(C(F)(F)F)cc1	ZINC000853869697	CH	On-Demand	Anodyne	TRPV1	17	40
O=C(NOCC1CCC1)Nc1ccc(C(F)(F)F)cc1	ZINC000853869697	CH	On-Demand	Anodyne	EPHX2	61	47
CC[C@H](C)N(CC)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853869743	CH	On-Demand	Anodyne	PDE5A	50	41
CC[C@H](C)N(CC)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853869743	CH	On-Demand	Anodyne	PDE6A	49	37
O=C(NOCC1CCC1)Nc1ccc(F)c(F)c1	ZINC000853869749	CF	On-Demand	Anodyne	CCR3	23	42
O=C(NOCC1CCC1)Nc1ccc(F)c(F)c1	ZINC000853869749	CF	On-Demand	Anodyne	EPHX2	20	42
O=C(NOCC1CCC1)Nc1ccccn1	ZINC000853869752	BD	On-Demand	Anodyne	GRIN2B	19	41
O=C(NOCC1CCC1)Nc1cccnc1Cl	ZINC000853869763	CF	On-Demand	Anodyne	G2YM83_BOTF4	72	38
O=C(NC[C@@H]1CCN1Cc1ccccc1)C(=O)C1CCSCC1	ZINC000853869765	EE	On-Demand	Anodyne	SIGMAR1	24	41
O=C(NC[C@H]1CCN1Cc1ccccc1)C(=O)C1CCSCC1	ZINC000853869767	EE	On-Demand	Anodyne	SIGMAR1	24	41
C=CCN(C(=O)NCc1ccc(OC)c(Cl)c1)[C@H](C)COC	ZINC000853869791	EG	On-Demand	Mild	PDE5A	44	39
C=CCN(C(=O)NCc1ccc(OC)c(Cl)c1)[C@H](C)COC	ZINC000853869791	EG	On-Demand	Mild	PDE6A	45	34
C=CCN(C(=O)NCc1ccc(OC)c(Cl)c1)[C@@H](C)COC	ZINC000853869793	EG	On-Demand	Mild	PDE5A	44	39
C=CCN(C(=O)NCc1ccc(OC)c(Cl)c1)[C@@H](C)COC	ZINC000853869793	EG	On-Demand	Mild	PDE6A	45	34
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853869798	DD	On-Demand	Anodyne	DRD2	25	47
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853869798	DD	On-Demand	Anodyne	SIGMAR1	41	45
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853869798	DD	On-Demand	Anodyne	CACNA1G	17	40
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853869800	DD	On-Demand	Anodyne	DRD2	25	47
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853869800	DD	On-Demand	Anodyne	SIGMAR1	41	45
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853869800	DD	On-Demand	Anodyne	CACNA1G	17	40
O=C(NOCC1CCC1)Nc1ccc(N2CCCC2)nc1	ZINC000853869834	CF	On-Demand	Anodyne	DGAT1	46	46
O=C(NCCS(=O)(=O)CC1CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853869835	GE	On-Demand	Reactive	CSNK1D	34	41
COC[C@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869884	GH	On-Demand	Anodyne	PDE5A	42	38
COC[C@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869884	GH	On-Demand	Anodyne	ROCK2	29	40
COC[C@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869884	GH	On-Demand	Anodyne	PDE6A	43	33
COC[C@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869884	GH	On-Demand	Anodyne	PDS	48	37
COC[C@@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869885	GH	On-Demand	Anodyne	PDE5A	42	38
COC[C@@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869885	GH	On-Demand	Anodyne	ROCK2	29	40
COC[C@@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869885	GH	On-Demand	Anodyne	PDE6A	43	33
COC[C@@H](NC(=O)NCc1ccc(OC)c(Cl)c1)c1cccc(OC)c1	ZINC000853869885	GH	On-Demand	Anodyne	PDS	48	37
O=C(NOCC1CCC1)Nc1ncc(Cc2ccccc2)s1	ZINC000853869887	DH	On-Demand	Anodyne	CDK5	56	47
O=C(NOCC1CCC1)Nc1ncc(Cc2ccccc2)s1	ZINC000853869887	DH	On-Demand	Anodyne	SCD	32	40
O=C(NOCC1CCC1)Nc1ncc(Cc2ccccc2)s1	ZINC000853869887	DH	On-Demand	Anodyne	MGEA5	34	41
CC[C@@H](O)CNC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853869892	CD	On-Demand	Anodyne	PDE5A	48	40
CC[C@@H](O)CNC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853869892	CD	On-Demand	Anodyne	TRPV1	18	41
CC[C@@H](O)CNC(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853869892	CD	On-Demand	Anodyne	PDE6A	48	37
Cc1nc(NC(=O)NC[C@@H]2CCN2Cc2ccccc2)sc1C	ZINC000853869893	EG	On-Demand	Anodyne	SIGMAR1	15	40
Cc1nc(NC(=O)NC[C@@H]2CCN2Cc2ccccc2)sc1C	ZINC000853869893	EG	On-Demand	Anodyne	CCR3	40	34
Cc1nc(NC(=O)NC[C@H]2CCN2Cc2ccccc2)sc1C	ZINC000853869895	EG	On-Demand	Anodyne	SIGMAR1	15	40
Cc1nc(NC(=O)NC[C@H]2CCN2Cc2ccccc2)sc1C	ZINC000853869895	EG	On-Demand	Anodyne	CCR3	40	34
O=C(NOCC1CCC1)Nc1ccc(Br)cc1	ZINC000853869907	CG	On-Demand	Anodyne	EPHX2	20	43
O=C(NOCC1CCC1)Nc1ccc(Br)cc1	ZINC000853869907	CG	On-Demand	Anodyne	MTCA1	23	43
O=C(NOCC1CCC1)Nc1ccc(Br)cc1	ZINC000853869907	CG	On-Demand	Anodyne	P96878_MYCTU	24	43
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	CCR3	52	43
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	ROCK2	15	40
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	CCKBR	19	40
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	EPHX2	25	52
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	ACR	15	40
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	HIF1A	15	44
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	KCNK3	64	36
COC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853869925	CE	On-Demand	Anodyne	KCNK9	48	33
Cc1nsc(C(=O)NC[C@H]2CCN2Cc2ccccc2)n1	ZINC000853869933	DD	On-Demand	Anodyne	DRD2	34	46
Cc1nsc(C(=O)NC[C@H]2CCN2Cc2ccccc2)n1	ZINC000853869933	DD	On-Demand	Anodyne	SIGMAR1	25	47
Cc1nsc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)n1	ZINC000853869937	DD	On-Demand	Anodyne	DRD2	34	46
Cc1nsc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)n1	ZINC000853869937	DD	On-Demand	Anodyne	SIGMAR1	25	47
O=C(NCCS(=O)(=O)CC1CC1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853869951	GC	On-Demand	Anodyne	CCR3	24	42
O=C(NCCS(=O)(=O)CC1CC1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853869953	GC	On-Demand	Anodyne	CCR3	24	42
CC[C@@](C)(NC(=O)NCc1ccc(OC)c(Cl)c1)C1CC1	ZINC000853869960	DH	On-Demand	Anodyne	PDE5A	51	42
CC[C@@](C)(NC(=O)NCc1ccc(OC)c(Cl)c1)C1CC1	ZINC000853869960	DH	On-Demand	Anodyne	TRPV1	16	42
CC[C@@](C)(NC(=O)NCc1ccc(OC)c(Cl)c1)C1CC1	ZINC000853869960	DH	On-Demand	Anodyne	PDE6A	49	37
CC[C@@](C)(NC(=O)NCc1ccc(OC)c(Cl)c1)C1CC1	ZINC000853869960	DH	On-Demand	Anodyne	MT-ND1	22	40
O=C(NOCC1CCC1)Nc1cccc(Br)c1	ZINC000853869967	CG	On-Demand	Anodyne	EPHX2	17	46
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853869971	EE	On-Demand	Anodyne	PDE5A	50	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853869971	EE	On-Demand	Anodyne	PDE6A	47	37
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@H](CC(F)(F)F)O1	ZINC000853869975	EG	On-Demand	Anodyne	RBP4	45	32
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@H](CC(F)(F)F)O1	ZINC000853869975	EG	On-Demand	Anodyne	G2YM83_BOTF4	71	36
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](CC(F)(F)F)O1	ZINC000853869977	EG	On-Demand	Anodyne	RBP4	45	32
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](CC(F)(F)F)O1	ZINC000853869977	EG	On-Demand	Anodyne	G2YM83_BOTF4	71	36
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@H](CC(F)(F)F)O1	ZINC000853869978	EG	On-Demand	Anodyne	RBP4	45	32
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@H](CC(F)(F)F)O1	ZINC000853869978	EG	On-Demand	Anodyne	G2YM83_BOTF4	71	36
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](CC(F)(F)F)O1	ZINC000853869979	EG	On-Demand	Anodyne	RBP4	45	32
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@H](CC(F)(F)F)O1	ZINC000853869979	EG	On-Demand	Anodyne	G2YM83_BOTF4	71	36
O=C(NCCS(=O)(=O)CC1CC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853870004	GD	On-Demand	Anodyne	CCR5	16	40
Cc1cc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)n2nc(C)cc2n1	ZINC000853870055	EE	On-Demand	Anodyne	DRD2	22	43
Cc1cc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)n2nc(C)cc2n1	ZINC000853870055	EE	On-Demand	Anodyne	SIGMAR1	15	44
Cc1cc(C(=O)NC[C@H]2CCN2Cc2ccccc2)n2nc(C)cc2n1	ZINC000853870056	EE	On-Demand	Anodyne	DRD2	22	43
Cc1cc(C(=O)NC[C@H]2CCN2Cc2ccccc2)n2nc(C)cc2n1	ZINC000853870056	EE	On-Demand	Anodyne	SIGMAR1	15	44
O=C(NOCC1CCC1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853870058	DF	On-Demand	Anodyne	NPY2R	51	33
O=C(NOCC1CCC1)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853870058	DF	On-Demand	Anodyne	CCR3	37	41
O=C(NOCC1CCC1)Nc1ccc([N+](=O)[O-])cc1F	ZINC000853870065	CF	On-Demand	Bother	SLC27A4	48	31
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	DRD4	42	32
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	CCR3	62	50
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	MTNR1A	56	48
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	MTNR1B	52	48
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	ROCK2	21	41
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	CCKBR	15	43
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	EPHX2	35	52
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	TAAR1	41	43
COc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870087	CF	On-Demand	Anodyne	KCNK3	42	37
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000853870091	GJ	On-Demand	Anodyne	CDK5	41	36
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000853870091	GJ	On-Demand	Anodyne	SCD1	47	58
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1	ZINC000853870091	GJ	On-Demand	Anodyne	SCD	45	58
CN1CCN(c2ccccc2NC(=O)N2CCO[C@@H](CC(F)(F)F)C2)CC1	ZINC000853870096	GF	On-Demand	Anodyne	HTR1B	17	41
CN1CCN(c2ccccc2NC(=O)N2CCO[C@@H](CC(F)(F)F)C2)CC1	ZINC000853870096	GF	On-Demand	Anodyne	KCNQ2	72	37
CN1CCN(c2ccccc2NC(=O)N2CCO[C@@H](CC(F)(F)F)C2)CC1	ZINC000853870096	GF	On-Demand	Anodyne	RBP4	52	35
CN1CCN(c2ccccc2NC(=O)N2CCO[C@H](CC(F)(F)F)C2)CC1	ZINC000853870097	GF	On-Demand	Anodyne	HTR1B	17	41
CN1CCN(c2ccccc2NC(=O)N2CCO[C@H](CC(F)(F)F)C2)CC1	ZINC000853870097	GF	On-Demand	Anodyne	KCNQ2	72	37
CN1CCN(c2ccccc2NC(=O)N2CCO[C@H](CC(F)(F)F)C2)CC1	ZINC000853870097	GF	On-Demand	Anodyne	RBP4	52	35
O=C(NOCC1CCC1)Nc1ccccc1Cl	ZINC000853870100	CG	On-Demand	Anodyne	EPHB3	50	32
O=C(NOCC1CCC1)Nc1cccnc1N1CCCC1	ZINC000853870116	CF	On-Demand	Anodyne	KCNQ2	59	33
O=C(NOCC1CCC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853870118	DG	On-Demand	Anodyne	P2RY1	67	43
O=C(NOCC1CCC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853870118	DG	On-Demand	Anodyne	EPHX2	84	58
O=C(NOCC1CCC1)Nc1ccc(OC(F)(F)F)cc1	ZINC000853870118	DG	On-Demand	Anodyne	MCHR1	15	42
COC(=O)Cc1csc(NC(=O)N2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853870142	GF	On-Demand	Anodyne	CPT1A	26	41
Cc1nnc(CN(C)C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(F)c2)s1	ZINC000853870162	GG	On-Demand	Anodyne	NPY2R	66	35
Cc1nnc(CN(C)C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(F)c2)s1	ZINC000853870163	GG	On-Demand	Anodyne	NPY2R	66	35
Cc1nnc(CN(C)C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(F)c2)s1	ZINC000853870164	GG	On-Demand	Anodyne	NPY2R	66	35
Cc1nnc(CN(C)C(=O)Nc2ccccc2N2CCN(C)CC2)s1	ZINC000853870177	FE	On-Demand	Anodyne	KCNQ2	70	37
C#CCCN(CCOC)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853870251	DF	On-Demand	Mild	PDE5A	43	39
C#CCCN(CCOC)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853870251	DF	On-Demand	Mild	PDE6A	44	34
O=C(NOCC1CCC1)Nc1ccccc1OC(F)(F)F	ZINC000853870267	DG	On-Demand	Anodyne	P2RY1	55	38
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1Cl	ZINC000853870268	CH	On-Demand	Anodyne	PYGL	21	41
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1Cl	ZINC000853870268	CH	On-Demand	Anodyne	ROCK2	15	40
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1Cl	ZINC000853870268	CH	On-Demand	Anodyne	EPHX2	16	41
O=C(NC[C@@H]1CCN1Cc1ccccc1)Nc1cccnc1Cl	ZINC000853870282	EG	On-Demand	Anodyne	G2YM83_BOTF4	59	34
O=C(NC[C@H]1CCN1Cc1ccccc1)Nc1cccnc1Cl	ZINC000853870283	EG	On-Demand	Anodyne	G2YM83_BOTF4	59	34
NC(=O)[C@@H]1CCCN1Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870284	ED	On-Demand	Anodyne	CCR3	59	41
NC(=O)[C@H]1CCCN1Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870285	ED	On-Demand	Anodyne	CCR3	59	41
O=C(NOCC1CCC1)Nc1ncc(-c2ccccc2)s1	ZINC000853870293	DH	On-Demand	Anodyne	PI4KB	25	40
O=C(NOCC1CCC1)Nc1ncc(-c2ccccc2)s1	ZINC000853870293	DH	On-Demand	Anodyne	CDK5	59	43
NC(=O)c1cc(NC(=O)NOCC2CCC2)ccc1Cl	ZINC000853870302	CE	On-Demand	Anodyne	IMDH_CRYPV	22	41
O=C(NOCC1CCC1)N1CCc2ccccc2C1	ZINC000853870303	CE	On-Demand	Anodyne	PREP	45	38
O=C(NOCC1CCC1)N1CCc2ccccc2C1	ZINC000853870303	CE	On-Demand	Anodyne	DPP8	23	44
O=C(NOCC1CCC1)Nc1ccc(-c2ncon2)cc1	ZINC000853870327	CF	On-Demand	Anodyne	MTOR	60	38
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1	ZINC000853870334	IF	On-Demand	Anodyne	KCNK3	89	34
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1	ZINC000853870334	IF	On-Demand	Anodyne	KCNK9	56	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1	ZINC000853870335	IF	On-Demand	Anodyne	KCNK3	89	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c1	ZINC000853870335	IF	On-Demand	Anodyne	KCNK9	56	34
COC(=O)c1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853870464	GF	On-Demand	Anodyne	CCR3	19	41
COC(=O)c1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853870464	GF	On-Demand	Anodyne	EPHX2	24	40
O=C(NOCC1CCC1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853870497	EH	On-Demand	Anodyne	CCR3	49	35
O=C(NOCC1CCC1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853870497	EH	On-Demand	Anodyne	CDK5	50	39
O=C(NOCC1CCC1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853870497	EH	On-Demand	Anodyne	SCD1	37	40
O=C(NOCC1CCC1)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853870497	EH	On-Demand	Anodyne	SCD	31	40
Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870499	BF	On-Demand	Anodyne	CCKAR	32	43
Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870499	BF	On-Demand	Anodyne	CCR3	53	38
Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870499	BF	On-Demand	Anodyne	KDR	22	40
Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870499	BF	On-Demand	Anodyne	CCKBR	46	43
Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870499	BF	On-Demand	Anodyne	EPHX2	21	47
Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870499	BF	On-Demand	Anodyne	KCNK3	77	40
Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870499	BF	On-Demand	Anodyne	KCNK9	64	40
O=C(NOCC1CCC1)Nc1ccccc1F	ZINC000853870501	BF	On-Demand	Anodyne	CCR3	17	41
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853870502	FI	On-Demand	Anodyne	CDK5	48	38
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853870502	FI	On-Demand	Anodyne	SCD1	40	51
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853870502	FI	On-Demand	Anodyne	SCD	34	51
O=C(NOCC1CCC1)Nc1ccccc1C(F)(F)F	ZINC000853870518	CH	On-Demand	Anodyne	RBP4	62	37
Cc1cccc(NC(=O)NOCC2CCC2)n1	ZINC000853870520	BE	On-Demand	Anodyne	GRM5	21	45
Cn1nc(-c2ccc(Cl)cc2)nc1C(=O)NOCC1CCC1	ZINC000853870524	DF	On-Demand	Anodyne	CNR1	20	40
Cn1nc(-c2ccc(Cl)cc2)nc1C(=O)NOCC1CCC1	ZINC000853870524	DF	On-Demand	Anodyne	LIPE	24	41
CC(C)(C)OC(=O)NCc1cc(O)nc(CNC(=O)Nc2cccc(C#N)c2)n1	ZINC000853870528	GE	On-Demand	Mild	CCR3	15	41
O=C(NOCC1CCC1)Nc1nccs1	ZINC000853870535	BD	On-Demand	Anodyne	MAP1	128	45
O=C(NOCC1CCC1)Nc1nccs1	ZINC000853870535	BD	On-Demand	Anodyne	GCK	22	43
CC(=O)Nc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870537	CE	On-Demand	Anodyne	CCR3	55	39
CC(=O)Nc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870537	CE	On-Demand	Anodyne	EPHX2	23	47
CC(=O)Nc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870537	CE	On-Demand	Anodyne	KCNK3	65	36
CC(=O)Nc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870537	CE	On-Demand	Anodyne	KCNK9	57	36
CCn1c(O)nnc1C1CCN(C(=O)NCc2ccc(OC)c(Cl)c2)CC1	ZINC000853870554	GF	On-Demand	Anodyne	PDE5A	55	43
CCn1c(O)nnc1C1CCN(C(=O)NCc2ccc(OC)c(Cl)c2)CC1	ZINC000853870554	GF	On-Demand	Anodyne	IL2RA	51	31
CCn1c(O)nnc1C1CCN(C(=O)NCc2ccc(OC)c(Cl)c2)CC1	ZINC000853870554	GF	On-Demand	Anodyne	PDE6A	48	36
Cc1nc(C(=O)NC[C@H]2CCN2Cc2ccccc2)no1	ZINC000853870569	CD	On-Demand	Anodyne	DRD2	24	47
Cc1nc(C(=O)NC[C@H]2CCN2Cc2ccccc2)no1	ZINC000853870569	CD	On-Demand	Anodyne	DRD4	29	40
Cc1nc(C(=O)NC[C@H]2CCN2Cc2ccccc2)no1	ZINC000853870569	CD	On-Demand	Anodyne	ACHE	23	41
Cc1nc(C(=O)NC[C@H]2CCN2Cc2ccccc2)no1	ZINC000853870569	CD	On-Demand	Anodyne	SIGMAR1	40	45
Cc1nc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)no1	ZINC000853870571	CD	On-Demand	Anodyne	DRD2	24	47
Cc1nc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)no1	ZINC000853870571	CD	On-Demand	Anodyne	DRD4	29	40
Cc1nc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)no1	ZINC000853870571	CD	On-Demand	Anodyne	ACHE	23	41
Cc1nc(C(=O)NC[C@@H]2CCN2Cc2ccccc2)no1	ZINC000853870571	CD	On-Demand	Anodyne	SIGMAR1	40	45
Cn1ccnc1C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853870592	CD	On-Demand	Anodyne	DRD2	37	47
Cn1ccnc1C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853870592	CD	On-Demand	Anodyne	DRD4	23	40
Cn1ccnc1C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853870592	CD	On-Demand	Anodyne	SIGMAR1	26	46
Cn1ccnc1C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853870592	CD	On-Demand	Anodyne	SPHK1	40	32
Cn1ccnc1C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853870593	CD	On-Demand	Anodyne	DRD2	37	47
Cn1ccnc1C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853870593	CD	On-Demand	Anodyne	DRD4	23	40
Cn1ccnc1C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853870593	CD	On-Demand	Anodyne	SIGMAR1	26	46
Cn1ccnc1C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853870593	CD	On-Demand	Anodyne	SPHK1	40	32
O=C(NCc1cccc(COC[C@@H]2CCCO2)c1)Nc1ccc(Cl)nc1	ZINC000853870596	GH	On-Demand	Anodyne	ROCK2	17	40
O=C(NCc1cccc(COC[C@@H]2CCCO2)c1)Nc1ccc(Cl)nc1	ZINC000853870596	GH	On-Demand	Anodyne	NAMPT	36	41
O=C(NCc1cccc(COC[C@H]2CCCO2)c1)Nc1ccc(Cl)nc1	ZINC000853870597	GH	On-Demand	Anodyne	ROCK2	17	40
O=C(NCc1cccc(COC[C@H]2CCCO2)c1)Nc1ccc(Cl)nc1	ZINC000853870597	GH	On-Demand	Anodyne	NAMPT	36	41
O=C(NC[C@@H]1CCN1Cc1ccccc1)C(F)(F)C(=O)N1CCOCC1	ZINC000853870623	FC	On-Demand	Anodyne	MLYCD	19	40
O=C(NC[C@H]1CCN1Cc1ccccc1)C(F)(F)C(=O)N1CCOCC1	ZINC000853870624	FC	On-Demand	Anodyne	MLYCD	19	40
O=C(NOCC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000853870625	CG	On-Demand	Anodyne	EPHX2	27	44
O=C(NOCC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000853870625	CG	On-Demand	Anodyne	ERBB4	46	33
O=C(NOCC1CCC1)Nc1ccc(F)c(Cl)c1	ZINC000853870625	CG	On-Demand	Anodyne	MCHR1	29	41
Cc1nc(NC(=O)N2C[C@@H](C)O[C@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853870642	GJ	On-Demand	Anodyne	PIK3CG	20	40
Cc1nc(NC(=O)N2C[C@@H](C)O[C@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853870642	GJ	On-Demand	Anodyne	PI4KB	41	42
Cc1nc(NC(=O)N2C[C@H](C)O[C@@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853870643	GJ	On-Demand	Anodyne	PIK3CG	20	40
Cc1nc(NC(=O)N2C[C@H](C)O[C@@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853870643	GJ	On-Demand	Anodyne	PI4KB	41	42
Cc1nc(NC(=O)N2C[C@H](CC(F)(F)F)O[C@H](C)C2)sc1-c1ccccc1	ZINC000853870644	GJ	On-Demand	Anodyne	PIK3CG	20	40
Cc1nc(NC(=O)N2C[C@H](CC(F)(F)F)O[C@H](C)C2)sc1-c1ccccc1	ZINC000853870644	GJ	On-Demand	Anodyne	PI4KB	41	42
Cc1nc(NC(=O)N2C[C@H](C)O[C@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853870645	GJ	On-Demand	Anodyne	PIK3CG	20	40
Cc1nc(NC(=O)N2C[C@H](C)O[C@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853870645	GJ	On-Demand	Anodyne	PI4KB	41	42
O=C(NC[C@@H]1CCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853870735	EG	On-Demand	Anodyne	CCR3	42	38
O=C(NC[C@@H]1CCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853870735	EG	On-Demand	Anodyne	CHRNA7	20	42
O=C(NC[C@@H]1CCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853870735	EG	On-Demand	Anodyne	NAMPT	39	46
O=C(NC[C@H]1CCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853870737	EG	On-Demand	Anodyne	CCR3	42	38
O=C(NC[C@H]1CCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853870737	EG	On-Demand	Anodyne	CHRNA7	20	42
O=C(NC[C@H]1CCN1Cc1ccccc1)Nc1ccc(Cl)nc1	ZINC000853870737	EG	On-Demand	Anodyne	NAMPT	39	46
O=C(NOCC1CCC1)Nc1cccc(N2CCNC2=O)c1	ZINC000853870740	DE	On-Demand	Anodyne	CCR3	59	38
N#Cc1ccc(Cc2cnc(NC(=O)NOCC3CCC3)s2)cc1	ZINC000853870742	EG	On-Demand	Mild	CDK5	41	35
O=C(NOCC1CCC1)Nc1ccc(Cl)cn1	ZINC000853870758	CF	On-Demand	Anodyne	F10	52	35
O=C(NOCC1CCC1)Nc1ccc(Cl)cn1	ZINC000853870758	CF	On-Demand	Anodyne	GCK	15	40
O=C(NOCC1CCC1)Nc1nc2c(s1)CCC2	ZINC000853870761	CE	On-Demand	Anodyne	SLC27A1	32	41
Cc1nc(NC(=O)NOCC2CCC2)sc1-c1ccccc1	ZINC000853870766	DH	On-Demand	Anodyne	PIK3CG	22	42
Cc1nc(NC(=O)NOCC2CCC2)sc1-c1ccccc1	ZINC000853870766	DH	On-Demand	Anodyne	PI4KB	43	41
COc1ncccc1NC(=O)NOCC1CCC1	ZINC000853870767	CD	On-Demand	Anodyne	P2RY1	44	40
COc1ncccc1NC(=O)NOCC1CCC1	ZINC000853870767	CD	On-Demand	Anodyne	G2YM83_BOTF4	44	32
NC(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853870768	CD	On-Demand	Anodyne	EPHX2	24	41
NC(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853870768	CD	On-Demand	Anodyne	PLAU	16	42
NC(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853870768	CD	On-Demand	Anodyne	ACR	57	35
NC(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853870768	CD	On-Demand	Anodyne	DGAT1	16	40
CC(C)c1ccccc1NC(=O)NOCC1CCC1	ZINC000853870769	CH	On-Demand	Anodyne	KCNQ2	40	34
CC(C)c1ccccc1NC(=O)NOCC1CCC1	ZINC000853870769	CH	On-Demand	Anodyne	SOAT1	34	41
Cc1nc(NC(=O)N2CCO[C@H](CC(F)(F)F)C2)sc1C	ZINC000853870770	DF	On-Demand	Anodyne	ETHR	40	31
Cc1nc(NC(=O)N2CCO[C@@H](CC(F)(F)F)C2)sc1C	ZINC000853870771	DF	On-Demand	Anodyne	ETHR	40	31
O=C(NCc1cccc(COC[C@@H]2CCCO2)c1)Nc1cccnc1Cl	ZINC000853870801	GH	On-Demand	Anodyne	G2YM83_BOTF4	65	32
O=C(NCc1cccc(COC[C@H]2CCCO2)c1)Nc1cccnc1Cl	ZINC000853870802	GH	On-Demand	Anodyne	G2YM83_BOTF4	65	32
O=C(NOCC1CCC1)Nc1cccc(-c2nnc3n2CCC3)c1	ZINC000853870817	EF	On-Demand	Anodyne	CCR3	51	39
N#Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870826	BE	On-Demand	Mild	CCR3	41	50
N#Cc1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870826	BE	On-Demand	Mild	MCHR1	41	44
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)CC1	ZINC000853870831	IC	On-Demand	Anodyne	TRY2_BOVIN	41	36
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)CC1	ZINC000853870832	IC	On-Demand	Anodyne	TRY2_BOVIN	41	36
COc1ccccc1NC(=O)N1CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000853870876	FG	On-Demand	Anodyne	RBP4	42	42
CCN1CC[C@H](N(CC)C(=O)NCc2c(C)cccc2C)C1	ZINC000853870894	DF	On-Demand	Anodyne	CCR5	34	53
CCN1CC[C@@H](N(CC)C(=O)NCc2c(C)cccc2C)C1	ZINC000853870895	DF	On-Demand	Anodyne	CCR5	34	53
CC(C)(C)OC(=O)NCc1cc(O)nc(CNC(=O)Nc2nccs2)n1	ZINC000853870902	GD	On-Demand	Anodyne	MAP1	80	34
CON(C(=O)Nc1nccs1)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000853870912	EI	On-Demand	Anodyne	MAP1	104	43
CON(C(=O)Nc1nccs1)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000853870913	EI	On-Demand	Anodyne	MAP1	104	43
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	CA2	53	57
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	CA1	48	45
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	CA4	43	52
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	CA5A	44	33
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	CA12	49	57
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	CA9	46	57
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	MTCA1	46	42
NS(=O)(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853870966	CD	On-Demand	Anodyne	P96878_MYCTU	57	42
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853870969	EH	On-Demand	Anodyne	CDK5	53	40
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853870969	EH	On-Demand	Anodyne	SCD1	38	41
O=C(NOCC1CCC1)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853870969	EH	On-Demand	Anodyne	SCD	34	43
COCC1(NC(=O)NCc2ccc(OC)c(Cl)c2)CCCC1	ZINC000853870983	EG	On-Demand	Anodyne	PDE5A	49	40
COCC1(NC(=O)NCc2ccc(OC)c(Cl)c2)CCCC1	ZINC000853870983	EG	On-Demand	Anodyne	PDE6A	48	36
O=C(NOCC1CCC1)Nc1nc2c(s1)CCCCC2	ZINC000853870985	CG	On-Demand	Anodyne	SLC27A1	33	42
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCN2Cc2ccccc2)CC1	ZINC000853871066	GF	On-Demand	Anodyne	HTR1A	21	41
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCN2Cc2ccccc2)CC1	ZINC000853871066	GF	On-Demand	Anodyne	DRD2	27	41
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCN2Cc2ccccc2)CC1	ZINC000853871066	GF	On-Demand	Anodyne	DRD3	21	40
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCN2Cc2ccccc2)CC1	ZINC000853871066	GF	On-Demand	Anodyne	KCNQ2	77	44
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCN2Cc2ccccc2)CC1	ZINC000853871066	GF	On-Demand	Anodyne	SIGMAR1	22	40
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCN2Cc2ccccc2)CC1	ZINC000853871068	GF	On-Demand	Anodyne	HTR1A	21	41
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCN2Cc2ccccc2)CC1	ZINC000853871068	GF	On-Demand	Anodyne	DRD2	27	41
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCN2Cc2ccccc2)CC1	ZINC000853871068	GF	On-Demand	Anodyne	DRD3	21	40
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCN2Cc2ccccc2)CC1	ZINC000853871068	GF	On-Demand	Anodyne	KCNQ2	77	44
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCN2Cc2ccccc2)CC1	ZINC000853871068	GF	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NOCC1CCC1)Nc1cc(C2CC2)nn1-c1ccccc1	ZINC000853871075	EH	On-Demand	Anodyne	DDR2	18	43
CON(C)CCNC(=O)NCCc1c(C)cccc1C	ZINC000853871087	CD	On-Demand	Anodyne	MTNR1A	39	40
O=C(NOCC1CCC1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000853871089	FJ	On-Demand	Anodyne	MPL	50	46
O=C(NOCC1CCC1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000853871089	FJ	On-Demand	Anodyne	SPHK2	31	43
O=C(NOCC1CCC1)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1	ZINC000853871089	FJ	On-Demand	Anodyne	SPHK1	33	43
O=C(NOCC1CCC1)Nc1ncc(Cc2ccc(Br)cc2)s1	ZINC000853871092	GI	On-Demand	Anodyne	CDK5	42	37
O=C(NOCC1CCC1)Nc1cccc2cccnc12	ZINC000853871113	CG	On-Demand	Anodyne	WNT3	17	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853871115	FF	On-Demand	Mild	PDE5A	44	38
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1ccc(OC)c(Cl)c1	ZINC000853871115	FF	On-Demand	Mild	PDE6A	48	36
O=C(NOCC1CCC1)Nc1nc2c(s1)CCCC2	ZINC000853871116	CF	On-Demand	Anodyne	SLC27A1	33	43
CN1CCN(c2nccc3ccc(Br)cc23)CCC1=O	ZINC000853871141	EF	On-Demand	Anodyne	HTR1B	16	41
CON(C(=O)n1ccnc1)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871163	DG	On-Demand	Anodyne	CYP26A1	50	38
CON(C(=O)n1ccnc1)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871164	DG	On-Demand	Anodyne	CYP26A1	50	38
CON(C(=O)Nc1cccnc1)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871165	EI	On-Demand	Anodyne	RAF1	15	44
CON(C(=O)Nc1cccnc1)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871165	EI	On-Demand	Anodyne	CSF1R	19	48
CON(C(=O)Nc1cccnc1)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871166	EI	On-Demand	Anodyne	RAF1	15	44
CON(C(=O)Nc1cccnc1)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871166	EI	On-Demand	Anodyne	CSF1R	19	48
CC(C)(C)OC(=O)NCc1cc(O)nc(CNC(=O)Nc2cccnc2)n1	ZINC000853871209	FD	On-Demand	Anodyne	NAMPT	45	48
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA2	136	58
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA1	126	58
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA7	79	44
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA13	15	40
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA5B	47	44
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA4	94	51
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA5A	54	44
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA14	67	44
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	EPHX2	19	40
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA12	121	58
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CA9	114	58
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	CYNT	40	40
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	NCE103	51	45
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	MTCA1	66	58
NS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871224	CD	On-Demand	Anodyne	P96878_MYCTU	81	58
O=C(NOCC1CCC1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853871234	CD	On-Demand	Anodyne	CASP2	18	42
O=C(NOCC1CCC1)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853871234	CD	On-Demand	Anodyne	CASP6	15	42
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	HTR1A	53	42
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	DRD2	39	40
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	HTR1D	16	42
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	HTR1B	19	42
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	DRD3	41	36
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	HTR7	41	41
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	KCNQ2	84	44
CN1CCN(c2ccccc2NC(=O)NOCC2CCC2)CC1	ZINC000853871235	DE	On-Demand	Anodyne	CSF1R	17	44
Cc1nc(NC(=O)N2CCO[C@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853871238	GI	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)N2CCO[C@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853871238	GI	On-Demand	Anodyne	PI4KB	41	43
Cc1nc(NC(=O)N2CCO[C@@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853871239	GI	On-Demand	Anodyne	PIK3CG	21	43
Cc1nc(NC(=O)N2CCO[C@@H](CC(F)(F)F)C2)sc1-c1ccccc1	ZINC000853871239	GI	On-Demand	Anodyne	PI4KB	41	43
NC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853871248	CD	On-Demand	Anodyne	CCR3	51	40
NC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853871248	CD	On-Demand	Anodyne	EPHX2	21	46
NC(=O)c1cccc(NC(=O)NOCC2CCC2)c1	ZINC000853871248	CD	On-Demand	Anodyne	KCNK3	66	37
O=C(NCc1cccc(COC[C@@H]2CCCO2)c1)n1ccnc1	ZINC000853871255	DE	On-Demand	Anodyne	NOS2	54	33
O=C(NCc1cccc(COC[C@H]2CCCO2)c1)n1ccnc1	ZINC000853871256	DE	On-Demand	Anodyne	NOS2	54	33
CS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871260	CD	On-Demand	Anodyne	CA2	32	44
CS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871260	CD	On-Demand	Anodyne	CA1	49	38
CS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871260	CD	On-Demand	Anodyne	EPHX2	25	42
CS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871260	CD	On-Demand	Anodyne	CA12	45	44
CS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871260	CD	On-Demand	Anodyne	CA9	45	44
CS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871260	CD	On-Demand	Anodyne	MTCA1	47	44
CS(=O)(=O)c1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871260	CD	On-Demand	Anodyne	P96878_MYCTU	59	44
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871270	EF	On-Demand	Anodyne	PDE5A	49	41
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871270	EF	On-Demand	Anodyne	HTR4	57	39
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871270	EF	On-Demand	Anodyne	CCR5	40	51
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871270	EF	On-Demand	Anodyne	PDE6A	45	35
COCCn1cc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)cn1	ZINC000853871273	GH	On-Demand	Anodyne	PANC	46	33
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871278	EF	On-Demand	Anodyne	PDE5A	49	41
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871278	EF	On-Demand	Anodyne	HTR4	57	39
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871278	EF	On-Demand	Anodyne	CCR5	40	51
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(OC)c(Cl)c2)C1	ZINC000853871278	EF	On-Demand	Anodyne	PDE6A	45	35
C=CCCC(C)(C)NC(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853871279	EG	On-Demand	Mild	KCNQ2	76	39
O=C(NOCC1CCC1)Nc1ccc(N2CCOCC2)cn1	ZINC000853871280	DD	On-Demand	Anodyne	STAT6	57	37
O=C(NOCC1CCC1)Nc1cc(F)cc(F)c1	ZINC000853871282	CF	On-Demand	Anodyne	CCR3	42	36
C#CCCN(CCOC)C(=O)Nc1cc(Cl)ccc1OC	ZINC000853871328	DF	On-Demand	Mild	RBP4	18	43
C[C@H]1CN(c2ccc(NC(=O)N(C)CC3=CCSC3)cc2F)C[C@H](C)O1	ZINC000853871331	GH	On-Demand	Anodyne	NPY2R	61	35
O=C(NC[C@@H]1CCN1Cc1ccccc1)Nc1cccc(N2CCOC2=O)c1	ZINC000853871340	GG	On-Demand	Anodyne	CCR3	38	41
O=C(NCCS(=O)(=O)CC1CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853871343	FD	On-Demand	Anodyne	EPHX2	21	46
C[C@H]1CN(c2ccc(NC(=O)N(C)CC3=CCSC3)cc2F)C[C@@H](C)O1	ZINC000853871346	GH	On-Demand	Anodyne	NPY2R	61	35
O=C(NC[C@H]1CCN1Cc1ccccc1)Nc1cccc(N2CCOC2=O)c1	ZINC000853871350	GG	On-Demand	Anodyne	CCR3	38	41
O=C(NC[C@H]1CCN1Cc1ccccc1)c1nc(Br)cs1	ZINC000853871360	FF	On-Demand	Anodyne	DRD2	17	48
O=C(NC[C@H]1CCN1Cc1ccccc1)c1nc(Br)cs1	ZINC000853871360	FF	On-Demand	Anodyne	SIGMAR1	21	47
O=C(NC[C@@H]1CCN1Cc1ccccc1)c1nc(Br)cs1	ZINC000853871363	FF	On-Demand	Anodyne	DRD2	17	48
O=C(NC[C@@H]1CCN1Cc1ccccc1)c1nc(Br)cs1	ZINC000853871363	FF	On-Demand	Anodyne	SIGMAR1	21	47
C[C@H]1CN(c2ccc(NC(=O)NOCC3CCC3)cc2F)C[C@@H](C)O1	ZINC000853871385	FG	On-Demand	Anodyne	NPY2R	71	36
C[C@H]1CN(c2ccc(NC(=O)NOCC3CCC3)cc2F)C[C@H](C)O1	ZINC000853871391	FG	On-Demand	Anodyne	NPY2R	71	36
COCc1n[nH]c(CNC(=O)NCc2ccc(OC)c(Cl)c2)n1	ZINC000853871401	ED	On-Demand	Anodyne	PDE5A	51	44
COCc1n[nH]c(CNC(=O)NCc2ccc(OC)c(Cl)c2)n1	ZINC000853871401	ED	On-Demand	Anodyne	PDE6A	48	36
O=C(NOCC1CCC1)Nc1ccc(Br)cc1F	ZINC000853871420	DG	On-Demand	Anodyne	MAP2K1	16	52
O=C(NOCC1CCC1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853871437	ED	On-Demand	Anodyne	NPY1R	30	41
O=C(NOCC1CCC1)Nc1cccc(CN2C(=O)CNC2=O)c1	ZINC000853871437	ED	On-Demand	Anodyne	CCR3	47	39
Cc1cc(NC(=O)Nc2ccccc2F)ccc1NC(=O)OC(C)(C)C	ZINC000853871440	FK	On-Demand	Anodyne	LPL	48	33
Cc1cc(NC(=O)Nc2ccccc2F)ccc1NC(=O)OC(C)(C)C	ZINC000853871440	FK	On-Demand	Anodyne	P2RY1	75	38
Cc1cc(NC(=O)Nc2ccccc2F)ccc1NC(=O)OC(C)(C)C	ZINC000853871440	FK	On-Demand	Anodyne	KDR	19	40
C[C@H]1CN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)CC[C@@H](C)O1	ZINC000853871442	FG	On-Demand	Anodyne	HSD11B1	17	48
C[C@H]1CN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)CC[C@@H](C)O1	ZINC000853871442	FG	On-Demand	Anodyne	LIPG	40	35
C#CCNC(=O)c1ccc(N2CC[C@@H](C)O[C@@H](C)C2)nc1	ZINC000853871502	CD	On-Demand	Mild	HPGDS	15	40
Cc1nnc(CN(C)C(=O)Nc2nc(C)c(-c3ccccc3)s2)s1	ZINC000853871531	FH	On-Demand	Anodyne	PIK3CG	21	45
O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H](O)C23CCC3)c2nonc12	ZINC000853871543	CD	On-Demand	Bother	GSTM2	111	42
O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H](O)C23CCC3)c2nonc12	ZINC000853871543	CD	On-Demand	Bother	GSTP1	68	42
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](O)C23CCC3)c2nonc12	ZINC000853871544	CD	On-Demand	Bother	GSTM2	111	42
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](O)C23CCC3)c2nonc12	ZINC000853871544	CD	On-Demand	Bother	GSTP1	68	42
O=[N+]([O-])c1ccc(N[C@H]2C[C@@H](O)C23CCC3)c2nonc12	ZINC000853871545	CD	On-Demand	Bother	GSTM2	111	42
O=[N+]([O-])c1ccc(N[C@H]2C[C@@H](O)C23CCC3)c2nonc12	ZINC000853871545	CD	On-Demand	Bother	GSTP1	68	42
O=[N+]([O-])c1ccc(N[C@@H]2C[C@H](O)C23CCC3)c2nonc12	ZINC000853871546	CD	On-Demand	Bother	GSTM2	111	42
O=[N+]([O-])c1ccc(N[C@@H]2C[C@H](O)C23CCC3)c2nonc12	ZINC000853871546	CD	On-Demand	Bother	GSTP1	68	42
CN1CCN(c2ccc3ccc(Br)cc3n2)CCC1=O	ZINC000853871580	EF	On-Demand	Anodyne	HTR3A	23	43
Cc1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853871600	FG	On-Demand	Anodyne	CCKAR	23	42
Cc1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853871600	FG	On-Demand	Anodyne	CCR3	17	41
Cc1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853871600	FG	On-Demand	Anodyne	CCKBR	29	42
Cc1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853871600	FG	On-Demand	Anodyne	EPHX2	22	44
Cc1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853871600	FG	On-Demand	Anodyne	KCNK3	42	33
CC(=O)c1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853871601	GG	On-Demand	Anodyne	CCR3	26	40
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	HTR1A	91	61
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	DRD2	77	55
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	DRD1	19	42
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	DRD4	61	51
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	ADRA1D	37	43
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	HTR2A	68	55
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	HTR2C	40	48
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	SLC6A4	19	48
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	ADRA1A	39	43
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	ADRA1B	24	43
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	DRD3	105	61
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	HTR4	23	47
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	HTR7	80	47
CON(C)CCNC(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853871603	FD	On-Demand	Anodyne	NPY1R	15	40
Cc1cccc(NC(=O)NCc2nc(O)cc(CNC(=O)OC(C)(C)C)n2)c1	ZINC000853871612	GF	On-Demand	Anodyne	CCKAR	29	43
Cc1cccc(NC(=O)NCc2nc(O)cc(CNC(=O)OC(C)(C)C)n2)c1	ZINC000853871612	GF	On-Demand	Anodyne	CCKBR	41	43
Cc1cccc(NC(=O)NCc2nc(O)cc(CNC(=O)OC(C)(C)C)n2)c1	ZINC000853871612	GF	On-Demand	Anodyne	KCNK3	47	35
Cc1cccc(NC(=O)NCc2nc(O)cc(CNC(=O)OC(C)(C)C)n2)c1	ZINC000853871612	GF	On-Demand	Anodyne	KCNK9	40	33
O=C(NOCC1CCC1)Nc1ccc(Cl)c(Cl)c1	ZINC000853871617	CH	On-Demand	Anodyne	EPHX2	18	45
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c1	ZINC000853871638	JF	On-Demand	Anodyne	KCNK3	68	34
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c1	ZINC000853871638	JF	On-Demand	Anodyne	KCNK9	42	33
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c1	ZINC000853871639	JF	On-Demand	Anodyne	KCNK3	68	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)N(C)C(C)C)c2)c1	ZINC000853871639	JF	On-Demand	Anodyne	KCNK9	42	33
C#CCCN(CCOC)C(=O)Nc1ccc(Cl)cn1	ZINC000853871663	CE	On-Demand	Mild	F10	50	34
FC(F)(F)CCC(CCC(F)(F)F)Nc1nccc(N2CCCC2)n1	ZINC000853871668	FJ	On-Demand	Anodyne	SORD	49	36
CN(CC1=CCSC1)C(=O)Nc1cccnc1Cl	ZINC000853871688	CF	On-Demand	Anodyne	G2YM83_BOTF4	69	35
COc1ccc2c(N3CC[C@@H](C)O[C@@H](C)C3)ccnc2c1	ZINC000853871700	CG	On-Demand	Anodyne	PDE3A	40	42
COc1ccc2c(N3CC[C@@H](C)O[C@@H](C)C3)ccnc2c1	ZINC000853871700	CG	On-Demand	Anodyne	PDE3B	46	42
C#CCCN(CCOC)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853871709	EG	On-Demand	Mild	EPHX2	45	38
CC(=O)Nc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871722	GJ	On-Demand	Anodyne	KDR	24	40
CC(=O)Nc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871722	GJ	On-Demand	Anodyne	IMDH_CRYPV	56	34
CC(=O)Nc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871722	GJ	On-Demand	Anodyne	KCNK3	83	37
CC(=O)Nc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871722	GJ	On-Demand	Anodyne	KCNK9	72	37
C#CCCN(CCOC)C(=O)Nc1cccc(NC(C)=O)c1	ZINC000853871741	DE	On-Demand	Mild	KCNK3	84	36
C#CCCN(CCOC)C(=O)Nc1cccc(NC(C)=O)c1	ZINC000853871741	DE	On-Demand	Mild	KCNK9	72	36
Cc1nc(NC(=O)N2CCn3c(nnc3C(C)(C)C)C2)sc1-c1ccccc1	ZINC000853871742	GI	On-Demand	Anodyne	PIK3CG	20	48
Cc1cc(NC(=O)Nc2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000853871748	EI	On-Demand	Anodyne	KIT	21	40
Cc1cc(NC(=O)Nc2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000853871748	EI	On-Demand	Anodyne	RAF1	16	41
Cc1cc(NC(=O)Nc2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000853871748	EI	On-Demand	Anodyne	KDR	24	40
Cc1cc(NC(=O)Nc2cccnc2)ccc1NC(=O)OC(C)(C)C	ZINC000853871748	EI	On-Demand	Anodyne	NAMPT	26	60
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871753	IC	On-Demand	Anodyne	F2	26	44
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871753	IC	On-Demand	Anodyne	TRY2_BOVIN	107	44
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871753	IC	On-Demand	Anodyne	ST14	110	38
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871753	IC	On-Demand	Anodyne	AKR1C3	44	34
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871753	IC	On-Demand	Anodyne	TMPRSS6	43	35
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871754	IC	On-Demand	Anodyne	F2	26	44
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871754	IC	On-Demand	Anodyne	TRY2_BOVIN	107	44
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871754	IC	On-Demand	Anodyne	ST14	110	38
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871754	IC	On-Demand	Anodyne	AKR1C3	44	34
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)CC1	ZINC000853871754	IC	On-Demand	Anodyne	TMPRSS6	43	35
CC(=O)c1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871795	GK	On-Demand	Anodyne	RAF1	16	41
CC(=O)c1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871795	GK	On-Demand	Anodyne	KDR	21	41
CC(=O)c1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871795	GK	On-Demand	Anodyne	AKR1C3	30	44
CC(=O)c1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871795	GK	On-Demand	Anodyne	IMDH_CRYPV	59	38
CC(=O)c1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871795	GK	On-Demand	Anodyne	KCNK3	83	38
CC(=O)c1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853871795	GK	On-Demand	Anodyne	KCNK9	48	38
COc1ncccc1NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853871799	EE	On-Demand	Anodyne	P2RY1	43	40
CN1CCN(c2ccccc2NC(=O)N2CCn3c(nnc3C(C)(C)C)C2)CC1	ZINC000853871854	GE	On-Demand	Anodyne	KCNQ2	69	37
COC[C@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871864	EG	On-Demand	Anodyne	ROCK1	17	40
COC[C@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871864	EG	On-Demand	Anodyne	MTNR1A	40	40
COC[C@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871864	EG	On-Demand	Anodyne	MTNR1B	41	40
COC[C@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871864	EG	On-Demand	Anodyne	ROCK2	18	40
COC[C@@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871865	EG	On-Demand	Anodyne	ROCK1	17	40
COC[C@@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871865	EG	On-Demand	Anodyne	MTNR1A	40	40
COC[C@@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871865	EG	On-Demand	Anodyne	MTNR1B	41	40
COC[C@@H](NC(=O)NCc1c(C)cccc1C)c1cccc(OC)c1	ZINC000853871865	EG	On-Demand	Anodyne	ROCK2	18	40
O=C(NOCC1CCC1)Nc1nc2ccccc2s1	ZINC000853871880	CG	On-Demand	Anodyne	CSNK1D	43	49
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	CHRM2	25	51
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	CHRM1	24	51
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	DRD2	32	61
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	DRD4	57	61
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	ACHE	55	48
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	HRH2	19	42
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	DRD3	23	61
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	SLC6A3	15	45
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	KCNH2	17	45
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	CHRM3	34	51
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	LTA4H	29	45
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	SIGMAR1	85	60
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	SSTR5	55	38
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	CCR3	49	46
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	SLC6A5	25	47
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	EPHX2	32	55
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	CXCR3	31	42
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	MCHR1	51	51
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	CACNA1G	26	52
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	CCR8	20	44
O=C(NOCC1CCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000853871896	DF	On-Demand	Anodyne	NPFFR1	41	36
O=C(NOCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853871915	CE	On-Demand	Bother	CACNA1C	56	46
O=C(NOCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853871915	CE	On-Demand	Bother	CACNA1D	87	46
O=C(NOCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853871915	CE	On-Demand	Bother	CCR3	22	46
O=C(NOCC1CCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000853871915	CE	On-Demand	Bother	NMBR	42	35
O=C(NOCC1CCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853871917	CE	On-Demand	Bother	NMBR	59	35
O=C(NOCC1CCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000853871917	CE	On-Demand	Bother	SLC27A4	53	34
Cc1nc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)sc1C	ZINC000853871925	FG	On-Demand	Anodyne	CCR3	26	40
COc1ncccc1NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853871926	EE	On-Demand	Anodyne	P2RY1	43	40
CN1CCN(c2ccccc2NC(=O)NC2CC(C)(C)C2)CC1	ZINC000853871931	DF	On-Demand	Anodyne	KCNQ2	79	43
CN1CCN(c2ccccc2NC(=O)NC2CC(C)(C)C2)CC1	ZINC000853871931	DF	On-Demand	Anodyne	P2RY1	44	40
CN1CCN(c2ccccc2NC(=O)NC2CC(C)(C)C2)CC1	ZINC000853871931	DF	On-Demand	Anodyne	WDR5	33	40
C#CCCN(CCOC)C(=O)Nc1ccccc1C(F)(F)F	ZINC000853871940	DG	On-Demand	Mild	RBP4	19	44
Cc1cc(NC(=O)Nc2ccc(F)cc2F)ccc1NC(=O)OC(C)(C)C	ZINC000853871942	GK	On-Demand	Anodyne	P2RY1	22	43
Cc1cc(NC(=O)Nc2ccc(F)cc2F)ccc1NC(=O)OC(C)(C)C	ZINC000853871942	GK	On-Demand	Anodyne	KDR	15	43
Cc1cc(NC(=O)Nc2ccc(F)cc2F)ccc1NC(=O)OC(C)(C)C	ZINC000853871942	GK	On-Demand	Anodyne	PDGFRA	15	43
CON(C(=O)Nc1ccccn1)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871945	EI	On-Demand	Anodyne	PDS	43	36
CON(C(=O)Nc1ccccn1)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000853871947	EI	On-Demand	Anodyne	PDS	43	36
N#Cc1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871949	BE	On-Demand	Mild	CCR3	15	42
N#Cc1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871949	BE	On-Demand	Mild	EPHX2	16	47
N#Cc1ccc(NC(=O)NOCC2CCC2)cc1	ZINC000853871949	BE	On-Demand	Mild	PFKFB3	47	31
CC(=O)c1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853871955	EG	On-Demand	Anodyne	IMDH_CRYPV	48	34
CC(=O)c1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853871957	EG	On-Demand	Anodyne	IMDH_CRYPV	48	34
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2c(C)cccc2C)cc1	ZINC000853871967	GF	On-Demand	Anodyne	ADRB2	46	56
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2c(C)cccc2C)cc1	ZINC000853871967	GF	On-Demand	Anodyne	ADRB1	75	56
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2c(C)cccc2C)cc1	ZINC000853871967	GF	On-Demand	Anodyne	ADRB3	49	41
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2c(C)cccc2C)cc1	ZINC000853871969	GF	On-Demand	Anodyne	ADRB2	46	56
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2c(C)cccc2C)cc1	ZINC000853871969	GF	On-Demand	Anodyne	ADRB1	75	56
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2c(C)cccc2C)cc1	ZINC000853871969	GF	On-Demand	Anodyne	ADRB3	49	41
Cc1cc(NC(=O)NCCc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853871972	FJ	On-Demand	Anodyne	CCKAR	27	41
C#CCCN(CCOC)C(=O)Nc1cccc(C)n1	ZINC000853871978	CD	On-Demand	Mild	GRM5	18	44
C#CCCN(CCOC)C(=O)Nc1ccc(-n2cccn2)c(F)c1	ZINC000853871979	EF	On-Demand	Mild	NPY2R	58	32
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	LPL	63	42
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	MAPK14	15	43
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	CA1	51	38
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	RAF1	15	41
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	CA12	23	43
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	CA9	22	43
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	LIPG	23	42
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	MTCA1	23	42
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	P96878_MYCTU	27	42
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	KCNK3	71	36
Cc1cc(NC(=O)Nc2ccccc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872004	EJ	On-Demand	Anodyne	KCNK9	48	36
Cc1nc(NC(=O)N(C)CC2=CCSC2)sc1-c1ccccc1	ZINC000853872005	EI	On-Demand	Anodyne	PIK3CG	20	42
Cc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872008	DG	On-Demand	Anodyne	CCKAR	22	41
Cc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872008	DG	On-Demand	Anodyne	CCKBR	30	41
Cc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872008	DG	On-Demand	Anodyne	KCNK3	61	36
Cc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872008	DG	On-Demand	Anodyne	KCNK9	54	36
Cc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872009	DG	On-Demand	Anodyne	CCKAR	22	41
Cc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872009	DG	On-Demand	Anodyne	CCKBR	30	41
Cc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872009	DG	On-Demand	Anodyne	KCNK3	61	36
Cc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872009	DG	On-Demand	Anodyne	KCNK9	54	36
Cc1cc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)no1	ZINC000853872028	EI	On-Demand	Anodyne	RAF1	18	46
Cc1cc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)no1	ZINC000853872028	EI	On-Demand	Anodyne	FLT3	45	41
Cc1cc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)no1	ZINC000853872028	EI	On-Demand	Anodyne	CSF1R	16	41
C=CCCC(C)(C)NC(=O)Nc1cccnc1Cl	ZINC000853872046	CH	On-Demand	Mild	G2YM83_BOTF4	68	34
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872054	JH	On-Demand	Anodyne	F2	18	44
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872054	JH	On-Demand	Anodyne	BMP1	61	38
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872054	JH	On-Demand	Anodyne	MMP13	23	40
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872054	JH	On-Demand	Anodyne	TRY2_BOVIN	54	34
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872054	JH	On-Demand	Anodyne	ADAMTS4	27	40
COc1ccc2cc(CN(C)C(=O)[C@@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872054	JH	On-Demand	Anodyne	LIMK2	17	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872055	JH	On-Demand	Anodyne	F2	18	44
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872055	JH	On-Demand	Anodyne	BMP1	61	38
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872055	JH	On-Demand	Anodyne	MMP13	23	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872055	JH	On-Demand	Anodyne	TRY2_BOVIN	54	34
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872055	JH	On-Demand	Anodyne	ADAMTS4	27	40
COc1ccc2cc(CN(C)C(=O)[C@H](C)OC(=O)c3cccc(S(=O)(=O)NC(C)C)c3)ccc2c1	ZINC000853872055	JH	On-Demand	Anodyne	LIMK2	17	40
CCn1cc(NC(=O)N2CCN(c3ccc(C)cc3C)CC2)ccc1=O	ZINC000853872064	FF	On-Demand	Anodyne	P2RY12	15	40
O=C(NCCS(=O)(=O)CC1CC1)N(CCN1CCOCC1)CC1CC1	ZINC000853872162	FC	On-Demand	Anodyne	CASR	41	33
C#CCCN(CCOC)C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853872189	ED	On-Demand	Mild	DRD3	46	37
C#CCCN(CCOC)C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853872189	ED	On-Demand	Mild	KCNQ2	76	39
O=C(NOCC1CCC1)Nc1cccc(Cl)c1	ZINC000853872201	CG	On-Demand	Anodyne	PPIA	19	40
O=C(NOCC1CCC1)Nc1cccc(Cl)c1	ZINC000853872201	CG	On-Demand	Anodyne	CCR3	35	41
O=C(NOCC1CCC1)Nc1cccc(Cl)c1	ZINC000853872201	CG	On-Demand	Anodyne	GRM5	15	46
O=C(NOCC1CCC1)Nc1cccc(Cl)c1	ZINC000853872201	CG	On-Demand	Anodyne	EPHX2	28	65
O=C(NOCC1CCC1)Nc1cccc(Cl)c1	ZINC000853872201	CG	On-Demand	Anodyne	F13A1	15	43
COc1ccccc1NC(=O)NOCC1CCC1	ZINC000853872210	CF	On-Demand	Anodyne	CCR3	23	44
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1	ZINC000853872234	CG	On-Demand	Anodyne	CA1	15	43
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1	ZINC000853872234	CG	On-Demand	Anodyne	EPHX2	34	45
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1	ZINC000853872234	CG	On-Demand	Anodyne	CA12	15	43
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1	ZINC000853872234	CG	On-Demand	Anodyne	MTCA1	23	43
O=C(NOCC1CCC1)Nc1ccc(Cl)cc1	ZINC000853872234	CG	On-Demand	Anodyne	P96878_MYCTU	24	43
O=C(NOCC1CCC1)Nc1cccnc1	ZINC000853872238	BD	On-Demand	Anodyne	NAMPT	48	45
O=C(NOCC1CCC1)Nc1ccc(F)cc1	ZINC000853872249	BF	On-Demand	Anodyne	CA1	17	43
O=C(NOCC1CCC1)Nc1ccc(F)cc1	ZINC000853872249	BF	On-Demand	Anodyne	CCR3	67	41
O=C(NOCC1CCC1)Nc1ccc(F)cc1	ZINC000853872249	BF	On-Demand	Anodyne	EPHX2	35	43
O=C(NOCC1CCC1)Nc1ccc(F)cc1	ZINC000853872249	BF	On-Demand	Anodyne	CA12	15	43
O=C(NOCC1CCC1)Nc1ccc(F)cc1	ZINC000853872249	BF	On-Demand	Anodyne	MTCA1	28	43
O=C(NOCC1CCC1)Nc1ccc(F)cc1	ZINC000853872249	BF	On-Demand	Anodyne	P96878_MYCTU	26	43
CC(C)c1ccccc1NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853872265	EI	On-Demand	Anodyne	SOAT1	26	40
CC(C)c1ccccc1NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C	ZINC000853872266	EI	On-Demand	Anodyne	SOAT1	26	40
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	HTR1A	67	56
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	DRD2	62	51
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	DRD1	19	40
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	DRD4	58	47
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	ADRA1D	21	41
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	HTR2A	54	49
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	HTR2C	37	44
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	SLC6A4	16	44
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	ADRA1A	23	41
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	ADRA1B	16	41
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	DRD3	92	51
C#CCCN(CCOC)C(=O)NCCN1CCN(c2cccc(Cl)c2)CC1	ZINC000853872280	GE	On-Demand	Mild	HTR7	44	40
Cc1cc(NC(=O)NCc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872290	FJ	On-Demand	Anodyne	ROCK2	16	40
Cc1cc(NC(=O)NCc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872290	FJ	On-Demand	Anodyne	LEF	46	36
COc1ccc(NC(=O)[C@H](C)OC(=O)c2cccc(S(=O)(=O)NC(C)C)c2)c(OC)c1	ZINC000853872293	JF	On-Demand	Anodyne	ST14	17	40
CON(C(=O)Nc1nncs1)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000853872306	EH	On-Demand	Anodyne	NR3C1	22	40
CON(C(=O)Nc1nncs1)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000853872307	EH	On-Demand	Anodyne	NR3C1	22	40
Cc1cc(NC(=O)Nc2cnn(CC(N)=O)c2)ccc1NC(=O)OC(C)(C)C	ZINC000853872313	GF	On-Demand	Anodyne	PANC	41	32
O=C(NOCC1CCC1)c1cc([N+](=O)[O-])c[nH]1	ZINC000853872321	BD	On-Demand	Bother	CACNA1C	36	41
O=C(NOCC1CCC1)c1cc([N+](=O)[O-])c[nH]1	ZINC000853872321	BD	On-Demand	Bother	CACNA1D	54	41
C#CCCN(CCOC)C(=O)Nc1ccc(N2CCOCC2)cn1	ZINC000853872331	ED	On-Demand	Mild	STAT6	51	33
CC(=O)Nc1cccc(NC(=O)N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853872341	GG	On-Demand	Anodyne	EPHX2	23	40
C#CCCN(CCOC)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853872360	DH	On-Demand	Mild	ROCK2	16	48
CCn1cc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)cn1	ZINC000853872385	FI	On-Demand	Anodyne	PANC	46	33
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	KIT	19	44
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	RAF1	24	51
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	KDR	30	44
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	MTNR1A	19	45
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	MTNR1B	25	45
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	PDGFRA	29	42
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	TEK	16	42
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	LIMK1	16	48
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	TAAR1	35	41
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	AKR1C3	20	40
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	KCNK3	59	44
COc1cccc(NC(=O)Nc2ccc(NC(=O)OC(C)(C)C)c(C)c2)c1	ZINC000853872409	FJ	On-Demand	Anodyne	KCNK9	58	35
Cc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)n1	ZINC000853872441	DF	On-Demand	Anodyne	GRM5	15	40
Cc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)n1	ZINC000853872442	DF	On-Demand	Anodyne	GRM5	15	40
Cc1cc(NC(=O)Nc2ccccn2)ccc1NC(=O)OC(C)(C)C	ZINC000853872469	EI	On-Demand	Anodyne	MAPK14	15	40
Cc1cc(NC(=O)Nc2ccccn2)ccc1NC(=O)OC(C)(C)C	ZINC000853872469	EI	On-Demand	Anodyne	P2RY1	55	43
Cc1cc(NC(=O)Nc2ccccn2)ccc1NC(=O)OC(C)(C)C	ZINC000853872469	EI	On-Demand	Anodyne	RAF1	17	41
Cc1cc(NC(=O)Nc2ccccn2)ccc1NC(=O)OC(C)(C)C	ZINC000853872469	EI	On-Demand	Anodyne	GRM4	38	41
Cc1cc(NC(=O)Nc2ccccn2)ccc1NC(=O)OC(C)(C)C	ZINC000853872469	EI	On-Demand	Anodyne	FLT3	32	44
COc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872474	EG	On-Demand	Anodyne	CCR3	19	41
COc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872474	EG	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872474	EG	On-Demand	Anodyne	MTNR1B	30	44
COc1cccc(NC(=O)N[C@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872474	EG	On-Demand	Anodyne	TAAR1	33	40
COc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872475	EG	On-Demand	Anodyne	CCR3	19	41
COc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872475	EG	On-Demand	Anodyne	MTNR1A	29	42
COc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872475	EG	On-Demand	Anodyne	MTNR1B	30	44
COc1cccc(NC(=O)N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c1	ZINC000853872475	EG	On-Demand	Anodyne	TAAR1	33	40
Cc1cc(NC(=O)NCCc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872484	GJ	On-Demand	Anodyne	CCR3	44	36
Cc1cc(NC(=O)NCCc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872484	GJ	On-Demand	Anodyne	RAF1	23	41
Cc1cc(NC(=O)NCCc2ccc(F)cc2)ccc1NC(=O)OC(C)(C)C	ZINC000853872484	GJ	On-Demand	Anodyne	LEF	40	35
Cc1cc(NC(=O)Nc2nccs2)ccc1NC(=O)OC(C)(C)C	ZINC000853872493	EI	On-Demand	Anodyne	MAP1	99	39
Cc1nnc(CN(C)C(=O)Nc2cccnc2Cl)s1	ZINC000853872510	CF	On-Demand	Anodyne	G2YM83_BOTF4	70	37
C#CCCN(CCOC)C(=O)Nc1cccc(C(C)=O)c1	ZINC000853872531	CE	On-Demand	Mild	CASR	19	43
C#CCCN(CCOC)C(=O)Nc1cccc(C(C)=O)c1	ZINC000853872531	CE	On-Demand	Mild	KCNK3	100	35
C#CCCN(CCOC)C(=O)Nc1cccc(C(C)=O)c1	ZINC000853872531	CE	On-Demand	Mild	KCNK9	63	34
Cc1cc(NC(=O)Nc2cn[nH]c2)ccc1NC(=O)OC(C)(C)C	ZINC000853872548	EH	On-Demand	Anodyne	ROCK2	16	40
Cc1cc(NC(=O)NCCN2CCCC[C@@H]2C)ccc1NC(=O)OC(C)(C)C	ZINC000853872556	GI	On-Demand	Anodyne	HRH3	22	42
Cc1cc(NC(=O)NCCN2CCCC[C@H]2C)ccc1NC(=O)OC(C)(C)C	ZINC000853872557	GI	On-Demand	Anodyne	HRH3	22	42
COc1ncccc1NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1	ZINC000853872561	FI	On-Demand	Anodyne	P2RY1	61	48
COc1ncccc1NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1	ZINC000853872561	FI	On-Demand	Anodyne	KDR	28	41
COc1ncccc1NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)c(C)c1	ZINC000853872561	FI	On-Demand	Anodyne	PDGFRA	36	40
Cc1cc(NC(=O)NCC2CCCC2)ccc1NC(=O)OC(C)(C)C	ZINC000853872581	EJ	On-Demand	Anodyne	PRMT3	25	41
C#CCCN(CCOC)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000853872586	CF	On-Demand	Mild	MCHR1	24	41
CN1CCN(c2ccccc2NC(=O)N(C)CC2=CCSC2)CC1	ZINC000853872594	EF	On-Demand	Anodyne	KCNQ2	73	38
COCCOc1ccc(NC(=O)NC[C@H](O)c2cc(F)c(F)c(F)c2)cn1	ZINC000853872600	GE	On-Demand	Anodyne	ADRB1	36	40
COCCOc1ccc(NC(=O)NC[C@@H](O)c2cc(F)c(F)c(F)c2)cn1	ZINC000853872601	GE	On-Demand	Anodyne	ADRB1	36	40
C#CCCN(CCOC)C(=O)Nc1ccccc1N1CCN(CC)CC1	ZINC000853872613	FE	On-Demand	Mild	HTR1A	47	37
C#CCCN(CCOC)C(=O)Nc1ccccc1N1CCN(CC)CC1	ZINC000853872613	FE	On-Demand	Mild	DRD2	42	37
C#CCCN(CCOC)C(=O)Nc1ccccc1N1CCN(CC)CC1	ZINC000853872613	FE	On-Demand	Mild	DRD3	60	37
C#CCCN(CCOC)C(=O)Nc1ccccc1N1CCN(CC)CC1	ZINC000853872613	FE	On-Demand	Mild	KCNQ2	76	39
COCCC(=O)N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853872620	FD	On-Demand	Anodyne	EPHX2	40	46
COCCC(=O)N1CCC(NC(=O)N[C@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853872620	FD	On-Demand	Anodyne	CCR8	51	34
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853872621	FD	On-Demand	Anodyne	EPHX2	40	46
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)CC1	ZINC000853872621	FD	On-Demand	Anodyne	CCR8	51	34
COCCC(=O)N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853872622	FD	On-Demand	Anodyne	EPHX2	40	46
COCCC(=O)N1CCC(NC(=O)N[C@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853872622	FD	On-Demand	Anodyne	CCR8	51	34
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853872623	FD	On-Demand	Anodyne	EPHX2	40	46
COCCC(=O)N1CCC(NC(=O)N[C@@H]2C[C@H](O)c3ccccc32)CC1	ZINC000853872623	FD	On-Demand	Anodyne	CCR8	51	34
COC(=O)N(C)CCNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1	ZINC000853872625	FC	On-Demand	Anodyne	TGM2	25	43
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000853872637	GD	On-Demand	Reactive	SLC18A3	15	47
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000853872638	GD	On-Demand	Reactive	SLC18A3	15	47
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000853872639	GD	On-Demand	Reactive	SLC18A3	15	47
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000853872640	GD	On-Demand	Reactive	SLC18A3	15	47
C#CCCN(CCOC)C(=O)Nc1nc(C)c(-c2ccccc2)s1	ZINC000853872642	EH	On-Demand	Mild	PIK3CG	18	40
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853872665	EC	On-Demand	Bother	CA2	45	41
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853872665	EC	On-Demand	Bother	CA1	43	39
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853872665	EC	On-Demand	Bother	CA4	47	39
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853872665	EC	On-Demand	Bother	CA5A	40	33
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853872665	EC	On-Demand	Bother	BCL2L1	16	40
COCCC(=O)N1CCC(NC(=O)NNc2cc(F)cc(Cl)c2)CC1	ZINC000853872670	FE	On-Demand	Reactive	EPHX2	30	50
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000853872686	GF	On-Demand	Reactive	SLC18A3	29	40
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000853872687	GF	On-Demand	Reactive	SLC18A3	29	40
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000853872688	GF	On-Demand	Reactive	SLC18A3	29	40
O=C(NNc1cc(F)cc(Cl)c1)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000853872689	GF	On-Demand	Reactive	SLC18A3	29	40
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853872704	FD	On-Demand	Anodyne	SIGMAR1	16	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853872704	FD	On-Demand	Anodyne	SLC18A3	78	46
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853872705	FD	On-Demand	Anodyne	SIGMAR1	16	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853872705	FD	On-Demand	Anodyne	SLC18A3	78	46
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853872706	FD	On-Demand	Anodyne	SIGMAR1	16	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853872706	FD	On-Demand	Anodyne	SLC18A3	78	46
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853872707	FD	On-Demand	Anodyne	SIGMAR1	16	44
O=C(NC1CCN([C@@H]2CCC[C@@H]2O)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853872707	FD	On-Demand	Anodyne	SLC18A3	78	46
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)Nc1nc2c(s1)CCCC2	ZINC000853872711	FG	On-Demand	Anodyne	SLC27A1	38	42
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)Nc1nc2c(s1)CCCC2	ZINC000853872712	FG	On-Demand	Anodyne	SLC27A1	38	42
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853872732	FG	On-Demand	Mild	ROCK2	43	39
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853872732	FG	On-Demand	Mild	SCD1	40	44
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853872732	FG	On-Demand	Mild	SCD	39	48
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853872735	EG	On-Demand	Mild	CDK5	16	43
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853872735	EG	On-Demand	Mild	SCD1	38	40
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000853872735	EG	On-Demand	Mild	SCD	34	41
COC(=O)N(C)CCNc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000853872748	CC	On-Demand	Bother	TAAR1	20	48
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853872760	FE	On-Demand	Anodyne	SIGMAR1	17	47
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853872760	FE	On-Demand	Anodyne	SLC18A3	85	49
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853872760	FE	On-Demand	Anodyne	EPHX2	22	41
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853872761	FE	On-Demand	Anodyne	SIGMAR1	17	47
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853872761	FE	On-Demand	Anodyne	SLC18A3	85	49
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853872761	FE	On-Demand	Anodyne	EPHX2	22	41
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853872762	FE	On-Demand	Anodyne	SIGMAR1	17	47
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853872762	FE	On-Demand	Anodyne	SLC18A3	85	49
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853872762	FE	On-Demand	Anodyne	EPHX2	22	41
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853872763	FE	On-Demand	Anodyne	SIGMAR1	17	47
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853872763	FE	On-Demand	Anodyne	SLC18A3	85	49
O=C(NC1CCN([C@@H]2CCCC[C@@H]2O)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853872763	FE	On-Demand	Anodyne	EPHX2	22	41
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)Nc1ccc(N2CCOCC2)cn1	ZINC000853872765	GE	On-Demand	Anodyne	STAT6	60	38
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)Nc1ccc(N2CCOCC2)cn1	ZINC000853872766	GE	On-Demand	Anodyne	STAT6	60	38
CON(C)CCNC(=O)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000853872772	DC	On-Demand	Anodyne	EPHX2	17	40
CON(C)CCNC(=O)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000853872773	DC	On-Demand	Anodyne	EPHX2	17	40
CON(C)CCNC(=O)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000853872774	DC	On-Demand	Anodyne	EPHX2	17	40
CON(C)CCNC(=O)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000853872775	DC	On-Demand	Anodyne	EPHX2	17	40
C#CCCN(CCOC)C(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853872784	DD	On-Demand	Mild	CASP3	15	45
C#CCCN(CCOC)C(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853872784	DD	On-Demand	Mild	CASP2	18	42
C#CCCN(CCOC)C(=O)Nc1ccc2c(c1)C(=O)NC2=O	ZINC000853872784	DD	On-Demand	Mild	CASP6	15	42
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)Nc1nc2c(s1)CCC2	ZINC000853872786	FF	On-Demand	Anodyne	SLC27A1	32	42
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)Nc1nc2c(s1)CCC2	ZINC000853872787	FF	On-Demand	Anodyne	SLC27A1	32	42
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CA2	97	45
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CA1	87	43
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CA7	41	42
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CA4	81	43
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CA14	38	45
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CA12	61	45
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CA9	64	45
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	CYNT	35	41
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	MTCA1	49	43
C#CCCN(CCOC)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000853872797	EC	On-Demand	Mild	P96878_MYCTU	61	43
C[C@H]1CN(c2ccc(NC(=O)N3Cc4ccccc4[C@H]3C)cc2F)C[C@H](C)O1	ZINC000853872800	GJ	On-Demand	Anodyne	NPY2R	69	36
C[C@H]1CN(c2ccc(NC(=O)N3Cc4ccccc4[C@H]3C)cc2F)C[C@H](C)O1	ZINC000853872800	GJ	On-Demand	Anodyne	TRPM8	18	41
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N1CCc2ccccc2C1	ZINC000853872808	FF	On-Demand	Anodyne	DPP8	25	41
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N1CCc2ccccc2C1	ZINC000853872809	FF	On-Demand	Anodyne	DPP8	25	41
NC(=O)c1cccc2c1CCN(C(=O)N1CCCCC1)C2	ZINC000853872815	CD	On-Demand	Anodyne	PARP1	17	43
COC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1	ZINC000853872822	GD	On-Demand	Bother	TBXA2R	23	40
C#CCCN(CCOC)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853872834	CE	On-Demand	Mild	CACNA1C	56	45
C#CCCN(CCOC)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853872834	CE	On-Demand	Mild	CACNA1D	90	45
COC(=O)N(C)CCNc1ccc(C(C)=O)cc1[N+](=O)[O-]	ZINC000853872836	CD	On-Demand	Bother	TAAR1	20	48
O=C(Nc1ccc(Cl)nc1)NC1CC(CO)C1	ZINC000853872843	CD	On-Demand	Anodyne	EPHX2	35	43
O=C(Nc1ccc(Cl)nc1)N[C@H]1C[C@H](O)C1	ZINC000853872849	BD	On-Demand	Anodyne	EPHX2	46	47
COC(=O)N(C)CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000853872858	ED	On-Demand	Bother	COLA	50	31
COC(=O)N(C)CCNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000853872858	ED	On-Demand	Bother	BCL2L1	23	40
C#CCCN(CCOC)C(=O)Nc1cccnc1Cl	ZINC000853872860	CE	On-Demand	Mild	G2YM83_BOTF4	68	34
C#CCCN(CCOC)C(=O)Nc1nc(-c2ccccc2)ns1	ZINC000853872866	EF	On-Demand	Mild	CASR	15	47
C#CCCN(CCOC)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	ZINC000853872867	GH	On-Demand	Mild	TNF	40	37
C#CCCN(CCOC)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	ZINC000853872867	GH	On-Demand	Mild	PTK2B	33	40
C#CCCN(CCOC)C(=O)Nc1cc(C(C)(C)C)nn1-c1ccc(F)cc1	ZINC000853872867	GH	On-Demand	Mild	DDR2	33	43
C#CCCN(CCOC)C(=O)Nc1nccs1	ZINC000853872868	CD	On-Demand	Mild	MAP1	127	39
C#CCCN(CCOC)C(=O)Nc1ccc(-n2nc(C)cc2C)nc1	ZINC000853872869	EE	On-Demand	Mild	ADORA2A	26	41
O=C(Nc1ccc(-c2ccccc2)cc1)NC1CC(CO)C1	ZINC000853872877	CG	On-Demand	Anodyne	CA1	22	42
O=C(Nc1ccc(-c2ccccc2)cc1)NC1CC(CO)C1	ZINC000853872877	CG	On-Demand	Anodyne	PRNP	23	42
O=C(Nc1ccc(-c2ccccc2)cc1)NC1CC(CO)C1	ZINC000853872877	CG	On-Demand	Anodyne	EPHX2	49	41
O=C(Nc1ccc(-c2ccccc2)cc1)NC1CC(CO)C1	ZINC000853872877	CG	On-Demand	Anodyne	SLC1A2	21	40
O=C(Nc1ccc(-c2ccccc2)cc1)NC1CC(CO)C1	ZINC000853872877	CG	On-Demand	Anodyne	DGAT1	20	41
C#CCCN(CCOC)C(=O)Nc1cccnc1	ZINC000853872881	BD	On-Demand	Mild	NAMPT	15	41
CN1CCN(c2ccccc2NC(=O)N2CCc3c(cccc3C(N)=O)C2)CC1	ZINC000853872896	GE	On-Demand	Anodyne	HTR1B	15	40
CN1CCN(c2ccccc2NC(=O)N2CCc3c(cccc3C(N)=O)C2)CC1	ZINC000853872896	GE	On-Demand	Anodyne	KCNQ2	68	37
C[C@H]1CN(c2ccc(NC(=O)NC3CC(CO)C3)cc2F)C[C@@H](C)O1	ZINC000853872898	FE	On-Demand	Anodyne	NPY2R	63	37
C[C@H]1CN(c2ccc(NC(=O)NC3CC(CO)C3)cc2F)C[C@H](C)O1	ZINC000853872900	FE	On-Demand	Anodyne	NPY2R	63	37
C#CCCN(CCOC)C(=O)Nc1nc2c(s1)CCCC2	ZINC000853872905	DF	On-Demand	Mild	SLC27A1	28	40
COCCC(=O)N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853872928	FD	On-Demand	Reactive	CCR3	18	40
COCCC(=O)N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853872928	FD	On-Demand	Reactive	EPHX2	30	40
COCCC(=O)N1CCC(NC(=O)NNc2cc(F)ccc2C)CC1	ZINC000853872928	FD	On-Demand	Reactive	CCR8	71	38
Cc1nc(NC(=O)NC2CC(CO)C2)sc1-c1ccccc1	ZINC000853872929	DG	On-Demand	Anodyne	PIK3CG	22	46
Cc1nc(NC(=O)NC2CC(CO)C2)sc1-c1ccccc1	ZINC000853872929	DG	On-Demand	Anodyne	PI4KB	41	39
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000853872930	GF	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@H]2CCC[C@H]2O)CC1	ZINC000853872930	GF	On-Demand	Anodyne	SLC18A3	47	39
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000853872931	GF	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@H]2CCC[C@@H]2O)CC1	ZINC000853872931	GF	On-Demand	Anodyne	SLC18A3	47	39
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000853872932	GF	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@@H]2CCC[C@@H]2O)CC1	ZINC000853872932	GF	On-Demand	Anodyne	SLC18A3	47	39
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000853872933	GF	On-Demand	Anodyne	SIGMAR1	18	45
O=C(NC[C@H](O)c1cccc2ccccc12)NC1CCN([C@@H]2CCC[C@H]2O)CC1	ZINC000853872933	GF	On-Demand	Anodyne	SLC18A3	47	39
O=C(NC1CC(CO)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853872934	DD	On-Demand	Bother	CACNA1D	65	35
CN1CCN(c2ccccc2NC(=O)N[C@H]2C[C@H](O)C2)CC1	ZINC000853872949	DD	On-Demand	Anodyne	KCNQ2	80	43
CN1CCN(c2ccccc2NC(=O)N[C@H]2C[C@H](O)C2)CC1	ZINC000853872949	DD	On-Demand	Anodyne	EPHX2	18	40
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853872990	FG	On-Demand	Mild	SCD1	41	44
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2cccc(F)c2)s1	ZINC000853872990	FG	On-Demand	Mild	SCD	38	44
C#CCCN(CCOC)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000853872996	DD	On-Demand	Mild	CASR	20	49
C#CCCN(CCOC)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000853872996	DD	On-Demand	Mild	KCNK3	92	34
C#CCCN(CCOC)C(=O)Nc1cccc(C(=O)OC)c1	ZINC000853872996	DD	On-Demand	Mild	KCNK9	57	33
Cc1nc(NC(=O)N[C@H]2C[C@H](O)C2)sc1-c1ccccc1	ZINC000853873012	DF	On-Demand	Anodyne	PIK3CG	23	49
Cc1nc(NC(=O)N[C@H]2C[C@H](O)C2)sc1-c1ccccc1	ZINC000853873012	DF	On-Demand	Anodyne	PI4KB	41	39
COCCC(=O)N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853873028	FD	On-Demand	Reactive	EPHX2	38	45
COCCC(=O)N1CCC(NC(=O)NNc2ccc(C)c(F)c2)CC1	ZINC000853873028	FD	On-Demand	Reactive	CCR8	52	36
O=C(N[C@H]1C[C@H](O)C1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853873029	DD	On-Demand	Bother	CACNA1D	52	35
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000853873036	GE	On-Demand	Reactive	SLC18A3	23	49
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000853873037	GE	On-Demand	Reactive	SLC18A3	23	49
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000853873038	GE	On-Demand	Reactive	SLC18A3	23	49
O=C(NNc1ccc([N+](=O)[O-])cc1F)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000853873039	GE	On-Demand	Reactive	SLC18A3	23	49
NC(=O)c1cccc2c1CCN(C(=O)N1CCCC1)C2	ZINC000853873052	CD	On-Demand	Anodyne	PARP1	19	43
C#CCCN(CCOC)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC000853873053	DE	On-Demand	Mild	ACR	60	34
CN1CCN(c2ccccc2NC(=O)NC2CC(CO)C2)CC1	ZINC000853873059	DD	On-Demand	Anodyne	DRD2	15	41
CN1CCN(c2ccccc2NC(=O)NC2CC(CO)C2)CC1	ZINC000853873059	DD	On-Demand	Anodyne	KCNQ2	80	41
COCCC(=O)N1CCC(NC(=O)NCCN(C)OC)CC1	ZINC000853873081	DB	On-Demand	Anodyne	EPHX2	28	46
O=C(Nc1cccc(N2CCOC2=O)c1)N[C@H]1C[C@H](O)C1	ZINC000853873092	CD	On-Demand	Anodyne	EPHX2	35	41
COCCC(=O)N1CCC(NC(=O)NNc2cccc(C(=O)OC)c2C)CC1	ZINC000853873093	GD	On-Demand	Reactive	EPHX2	28	41
COCCC(=O)N1CCC(NC(=O)NNc2cccc(C(=O)OC)c2C)CC1	ZINC000853873093	GD	On-Demand	Reactive	CCR8	87	40
C#CCCN(CCOC)C(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000853873110	DG	On-Demand	Mild	EPHX2	17	41
C#CCCN(CCOC)C(=O)Nc1nc2ccccc2s1	ZINC000853873126	DF	On-Demand	Mild	CASR	20	46
C#CCCN(CCOC)C(=O)Nc1nc2ccccc2s1	ZINC000853873126	DF	On-Demand	Mild	CSNK1D	37	45
C#CCCN(CCOC)C(=O)Nc1nc2ccccc2s1	ZINC000853873126	DF	On-Demand	Mild	BCL2L1	41	32
CC(C)c1ccccc1NC(=O)NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853873134	FI	On-Demand	Anodyne	SOAT1	49	42
CC(C)c1ccccc1NC(=O)NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853873135	FI	On-Demand	Anodyne	SOAT1	49	42
COCCC(=O)N1CCC(NC(=O)NNc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853873141	GD	On-Demand	Reactive	CCR8	44	35
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000853873142	GH	On-Demand	Mild	SCD1	40	43
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2ccc(C)c(F)c2)s1	ZINC000853873142	GH	On-Demand	Mild	SCD	34	46
C#CCCN(CCOC)C(=O)Nc1ccc(N2CCCC2)nc1	ZINC000853873151	DE	On-Demand	Mild	DGAT1	42	39
CON(C)CCNC(=O)NC1CCN([C@@H]2CCCC[C@@H]2O)CC1	ZINC000853873169	EC	On-Demand	Anodyne	EPHX2	21	42
CON(C)CCNC(=O)NC1CCN([C@H]2CCCC[C@@H]2O)CC1	ZINC000853873170	EC	On-Demand	Anodyne	EPHX2	21	42
CON(C)CCNC(=O)NC1CCN([C@@H]2CCCC[C@H]2O)CC1	ZINC000853873171	EC	On-Demand	Anodyne	EPHX2	21	42
CON(C)CCNC(=O)NC1CCN([C@H]2CCCC[C@H]2O)CC1	ZINC000853873172	EC	On-Demand	Anodyne	EPHX2	21	42
C#CCCN(CCOC)C(=O)Nc1nc(CN2CCOCC2)cs1	ZINC000853873173	FD	On-Demand	Mild	CASR	46	42
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853873180	FG	On-Demand	Mild	SCD1	39	43
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000853873180	FG	On-Demand	Mild	SCD	33	43
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853873181	GH	On-Demand	Mild	SCD1	42	54
C#CCCN(CCOC)C(=O)Nc1ncc(Cc2cccc(Cl)c2)s1	ZINC000853873181	GH	On-Demand	Mild	SCD	38	54
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3C[C@H](O)C3)cc2F)C[C@@H](C)O1	ZINC000853873189	EE	On-Demand	Anodyne	NPY2R	63	35
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3C[C@H](O)C3)cc2F)C[C@H](C)O1	ZINC000853873191	EE	On-Demand	Anodyne	NPY2R	63	35
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)Nc1cccnc1N1CCCC1	ZINC000853873195	GF	On-Demand	Anodyne	KCNQ2	69	40
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)Nc1cccnc1N1CCCC1	ZINC000853873196	GF	On-Demand	Anodyne	KCNQ2	69	40
COCCC(=O)N1CCC(NC(=O)NCc2ccc([Si](C)(C)C)cc2)CC1	ZINC000853873203	GE	On-Demand	Anodyne	EPHX2	39	43
COCCC(=O)N1CCC(NC(=O)NCc2ccc([Si](C)(C)C)cc2)CC1	ZINC000853873203	GE	On-Demand	Anodyne	CCR8	51	35
C#CCCN(CCOC)C(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853873204	DD	On-Demand	Mild	KCNK3	71	36
C#CCCN(CCOC)C(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000853873204	DD	On-Demand	Mild	KCNK9	52	32
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)Nc1nc2c(s1)CCCCC2	ZINC000853873242	GH	On-Demand	Anodyne	SLC27A1	37	42
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)Nc1nc2c(s1)CCCCC2	ZINC000853873243	GH	On-Demand	Anodyne	SLC27A1	37	42
C#CCCN(CCOC)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC000853873244	GF	On-Demand	Mild	NPY2R	65	34
C#CCCN(CCOC)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC000853873245	GF	On-Demand	Mild	NPY2R	65	34
C#CCCN(CCOC)C(=O)Nc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1	ZINC000853873246	GF	On-Demand	Mild	NPY2R	65	34
COCc1cc([N+](=O)[O-])ccc1NCCN(C)C(=O)OC	ZINC000853873248	CD	On-Demand	Bother	CACNA1D	44	32
COC(=O)N(C)CCNc1ncccc1C(=O)N1CCCCC1	ZINC000853873250	DD	On-Demand	Anodyne	ADRA1D	15	54
COC(=O)N(C)CCNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-]	ZINC000853873255	FD	On-Demand	Bother	COLA	63	31
COC(=O)N(C)CCNc1cnn(-c2ccc(C)c(Cl)c2)c(=O)c1Cl	ZINC000853873256	GF	On-Demand	Anodyne	NPBWR1	38	40
COC(=O)N(C)CCNc1ccc2cc(OC)ccc2n1	ZINC000853873262	CE	On-Demand	Anodyne	MTNR1A	45	37
COC(=O)N(C)CCNc1ccc(S(=O)(=O)N2CCCC2)cn1	ZINC000853873277	EC	On-Demand	Anodyne	TGM2	29	43
COC(=O)N(C)CCNc1nccc(N2CCCC2)n1	ZINC000853873288	CD	On-Demand	Anodyne	SORD	54	37
COC(=O)N(C)CCNc1nccc(N2CCCC2)n1	ZINC000853873288	CD	On-Demand	Anodyne	EPHB4	49	36
COC(=O)N(C)CCNc1nccc(N2CCCC2)n1	ZINC000853873288	CD	On-Demand	Anodyne	MRGPRX1	45	41
COC(=O)N(C)CCNc1cc(C)nc(-c2cccnc2)n1	ZINC000853873289	DD	On-Demand	Anodyne	CYP11B2	17	40
COC(=O)N(C)CCNc1cc(C)nc(-c2cccnc2)n1	ZINC000853873289	DD	On-Demand	Anodyne	ROS1	58	42
COC(=O)N(C)CCNc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000853873293	EE	On-Demand	Anodyne	PTPRB	41	36
COC(=O)N(C)CCNc1nc(O)c2ccccc2n1	ZINC000853873301	CD	On-Demand	Anodyne	METG	40	30
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853873331	FD	On-Demand	Anodyne	CA2	50	41
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853873331	FD	On-Demand	Anodyne	CA1	44	41
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1C(F)(F)F	ZINC000853873331	FD	On-Demand	Anodyne	CA4	54	41
COC(=O)N(C)CCNc1cc(N2CCOCC2)ncn1	ZINC000853873343	CC	On-Demand	Anodyne	EPHB4	63	36
COC(=O)N(C)CCNc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000853873347	GG	On-Demand	Bother	TAAR1	24	54
COC(=O)N(C)CCNc1nc(N)c2cc(OC)c(OC)cc2n1	ZINC000853873348	ED	On-Demand	Anodyne	ADRA1D	20	46
COC(=O)N(C)CCNc1nc(N)c2cc(OC)c(OC)cc2n1	ZINC000853873348	ED	On-Demand	Anodyne	ADRA1A	15	46
COC(=O)N(C)CCNc1nc(N)c2cc(OC)c(OC)cc2n1	ZINC000853873348	ED	On-Demand	Anodyne	ADRA1B	44	46
COC(=O)N(C)CCNc1nc(N)c2cc(OC)c(OC)cc2n1	ZINC000853873348	ED	On-Demand	Anodyne	DRTS_TRYCR	56	34
COC(=O)N(C)CCNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853873350	CD	On-Demand	Bother	GSTM2	125	47
COC(=O)N(C)CCNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853873350	CD	On-Demand	Bother	GSTP1	78	45
COC(=O)N(C)CCNc1nc(-c2ccccn2)nc(C)c1C	ZINC000853873353	DE	On-Demand	Anodyne	METAP1	52	47
COC(=O)c1cc(NCCN(C)C(=O)OC)c2cc(Br)ccc2n1	ZINC000853873357	GF	On-Demand	Anodyne	NQO2	22	41
COC(=O)c1cc(NCCN(C)C(=O)OC)c2cc(Br)ccc2n1	ZINC000853873357	GF	On-Demand	Anodyne	NQO1	15	41
COC(=O)N(C)CCNc1ccnc2cc(Br)ccc12	ZINC000853873360	EG	On-Demand	Anodyne	HRP1_PLAFA	116	38
COC(=O)N(C)CCNc1ccnc2cc(Br)ccc12	ZINC000853873360	EG	On-Demand	Anodyne	HNMT	56	36
COC(=O)N(C)CCNc1ccnc2cc(F)ccc12	ZINC000853873370	CE	On-Demand	Anodyne	HRP1_PLAFA	116	38
COC(=O)N(C)CCNc1ccnc2cc(F)ccc12	ZINC000853873370	CE	On-Demand	Anodyne	HNMT	56	36
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853873378	FB	On-Demand	Anodyne	CA2	58	41
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853873378	FB	On-Demand	Anodyne	CA1	53	41
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853873378	FB	On-Demand	Anodyne	CA7	40	34
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853873378	FB	On-Demand	Anodyne	CA5B	44	34
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853873378	FB	On-Demand	Anodyne	CA4	60	41
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1S(C)(=O)=O	ZINC000853873378	FB	On-Demand	Anodyne	CA5A	46	34
COC(=O)N(C)CCNc1c(C#N)cnc2c(F)cc(F)cc12	ZINC000853873388	DE	On-Demand	Mild	MAP3K8	93	38
COC(=O)N(C)CCNc1ncnc2ccc(F)cc12	ZINC000853873389	CD	On-Demand	Anodyne	EGFR	76	44
COC(=O)N(C)CCNc1ncnc2ccc(F)cc12	ZINC000853873389	CD	On-Demand	Anodyne	ERBB2	45	41
COC(=O)N(C)CCNc1ncnc2ccc(F)cc12	ZINC000853873389	CD	On-Demand	Anodyne	DYRK1A	41	37
COC(=O)N(C)CCNc1ncnc2ccc(F)cc12	ZINC000853873389	CD	On-Demand	Anodyne	ERBB4	44	34
COC(=O)N(C)CCNc1ncnc2ccc(F)cc12	ZINC000853873389	CD	On-Demand	Anodyne	CLK4	64	42
COC(=O)N(C)CCNc1ncnc2ccc(F)cc12	ZINC000853873389	CD	On-Demand	Anodyne	CD38	21	40
COC(=O)N(C)CCNc1cc(-c2cccnc2)nc(C)n1	ZINC000853873390	DD	On-Demand	Anodyne	PTGDR	20	48
COC(=O)N(C)CCNc1cc(-c2cccnc2)nc(C)n1	ZINC000853873390	DD	On-Demand	Anodyne	ROS1	60	41
COC(=O)N(C)CCNc1ccc(C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000853873422	ED	On-Demand	Bother	TAAR1	21	48
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1C#N	ZINC000853873427	DC	On-Demand	Mild	CA2	47	39
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1C#N	ZINC000853873427	DC	On-Demand	Mild	CA1	43	39
COC(=O)N(C)CCNc1ccc(S(N)(=O)=O)cc1C#N	ZINC000853873427	DC	On-Demand	Mild	CA4	48	39
COC(=O)N(C)CCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000853873431	FE	On-Demand	Anodyne	MRGPRX1	35	41
COC(=O)N(C)CCNc1cnn(Cc2ccccc2)c(=O)c1Cl	ZINC000853873431	FE	On-Demand	Anodyne	NPBWR1	43	43
COC(=O)N(C)CCNc1ccc(S(=O)(=O)N2CCCCC2)cn1	ZINC000853873434	FD	On-Demand	Anodyne	TGM2	24	42
COC(=O)N(C)CCNc1ncnc2ccc([N+](=O)[O-])cc12	ZINC000853873448	DD	On-Demand	Bother	CLK4	58	38
COC(=O)N(C)CCNc1nc(-c2ccccc2)cs1	ZINC000853873457	CF	On-Demand	Anodyne	ROCK1	23	49
COC(=O)N(C)CCNc1nc(-c2ccccc2)cs1	ZINC000853873457	CF	On-Demand	Anodyne	ROCK2	17	49
COC(=O)N(C)CCNc1nc(-c2ccccc2)cs1	ZINC000853873457	CF	On-Demand	Anodyne	NPY5R	17	40
COC(=O)N(C)CCNc1nc(-c2ccccc2)cs1	ZINC000853873457	CF	On-Demand	Anodyne	VCP	31	42
COC(=O)N(C)CCNc1nccc(N2CCOCC2)n1	ZINC000853873459	CC	On-Demand	Anodyne	EPHB4	96	44
COC(=O)N(C)CCNc1nccc(N2CCOCC2)n1	ZINC000853873459	CC	On-Demand	Anodyne	STAT6	46	33
COC(=O)N(C)CCNc1nccc(N2CCOCC2)n1	ZINC000853873459	CC	On-Demand	Anodyne	MRGPRX1	46	40
COC(=O)N(C)CCNc1ncnc2cccc(F)c12	ZINC000853873473	CD	On-Demand	Anodyne	DYRK1A	45	32
COC(=O)N(C)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853873476	EE	On-Demand	Anodyne	CNR2	16	41
COC(=O)N(C)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853873476	EE	On-Demand	Anodyne	ACACB	15	41
COC(=O)N(C)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853873476	EE	On-Demand	Anodyne	TACR3	38	41
COC(=O)N(C)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853873476	EE	On-Demand	Anodyne	METG	94	33
COC(=O)N(C)CCNc1cc(C(=O)NC2CC2)c2ccccc2n1	ZINC000853873476	EE	On-Demand	Anodyne	TNKS	57	32
COC(=O)N(C)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000853873491	FE	On-Demand	Anodyne	ADRA1D	18	46
COC(=O)N(C)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000853873491	FE	On-Demand	Anodyne	AVPR2	61	39
COC(=O)N(C)CCNc1ncccc1C(=O)N1CCc2ccccc21	ZINC000853873491	FE	On-Demand	Anodyne	ADRA1A	15	46
COC(=O)N(C)CCNc1cccc([N+](=O)[O-])c1S(N)(=O)=O	ZINC000853873494	EC	On-Demand	Bother	COLA	89	33
COC(=O)N(C)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000853873500	FE	On-Demand	Anodyne	AVPR2	102	43
COC(=O)N(C)CCNc1ccc(C(=O)N2CCc3ccccc32)cn1	ZINC000853873500	FE	On-Demand	Anodyne	AVPR1A	62	43
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853873511	GG	On-Demand	Anodyne	CDK5	50	37
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853873511	GG	On-Demand	Anodyne	SCD1	38	42
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ncc(Cc2cccc(OC)c2)s1	ZINC000853873511	GG	On-Demand	Anodyne	SCD	36	49
COC(=O)N(C)CCNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000853873519	EE	On-Demand	Anodyne	PTR1	47	35
COC(=O)N(C)CCNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC000853873519	EE	On-Demand	Anodyne	L3MBTL3	42	37
COC(=O)N(C)CCNc1ccc(C#N)c(C(F)(F)F)c1	ZINC000853873520	DF	On-Demand	Mild	AR	67	47
COC(=O)N(C)CCNc1nc(-c2cccc(OC)c2)no1	ZINC000853873524	DD	On-Demand	Anodyne	HSD17B2	18	40
COC(=O)N(C)CCNc1cc(-c2ccccc2)nc2ncnn12	ZINC000853873525	ED	On-Demand	Anodyne	P2RY12	51	33
O=C(NCC1CCN(CC2CC2)CC1)C(F)(F)c1ccccc1F	ZINC000853873561	EG	On-Demand	Anodyne	HTR4	47	36
O=C(NCC1CCN(CC2CC2)CC1)C(F)(F)c1ccccc1F	ZINC000853873561	EG	On-Demand	Anodyne	SIGMAR1	25	43
O=C(NCC1CCN(CC2CC2)CC1)C(F)(F)c1ccccc1F	ZINC000853873561	EG	On-Demand	Anodyne	CACNA1I	62	37
COC(=O)N(C)CCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000853873571	CD	On-Demand	Bother	COLA	93	34
COC(=O)N(C)CCNc1nc(N(C)C)c2ccccc2n1	ZINC000853873572	DD	On-Demand	Anodyne	ADRA2A	17	51
COC(=O)N(C)CCNc1ncnc2[nH]c3ccccc3c12	ZINC000853873592	CE	On-Demand	Anodyne	UTS2R	23	46
COC(=O)N(C)CCNc1ncnc2c(OC)cc(OC)cc12	ZINC000853873598	DD	On-Demand	Anodyne	PDE6A	48	41
COC(=O)N(C)CCNc1ncnc2c1ncn2-c1ccccc1	ZINC000853873608	ED	On-Demand	Anodyne	ADORA3	50	36
COC(=O)N(C)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853873675	FC	On-Demand	Bother	COLA	68	33
COC(=O)N(C)CCNc1ccc(S(=O)(=O)N(C)C)cc1[N+](=O)[O-]	ZINC000853873675	FC	On-Demand	Bother	BCL2L1	36	40
COC(=O)N(C)CCNc1nc(-c2ccc(F)cc2)cs1	ZINC000853873678	DG	On-Demand	Anodyne	ROCK1	20	43
COC(=O)N(C)CCNc1nc(-c2ccc(F)cc2)cs1	ZINC000853873678	DG	On-Demand	Anodyne	ROCK2	15	43
COC(=O)N(C)CCNc1ccc(-n2nc(C)cc2C)nn1	ZINC000853873679	DD	On-Demand	Anodyne	ADORA2A	33	40
COC(=O)N(C)CCNc1cc(C(F)(F)F)nc(-c2cccnc2)n1	ZINC000853873680	FF	On-Demand	Anodyne	ROS1	50	38
COC(=O)N(C)CCNc1ncnc2ccc(I)cc12	ZINC000853873698	GE	On-Demand	Anodyne	EGFR	47	41
COC(=O)N(C)CCNc1ncnc2ccc(I)cc12	ZINC000853873698	GE	On-Demand	Anodyne	CLK4	63	37
COC(=O)N(C)CCNc1ncnc2ccc(I)cc12	ZINC000853873698	GE	On-Demand	Anodyne	CD38	29	43
COC(=O)N(C)CCNc1ccnc(-c2ccccc2)n1	ZINC000853873701	CE	On-Demand	Anodyne	PKNB	15	40
COC(=O)N(C)CCNc1ccc(C(=O)NC2CC2)cn1	ZINC000853873704	CD	On-Demand	Anodyne	MAPK11	20	40
COC(=O)N(C)CCNc1ccc(C(=O)NC2CC2)cn1	ZINC000853873704	CD	On-Demand	Anodyne	MAPK14	34	40
COC(=O)N(C)CCNc1ccc(C(=O)NC2CC2)cn1	ZINC000853873704	CD	On-Demand	Anodyne	SSTR5	35	42
COC(=O)N(C)CCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000853873715	ED	On-Demand	Bother	SLC27A4	41	29
COC(=O)N(C)CCNc1cc(C#N)c2ccccc2n1	ZINC000853873726	CE	On-Demand	Mild	METG	84	42
COC(=O)N(C)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853873730	FD	On-Demand	Bother	BCL2L1	61	36
COC(=O)N(C)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853873730	FD	On-Demand	Bother	BCL2	42	32
COC(=O)N(C)CCNc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000853873730	FD	On-Demand	Bother	LRRK2	18	41
COC(=O)N(C)CCNc1ncc(C(=O)N2CCOCC2)cc1Cl	ZINC000853873736	FD	On-Demand	Anodyne	LRRK2	34	42
COC(=O)N(C)CCNc1ncnc2ccc(Br)cc12	ZINC000853873739	EF	On-Demand	Anodyne	EGFR	115	45
COC(=O)N(C)CCNc1ncnc2ccc(Br)cc12	ZINC000853873739	EF	On-Demand	Anodyne	ERBB2	34	42
COC(=O)N(C)CCNc1ncnc2ccc(Br)cc12	ZINC000853873739	EF	On-Demand	Anodyne	CLK4	64	38
COC(=O)N(C)CCNc1ncnc2ccc(Br)cc12	ZINC000853873739	EF	On-Demand	Anodyne	CD38	19	41
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCN(C)C(=O)OC)c([N+](=O)[O-])c1	ZINC000853873751	GC	On-Demand	Bother	TAAR1	20	46
COC(=O)N(C)CCNc1ncnc2ccc(C)cc12	ZINC000853873758	CE	On-Demand	Anodyne	EGFR	55	38
COC(=O)N(C)CCNc1ncnc2ccc(C)cc12	ZINC000853873758	CE	On-Demand	Anodyne	CLK4	66	39
COC(=O)N(C)CCNc1ncnc2ccc(C)cc12	ZINC000853873758	CE	On-Demand	Anodyne	CD38	23	41
COC(=O)N(C)CCNc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000853873759	ED	On-Demand	Bother	TAAR1	20	46
Cc1nc(C(=O)NCC2CCN(CC3CC3)CC2)no1	ZINC000853873764	CD	On-Demand	Anodyne	HTR4	54	43
Cc1nc(C(=O)NCC2CCN(CC3CC3)CC2)no1	ZINC000853873764	CD	On-Demand	Anodyne	CACNA1I	72	39
COC(=O)N(C)CCNc1ccnc(N2CCOCC2)n1	ZINC000853873786	CC	On-Demand	Anodyne	PIK3CA	32	41
COC(=O)N(C)CCNc1ccnc(N2CCOCC2)n1	ZINC000853873786	CC	On-Demand	Anodyne	MTOR	28	41
COC(=O)N(C)CCNc1ccnc(N2CCOCC2)n1	ZINC000853873786	CC	On-Demand	Anodyne	PIK3CG	24	41
COC(=O)N(C)CCNc1ccnc(N2CCOCC2)n1	ZINC000853873786	CC	On-Demand	Anodyne	EPHB4	86	36
COC(=O)N(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000853873791	CD	On-Demand	Anodyne	ADORA1	71	45
COC(=O)N(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000853873791	CD	On-Demand	Anodyne	ADCY5	25	41
COC(=O)N(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000853873791	CD	On-Demand	Anodyne	ADORA3	87	38
COC(=O)N(C)CCNc1ncnc2c1ncn2C1CC1	ZINC000853873791	CD	On-Demand	Anodyne	OXGR1	88	33
COC(=O)N(C)CCNc1ccnc2c(Cl)cccc12	ZINC000853873820	CF	On-Demand	Anodyne	HRP1_PLAFA	57	34
COC(=O)N(C)CCNc1ccnc2c(Cl)cccc12	ZINC000853873820	CF	On-Demand	Anodyne	HNMT	51	36
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853873821	FF	On-Demand	Anodyne	CCR3	63	41
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853873821	FF	On-Demand	Anodyne	EPHX2	27	44
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccc(N2CCOC2=O)c1	ZINC000853873821	FF	On-Demand	Anodyne	CACNA1I	45	34
COC(=O)N(C)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000853873822	DE	On-Demand	Anodyne	HRP1_PLAFA	99	37
COC(=O)N(C)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000853873822	DE	On-Demand	Anodyne	KDR	56	39
COC(=O)N(C)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000853873822	DE	On-Demand	Anodyne	HNMT	42	32
COC(=O)N(C)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000853873822	DE	On-Demand	Anodyne	MET	40	37
COC(=O)N(C)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000853873822	DE	On-Demand	Anodyne	PDGFRA	55	41
COC(=O)N(C)CCNc1ccnc2cc(F)c(OC)cc12	ZINC000853873822	DE	On-Demand	Anodyne	CSF1R	33	44
COC(=O)N(C)CCNc1nccn(C(F)F)c1=O	ZINC000853873824	CC	On-Demand	Anodyne	CASP3	53	36
COC(=O)N(C)CCNc1ccc2ccc(Br)cc2n1	ZINC000853873827	EG	On-Demand	Anodyne	NCEH1	34	40
Cn1ccnc1C(=O)NCC1CCN(CC2CC2)CC1	ZINC000853873828	CD	On-Demand	Anodyne	HTR4	68	44
Cn1ccnc1C(=O)NCC1CCN(CC2CC2)CC1	ZINC000853873828	CD	On-Demand	Anodyne	CACNA1I	81	43
COC(=O)N(C)CCNc1ncnc2cc(F)c(Br)cc12	ZINC000853873883	FF	On-Demand	Anodyne	EGFR	68	37
COC(=O)N(C)CCNc1nc(N)c2ccccc2n1	ZINC000853873891	CD	On-Demand	Anodyne	TACR3	43	39
COC(=O)N(C)CCNc1ncnc2ccc(C(C)C)cc12	ZINC000853873895	DF	On-Demand	Anodyne	EGFR	46	37
COC(=O)N(C)CCNc1ncnc2ccc(C(C)C)cc12	ZINC000853873895	DF	On-Demand	Anodyne	CLK4	55	36
O=C(COC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853873902	JG	On-Demand	Anodyne	DGAT1	39	41
O=C(COC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853873903	JG	On-Demand	Anodyne	DGAT1	39	41
COC(=O)N(C)CCNc1cnc(-c2ccccc2)cn1	ZINC000853873915	CE	On-Demand	Anodyne	TPH1	31	45
O=C(NCC1CCN(CC2CC2)CC1)C(F)(F)C(=O)N1CCOCC1	ZINC000853873918	FC	On-Demand	Anodyne	CACNA1I	45	33
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	ADORA1	177	69
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	SLC29A1	138	59
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	ADORA2A	71	60
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	ADORA2B	21	57
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	ADK	70	52
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	AHCY	44	42
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	P2RX4	44	43
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	P2RX1	58	41
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	P2RY4	19	41
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	P2RY1	37	43
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	AMD1	43	46
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	GAPDH	38	44
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	P2RY2	21	43
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	ADORA3	153	60
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	OXGR1	130	44
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	RNASE1	43	34
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	DNMT3B	85	48
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	PANC	38	43
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	Q4VQ11_PIG	79	57
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	GPR17	60	44
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	HSPA5	52	37
COC(=O)N(C)CCNc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853873921	GA	On-Demand	Anodyne	DOT1L	116	47
O=C(NCC1CCN(CC2CC2)CC1)C(=O)C1CCSCC1	ZINC000853873926	DD	On-Demand	Anodyne	CACNA1I	48	34
O=C(NCC1CCN(CC2CC2)CC1)n1ccnc1	ZINC000853873936	CD	On-Demand	Anodyne	CACNA1I	53	35
COC(=O)N(C)CCNc1nn2c(C)nnc2c2ccccc12	ZINC000853873951	DD	On-Demand	Anodyne	CREBBP	42	33
COC(=O)N(C)CCNc1nn2c(C)nnc2c2ccccc12	ZINC000853873951	DD	On-Demand	Anodyne	BRD9	55	39
COC(=O)N(C)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000853873969	FD	On-Demand	Anodyne	HTR3A	32	47
COC(=O)N(C)CCNc1nc2ccccc2nc1N1CCN(C)CC1	ZINC000853873969	FD	On-Demand	Anodyne	HRH4	27	47
COC(=O)N(C)CCNc1ncnc2ccc(S(C)(=O)=O)cc12	ZINC000853873979	ED	On-Demand	Anodyne	CLK4	53	36
O=C(NCC1CCN(CC2CC2)CC1)Nc1ccc(Cl)nc1	ZINC000853873984	DF	On-Demand	Anodyne	HTR4	43	38
O=C(NCC1CCN(CC2CC2)CC1)Nc1ccc(Cl)nc1	ZINC000853873984	DF	On-Demand	Anodyne	CCR3	70	41
O=C(NCC1CCN(CC2CC2)CC1)Nc1ccc(Cl)nc1	ZINC000853873984	DF	On-Demand	Anodyne	EPHX2	23	43
O=C(NCC1CCN(CC2CC2)CC1)Nc1ccc(Cl)nc1	ZINC000853873984	DF	On-Demand	Anodyne	CACNA1I	71	41
COC(=O)N(C)CCNc1ncccc1OCc1ccccc1	ZINC000853873991	DF	On-Demand	Anodyne	PPIA	53	53
CC(C)(C)OC(=O)C(=O)NCC1CCN(CC2CC2)CC1	ZINC000853874012	CD	On-Demand	Anodyne	CACNA1I	66	40
Cc1nc(NC(=O)NCC2CCN(CC3CC3)CC2)sc1C	ZINC000853874017	DG	On-Demand	Anodyne	CACNA1I	50	33
COC(=O)N(C)CCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000853874027	GD	On-Demand	Anodyne	CA2	16	40
COC(=O)N(C)CCNc1c(F)cc(S(N)(=O)=O)cc1Br	ZINC000853874027	GD	On-Demand	Anodyne	CA4	19	40
COC(=O)N(C)CCNc1ncnc2cccc(OC)c12	ZINC000853874028	CD	On-Demand	Anodyne	EGFR	37	46
COC(=O)N(C)CCNc1ncnc2cccc(OC)c12	ZINC000853874028	CD	On-Demand	Anodyne	ERBB2	29	40
COC(=O)N(C)CCNc1ncnc2cc(F)c(OC)cc12	ZINC000853874042	DD	On-Demand	Anodyne	EGFR	72	47
COC(=O)N(C)CCNc1ncnc2cc(F)c(OC)cc12	ZINC000853874042	DD	On-Demand	Anodyne	ERBB2	30	42
COC(=O)N(C)CCNc1ncnc2cc(F)c(OC)cc12	ZINC000853874042	DD	On-Demand	Anodyne	FLT1	23	44
COC(=O)N(C)CCNc1ncnc2cc(F)c(OC)cc12	ZINC000853874042	DD	On-Demand	Anodyne	KDR	20	44
COC(=O)N(C)CCNc1ncnc2cc(F)c(OC)cc12	ZINC000853874042	DD	On-Demand	Anodyne	PDE6A	43	36
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	HTR1A	51	40
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	DRD2	47	48
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	HTR1B	19	40
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	DRD3	52	40
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	HTR4	52	39
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	HTR7	40	39
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	KCNQ2	76	40
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	CCR3	61	40
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	CSF1R	15	46
CN1CCN(c2ccccc2NC(=O)NCC2CCN(CC3CC3)CC2)CC1	ZINC000853874047	GF	On-Demand	Anodyne	CACNA1I	57	38
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	PDGFRB	34	40
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	HRP1_PLAFA	125	49
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	KDR	55	39
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	MTNR1A	32	45
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	MTNR1B	23	45
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	HNMT	63	38
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	PDGFRA	47	40
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	CSF1R	19	40
COC(=O)N(C)CCNc1ccnc2cc(OC)ccc12	ZINC000853874056	CE	On-Demand	Anodyne	BOTA	32	42
COC(=O)N(C)CCNc1ccc2ncc([N+](=O)[O-])n2n1	ZINC000853874072	CC	On-Demand	Bother	IKBKB	17	40
COC(=O)N(C)CCNc1nc2ccc(S(N)(=O)=O)cc2[nH]1	ZINC000853874087	EC	On-Demand	Anodyne	NCE103	43	33
COC(=O)N(C)CCNc1nc2ccccc2nc1N1CCOCC1	ZINC000853874088	ED	On-Demand	Anodyne	PIK3CA	44	41
COC(=O)N(C)CCNc1nc2ccccc2nc1N1CCOCC1	ZINC000853874088	ED	On-Demand	Anodyne	MTOR	53	39
COC(=O)N(C)CCNc1nc2ccccc2nc1N1CCOCC1	ZINC000853874088	ED	On-Demand	Anodyne	EPHB4	46	32
Cc1nsc(C(=O)NCC2CCN(CC3CC3)CC2)n1	ZINC000853874090	CD	On-Demand	Anodyne	HTR4	53	41
Cc1nsc(C(=O)NCC2CCN(CC3CC3)CC2)n1	ZINC000853874090	CD	On-Demand	Anodyne	CACNA1I	68	38
O=C(NCC1CCN(CC2CC2)CC1)c1nc(Br)cs1	ZINC000853874103	FF	On-Demand	Anodyne	HTR4	43	40
O=C(NCC1CCN(CC2CC2)CC1)c1nc(Br)cs1	ZINC000853874103	FF	On-Demand	Anodyne	CACNA1I	78	40
COC(=O)N(C)CCNc1c(C#N)cnc2c(Cl)cccc12	ZINC000853874105	DF	On-Demand	Mild	SRC	50	35
COC(=O)N(C)CCNc1c(C#N)cnc2c(Cl)cccc12	ZINC000853874105	DF	On-Demand	Mild	MAP3K8	104	38
O=C(NCC1CCN(CC2CC2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853874112	FG	On-Demand	Anodyne	CCR3	61	40
O=C(NCC1CCN(CC2CC2)CC1)Nc1ccc2oc(=O)ccc2c1	ZINC000853874112	FG	On-Demand	Anodyne	CACNA1I	58	36
C[C@@H]1CCN(C(=O)Nc2ccc(C#N)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874148	FE	On-Demand	Mild	EPHX2	40	35
CON(C)CCNC(=O)NC1CCC(C)(c2ccccc2)CC1	ZINC000853874194	DF	On-Demand	Anodyne	KCNA3	45	44
CON(C)CCNC(=O)NC1CCC(C)(c2ccccc2)CC1	ZINC000853874194	DF	On-Demand	Anodyne	EPHX2	19	45
Cc1cccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1	ZINC000853874195	EF	On-Demand	Anodyne	EPHX2	28	46
Cc1cccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1	ZINC000853874195	EF	On-Demand	Anodyne	LIMK2	15	41
Cc1cccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1	ZINC000853874195	EF	On-Demand	Anodyne	KCNK3	43	36
C[C@@H]1CCN(C(=O)Nc2ccccc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874199	FG	On-Demand	Anodyne	RBP4	60	41
C[C@@H]1CCN(C(=O)Nc2ccccc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874199	FG	On-Demand	Anodyne	SMO	31	46
C[C@@H]1CCN(C(=O)Nc2nccs2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874203	EE	On-Demand	Anodyne	MAP1	104	40
CC(=O)c1cccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1	ZINC000853874217	FF	On-Demand	Anodyne	EPHX2	27	43
CC(=O)c1cccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1	ZINC000853874217	FF	On-Demand	Anodyne	AKR1C3	17	42
CN1CCN(c2ccccc2NC(=O)N2C[C@@]34CCCC[C@]3(COC4)C2)CC1	ZINC000853874222	GF	On-Demand	Anodyne	KCNQ2	75	40
CN1CCN(c2ccccc2NC(=O)N2C[C@]34CCCC[C@]3(COC4)C2)CC1	ZINC000853874223	GF	On-Demand	Anodyne	KCNQ2	75	40
CN1CCN(c2ccccc2NC(=O)N2C[C@]34CCCC[C@@]3(COC4)C2)CC1	ZINC000853874224	GF	On-Demand	Anodyne	KCNQ2	75	40
C[C@@H]1CCN(C(=O)Nc2cc(F)cc(F)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874225	FF	On-Demand	Anodyne	CACNA1H	29	42
COc1ccccc1[C@@H]1C[C@H]1Nc1ccc([N+](=O)[O-])cc1C(C)=O	ZINC000853874282	EH	On-Demand	Bother	KCNMA1	23	49
COC(=O)N(C)CCNc1nccc2ccc(Br)cc12	ZINC000853874289	EG	On-Demand	Anodyne	NCEH1	40	40
COC(=O)N(C)CCNc1nccc(-c2ccc(OC)cc2)n1	ZINC000853874301	DE	On-Demand	Anodyne	CLK4	28	53
COC(=O)N(C)CCNc1nccc(-c2ccc(OC)cc2)n1	ZINC000853874301	DE	On-Demand	Anodyne	DYRK1B	15	55
COC(=O)N(C)CCNc1nccc(-c2ccc(OC)cc2)n1	ZINC000853874301	DE	On-Demand	Anodyne	SMG1	60	36
C[C@@H]1CCN(C(=O)Nc2cccnc2N2CCCC2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874304	GF	On-Demand	Anodyne	TRPV1	19	41
C[C@@H]1CCN(C(=O)Nc2cccnc2N2CCCC2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874304	GF	On-Demand	Anodyne	RBP4	40	37
C[C@@H]1CCN(C(=O)Nc2ccc(Cl)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874311	FG	On-Demand	Anodyne	EPHX2	57	43
Cc1cccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1C	ZINC000853874316	FG	On-Demand	Anodyne	RBP4	54	39
C[C@@H]1CCN(C(=O)Nc2ccccn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874336	EE	On-Demand	Anodyne	RBP4	48	35
C[C@@H]1CCN(C(=O)Nc2cccc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874350	GH	On-Demand	Anodyne	RBP4	61	40
C[C@@H]1CCN(C(=O)Nc2cccc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874350	GH	On-Demand	Anodyne	CCR8	56	34
C[C@@H]1CCN(C(=O)Nc2ccc3c(c2)OCO3)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874352	FE	On-Demand	Anodyne	TRPC3	39	41
C[C@@H]1CCN(C(=O)Nc2ccc(Cl)cc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874361	GH	On-Demand	Anodyne	EPHX2	18	44
C[C@@H]1CCN(C(=O)Nc2ccc(Cl)cc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874361	GH	On-Demand	Anodyne	RBP4	44	41
c1ccc(-c2nc3sccn3c2CNCC2CCN(CC3CC3)CC2)cc1	ZINC000853874365	GI	On-Demand	Anodyne	HTR4	15	41
COc1ccccc1[C@@H]1C[C@H]1Nc1ncnc2sc(C)cc12	ZINC000853874368	DH	On-Demand	Anodyne	EGFR	19	51
C[C@@H]1CCN(C(=O)Nc2cccc(C#N)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874370	FE	On-Demand	Mild	MCHR1	34	40
COC(=O)N(C)CCNc1nccc(N2CCCC(C)(C)C2)n1	ZINC000853874379	DE	On-Demand	Anodyne	MRGPRX1	42	39
C[C@@H]1CCN(C(=O)Nc2cc(Cl)ccc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874394	GH	On-Demand	Anodyne	RBP4	44	43
C[C@@H]1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874398	GH	On-Demand	Anodyne	TRPV1	29	55
C[C@@H]1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874398	GH	On-Demand	Anodyne	EPHX2	60	49
C[C@@H]1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874398	GH	On-Demand	Anodyne	TRPM8	66	41
O=C(NCC1CCN(CC2CC2)CC1)N1CCCCC1	ZINC000853874413	CE	On-Demand	Anodyne	HTR4	19	41
O=C(NCC1CCN(CC2CC2)CC1)N1CCCCC1	ZINC000853874413	CE	On-Demand	Anodyne	CACNA1I	58	37
C[C@@H]1CCN(C(=O)Nc2cccc(Cl)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874422	FG	On-Demand	Anodyne	EPHX2	31	47
C[C@@H]1CCN(C(=O)Nc2ccc(F)c(F)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874423	FF	On-Demand	Anodyne	CACNA1H	29	41
COC(=O)N(C)CCNc1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000853874433	CC	On-Demand	Bother	COLA	46	32
COCC1(NC(=O)Nc2cccnc2Cl)CCCCC1	ZINC000853874530	CG	On-Demand	Anodyne	G2YM83_BOTF4	73	38
O=C(NNC(=O)c1cccc(F)n1)Nc1ccc(N2CCOCC2)cn1	ZINC000853874592	FC	On-Demand	Reactive	STAT6	63	38
Cc1ccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c(C)c1	ZINC000853874606	FG	On-Demand	Anodyne	EPHX2	15	40
Cc1ccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c(C)c1	ZINC000853874606	FG	On-Demand	Anodyne	RBP4	53	34
COc1ccccc1[C@@H]1C[C@H]1Nc1cc([N+](=O)[O-])ccc1C(C)=O	ZINC000853874701	EH	On-Demand	Bother	KCNMA1	22	46
C[C@@H]1CCN(C(=O)Nc2cccc(Cl)c2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874730	GH	On-Demand	Anodyne	RBP4	53	38
Cc1ccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)cc1	ZINC000853874736	EF	On-Demand	Anodyne	EPHX2	52	38
C[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874741	FF	On-Demand	Anodyne	RBP4	54	37
C[C@@H]1CCN(C(=O)Nc2cccnc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874741	FF	On-Demand	Anodyne	G2YM83_BOTF4	68	39
CN(C[C@@H]1CC1(C)C)C(=O)Nc1cccnc1Cl	ZINC000853874746	CG	On-Demand	Anodyne	G2YM83_BOTF4	82	44
C[C@@H]1CCN(C(=O)Nc2ccc(Cl)nc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874773	FF	On-Demand	Anodyne	EPHX2	36	42
O=C(NNC(=O)c1cccc(F)n1)Nc1nc2c(s1)CCCC2	ZINC000853874793	EE	On-Demand	Reactive	SLC27A1	39	43
C[C@@H]1CCN(C(=O)Nc2ccccc2C(F)(F)F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874822	GH	On-Demand	Anodyne	RBP4	103	51
C[C@@H]1CCN(C(=O)Nc2ccccc2C(F)(F)F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874822	GH	On-Demand	Anodyne	SFRP1	85	32
C[C@@H]1CCN(C(=O)Nc2ccccc2C(F)(F)F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874822	GH	On-Demand	Anodyne	WNT3	61	32
COC(=O)c1cccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c1	ZINC000853874829	GE	On-Demand	Anodyne	RBP4	20	43
COCCN(CCF)C(=O)NC1CCC(C)(c2ccccc2)CC1	ZINC000853874856	EH	On-Demand	Anodyne	KCNA3	40	39
CC(=O)c1ccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)cc1	ZINC000853874859	FF	On-Demand	Anodyne	EPHX2	51	37
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](c1ccncc1)C1(CO)CCC1	ZINC000853874867	GJ	On-Demand	Anodyne	ROCK1	18	40
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@H](c1ccncc1)C1(CO)CCC1	ZINC000853874867	GJ	On-Demand	Anodyne	ROCK2	26	57
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](c1ccncc1)C1(CO)CCC1	ZINC000853874870	GJ	On-Demand	Anodyne	ROCK1	18	40
O=C(Nc1ccc(-c2ccccc2)cc1)N[C@@H](c1ccncc1)C1(CO)CCC1	ZINC000853874870	GJ	On-Demand	Anodyne	ROCK2	26	57
C[C@@H]1CCN(C(=O)C(F)(F)c2ccccc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874876	GF	On-Demand	Anodyne	RBP4	41	33
Cc1nc(NC(=O)N2C[C@@]34CCCC[C@]3(COC4)C2)sc1-c1ccccc1	ZINC000853874882	GJ	On-Demand	Anodyne	PIK3CG	20	44
Cc1nc(NC(=O)N2C[C@@]34CCCC[C@]3(COC4)C2)sc1-c1ccccc1	ZINC000853874882	GJ	On-Demand	Anodyne	PI4KB	42	45
Cc1nc(NC(=O)N2C[C@]34CCCC[C@]3(COC4)C2)sc1-c1ccccc1	ZINC000853874884	GJ	On-Demand	Anodyne	PIK3CG	20	44
Cc1nc(NC(=O)N2C[C@]34CCCC[C@]3(COC4)C2)sc1-c1ccccc1	ZINC000853874884	GJ	On-Demand	Anodyne	PI4KB	42	45
Cc1nc(NC(=O)N2C[C@]34CCCC[C@@]3(COC4)C2)sc1-c1ccccc1	ZINC000853874887	GJ	On-Demand	Anodyne	PIK3CG	20	44
Cc1nc(NC(=O)N2C[C@]34CCCC[C@@]3(COC4)C2)sc1-c1ccccc1	ZINC000853874887	GJ	On-Demand	Anodyne	PI4KB	42	45
Cc1cc(C(=O)NCC2CCN(CC3CC3)CC2)n2nc(C)cc2n1	ZINC000853874937	EE	On-Demand	Anodyne	HTR4	53	41
Cc1cc(C(=O)NCC2CCN(CC3CC3)CC2)n2nc(C)cc2n1	ZINC000853874937	EE	On-Demand	Anodyne	CACNA1I	66	39
C[C@@H]1CCN(C(=O)Nc2cccnc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853874940	EE	On-Demand	Anodyne	CHRNA7	44	37
COc1ccccc1NC(=O)N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853874946	FF	On-Demand	Anodyne	RBP4	61	40
COc1ccccc1NC(=O)N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853874946	FF	On-Demand	Anodyne	SMO	17	42
Nc1nc(Cl)cc(N2CCC([C@H]3CCCCO3)CC2)n1	ZINC000853874966	CE	On-Demand	Anodyne	HRH4	44	40
Nc1nc(Cl)cc(N2CCC([C@@H]3CCCCO3)CC2)n1	ZINC000853874968	CE	On-Demand	Anodyne	HRH4	44	40
O=C(NNC(=O)c1cccc(F)n1)Nc1cccnc1N1CCCC1	ZINC000853874980	ED	On-Demand	Reactive	KCNQ2	44	32
O=C(NNC(=O)c1cccc(F)n1)Nc1ccc(N2CCCC2)nc1	ZINC000853875017	ED	On-Demand	Reactive	DGAT1	46	44
COc1ncccc1NC(=O)N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853875074	FE	On-Demand	Anodyne	RBP4	44	38
Cc1nsc(C(=O)N[C@@H](c2ccccc2)[C@H](C)O)n1	ZINC000853875082	CD	On-Demand	Anodyne	TACR3	34	41
Cc1nsc(C(=O)N[C@H](c2ccccc2)[C@@H](C)O)n1	ZINC000853875084	CD	On-Demand	Anodyne	TACR3	34	41
Cc1nsc(C(=O)N[C@H](c2ccccc2)[C@H](C)O)n1	ZINC000853875086	CD	On-Demand	Anodyne	TACR3	34	41
Cc1nsc(C(=O)N[C@@H](c2ccccc2)[C@@H](C)O)n1	ZINC000853875088	CD	On-Demand	Anodyne	TACR3	34	41
c1cncc(-c2nc(N3CCC([C@@H]4CCCCO4)CC3)c3ccccc3n2)c1	ZINC000853875091	FI	On-Demand	Anodyne	PIK3CA	20	44
c1cncc(-c2nc(N3CCC([C@@H]4CCCCO4)CC3)c3ccccc3n2)c1	ZINC000853875091	FI	On-Demand	Anodyne	PRKD1	26	43
c1cncc(-c2nc(N3CCC([C@@H]4CCCCO4)CC3)c3ccccc3n2)c1	ZINC000853875091	FI	On-Demand	Anodyne	MTOR	24	44
c1cncc(-c2nc(N3CCC([C@H]4CCCCO4)CC3)c3ccccc3n2)c1	ZINC000853875094	FI	On-Demand	Anodyne	PIK3CA	20	44
c1cncc(-c2nc(N3CCC([C@H]4CCCCO4)CC3)c3ccccc3n2)c1	ZINC000853875094	FI	On-Demand	Anodyne	PRKD1	26	43
c1cncc(-c2nc(N3CCC([C@H]4CCCCO4)CC3)c3ccccc3n2)c1	ZINC000853875094	FI	On-Demand	Anodyne	MTOR	24	44
Cc1nc(N2CCC([C@@H]3CCCCO3)CC2)c2cnn(-c3ccccc3)c2n1	ZINC000853875115	GH	On-Demand	Anodyne	MTOR	19	47
Cc1nc(N2CCC([C@H]3CCCCO3)CC2)c2cnn(-c3ccccc3)c2n1	ZINC000853875117	GH	On-Demand	Anodyne	MTOR	19	47
COc1ccccc1[C@@H]1C[C@H]1Nc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1	ZINC000853875122	FG	On-Demand	Bother	KCNMA1	22	48
C[C@@H]1CCN(C(=O)Nc2ccc(F)cc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875124	FF	On-Demand	Anodyne	RBP4	43	38
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CN(C(=O)OC)C2)cc1	ZINC000853875165	GC	On-Demand	Anodyne	ADRB2	36	53
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CN(C(=O)OC)C2)cc1	ZINC000853875165	GC	On-Demand	Anodyne	ADRB1	73	53
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CN(C(=O)OC)C2)cc1	ZINC000853875165	GC	On-Demand	Anodyne	ADRB3	48	42
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CN(C(=O)OC)C2)cc1	ZINC000853875166	GC	On-Demand	Anodyne	ADRB2	36	53
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CN(C(=O)OC)C2)cc1	ZINC000853875166	GC	On-Demand	Anodyne	ADRB1	73	53
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CN(C(=O)OC)C2)cc1	ZINC000853875166	GC	On-Demand	Anodyne	ADRB3	48	42
CN1CCN(c2ccccc2NC(=O)NNC(=O)c2cccc(F)n2)CC1	ZINC000853875182	FD	On-Demand	Reactive	KCNQ2	75	39
COc1ccccc1[C@@H]1C[C@H]1Nc1nccc(N2CCCC2)n1	ZINC000853875201	DG	On-Demand	Anodyne	EBP	16	43
COc1ccccc1[C@@H]1C[C@H]1Nc1nccc(N2CCCC2)n1	ZINC000853875201	DG	On-Demand	Anodyne	GALR2	44	35
COC(=O)N(C)CCNc1ccnc2cc([N+](=O)[O-])ccc12	ZINC000853875237	DE	On-Demand	Bother	HRP1_PLAFA	111	45
COC(=O)N(C)CCNc1ccnc2cc([N+](=O)[O-])ccc12	ZINC000853875237	DE	On-Demand	Bother	HNMT	44	34
CC(C)c1ccccc1NC(=O)N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853875256	FH	On-Demand	Anodyne	RBP4	65	40
COc1ccccc1[C@@H]1C[C@H]1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853875258	EG	On-Demand	Bother	KCNMA1	20	44
C[C@@H]1CCN(C(=O)Nc2ccc(F)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875284	EF	On-Demand	Anodyne	EPHX2	56	38
C[C@@H]1CCN(C(=O)Nc2ccc(F)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875284	EF	On-Demand	Anodyne	TRPM8	43	36
Cc1ccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)cc1Cl	ZINC000853875292	GH	On-Demand	Anodyne	NPY2R	40	35
Cc1ccc(NC(=O)N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)cc1Cl	ZINC000853875292	GH	On-Demand	Anodyne	EPHX2	41	45
C[C@@H]1CCN(C(=O)Nc2cc(F)ccc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875294	FF	On-Demand	Anodyne	RBP4	43	36
CN1CCN(c2ccccc2NC(=O)N2CC3CC2(c2ccccc2)C3)CC1	ZINC000853875333	GH	On-Demand	Anodyne	KCNQ2	71	39
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccnc1Cl	ZINC000853875350	DF	On-Demand	Anodyne	HRH1	17	45
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccnc1Cl	ZINC000853875350	DF	On-Demand	Anodyne	HTR4	44	38
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccnc1Cl	ZINC000853875350	DF	On-Demand	Anodyne	CCR3	60	45
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccnc1Cl	ZINC000853875350	DF	On-Demand	Anodyne	CACNA1I	67	38
O=C(NCC1CCN(CC2CC2)CC1)Nc1cccnc1Cl	ZINC000853875350	DF	On-Demand	Anodyne	G2YM83_BOTF4	66	35
CC(=O)c1ccc(N2CCC([C@H]3CCCCO3)CC2)c([N+](=O)[O-])c1	ZINC000853875353	EH	On-Demand	Bother	TAAR1	16	47
CC(=O)c1ccc(N2CCC([C@@H]3CCCCO3)CC2)c([N+](=O)[O-])c1	ZINC000853875355	EH	On-Demand	Bother	TAAR1	16	47
C[C@@H]1CCN(C(=O)Nc2ccc(N3CCCC3)nc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875437	GF	On-Demand	Anodyne	DGAT1	45	45
CCn1c(=O)c(NCCN(C)C(=O)OC)nc2ccccc21	ZINC000853875438	DD	On-Demand	Anodyne	PYGM	22	46
C[C@@H]1CCN(C(=O)Nc2cccc3cccnc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875443	GG	On-Demand	Anodyne	RBP4	56	38
C[C@@H]1CCN(C(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875449	GG	On-Demand	Anodyne	NPY2R	40	37
C[C@@H]1CCN(C(=O)Nc2ccc(F)c(Cl)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875449	GG	On-Demand	Anodyne	EPHX2	43	38
C[C@@H]1CCN(C(=O)Nc2ccccc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853875460	EF	On-Demand	Anodyne	RBP4	61	42
COC(=O)N(C)CCNc1nccc2cc(Br)ccc12	ZINC000853875473	EG	On-Demand	Anodyne	NCEH1	42	44
C[C@H]1CN(c2ccc(NC(=O)N[C@H]3CCNC3=O)cc2F)C[C@H](C)O1	ZINC000853875489	FD	On-Demand	Anodyne	NPY2R	51	35
CN1CCN(c2ccccc2NC(=O)N(C)C[C@@H]2CC2(C)C)CC1	ZINC000853875511	EF	On-Demand	Anodyne	KCNQ2	77	40
CN1CCN(c2ccccc2NC(=O)N(C)C[C@H]2CC2(C)C)CC1	ZINC000853875512	EF	On-Demand	Anodyne	KCNQ2	77	40
CON(C)CCNC(=O)NCc1cccc2c1OCCCO2	ZINC000853875515	DD	On-Demand	Anodyne	MTNR1A	15	48
CCn1cc(NC(=O)N2CCC(NC(=O)OC)CC2)ccc1=O	ZINC000853875770	DD	On-Demand	Anodyne	EPHX2	44	43
Cc1cncc(CCNc2nccc(N3CCCC3)n2)n1	ZINC000853875774	CD	On-Demand	Anodyne	MRGPRX1	44	40
CN(C)CCC[C@H]1CN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CCO1	ZINC000853875808	GE	On-Demand	Bother	CACNA1D	40	32
CN(C)CCC[C@@H]1CN(C(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CCO1	ZINC000853875809	GE	On-Demand	Bother	CACNA1D	40	32
CN(C)CCC[C@@H]1CN(C(=O)Nc2cccnc2Cl)CCO1	ZINC000853875864	EE	On-Demand	Anodyne	G2YM83_BOTF4	65	33
O=[N+]([O-])c1ccc(N2CCC([C@@H]3CCCCO3)CC2)c2nonc12	ZINC000853875866	EF	On-Demand	Bother	GSTM2	104	44
O=[N+]([O-])c1ccc(N2CCC([C@@H]3CCCCO3)CC2)c2nonc12	ZINC000853875866	EF	On-Demand	Bother	GSTP1	60	43
O=[N+]([O-])c1ccc(N2CCC([C@H]3CCCCO3)CC2)c2nonc12	ZINC000853875867	EF	On-Demand	Bother	GSTM2	104	44
O=[N+]([O-])c1ccc(N2CCC([C@H]3CCCCO3)CC2)c2nonc12	ZINC000853875867	EF	On-Demand	Bother	GSTP1	60	43
COCC1(NC(=O)Nc2ccccc2N2CCN(C)CC2)CCCCC1	ZINC000853875943	FF	On-Demand	Anodyne	KCNQ2	82	46
COCCOc1ccc(NC(=O)N2CCC(NC(=O)OC)CC2)cn1	ZINC000853875987	FD	On-Demand	Anodyne	PDGFRB	43	40
COCCOc1ccc(NC(=O)N2CCC(NC(=O)OC)CC2)cn1	ZINC000853875987	FD	On-Demand	Anodyne	EPHX2	33	40
COC(=O)c1cccc(NNC(=O)NCCn2cc([N+](=O)[O-])cn2)c1C	ZINC000853876018	FD	On-Demand	Reactive	CACNA1C	41	33
COC(=O)c1cccc(NNC(=O)NCCn2cc([N+](=O)[O-])cn2)c1C	ZINC000853876018	FD	On-Demand	Reactive	CACNA1D	60	33
CN(C)CCC[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)CCO1	ZINC000853876103	GE	On-Demand	Anodyne	KCNQ2	66	34
CC(C)(C)OC(=O)Cn1ccc(NC(=O)Nc2cccnc2Cl)n1	ZINC000853876158	FF	On-Demand	Anodyne	P2RY1	46	36
CC(C)(C)OC(=O)Cn1ccc(NC(=O)Nc2cccnc2Cl)n1	ZINC000853876158	FF	On-Demand	Anodyne	G2YM83_BOTF4	56	33
CCCOc1cccc(CCNC(=O)NCCN(C)OC)c1	ZINC000853876221	DD	On-Demand	Anodyne	HRH2	28	48
CCCOc1cccc(CCNC(=O)NCCN(C)OC)c1	ZINC000853876221	DD	On-Demand	Anodyne	MTNR1A	68	46
CCCOc1cccc(CCNC(=O)NCCN(C)OC)c1	ZINC000853876221	DD	On-Demand	Anodyne	MTNR1B	54	45
CCCOc1cccc(CCNC(=O)NCCN(C)OC)c1	ZINC000853876221	DD	On-Demand	Anodyne	CRTM	55	34
CCCOc1cccc(CCNC(=O)NCCN(C)OC)c1	ZINC000853876221	DD	On-Demand	Anodyne	PDS	56	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc2cccnc12	ZINC000853876229	GH	On-Demand	Anodyne	GPR119	40	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc2cccnc12	ZINC000853876229	GH	On-Demand	Anodyne	WNT3	19	46
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(F)(F)c1ccccc1F	ZINC000853876235	EG	On-Demand	Anodyne	SLC6A1	45	38
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(F)(F)c1ccccc1F	ZINC000853876235	EG	On-Demand	Anodyne	CHRM4	16	48
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(F)(F)c1ccccc1F	ZINC000853876235	EG	On-Demand	Anodyne	CCR3	44	39
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(F)cc1F	ZINC000853876239	FH	On-Demand	Anodyne	GPR119	44	43
CCCOc1cccc(CCNC(=O)NCCc2nnc(S)n2C2CC2)c1	ZINC000853876241	GF	On-Demand	Anodyne	HRH2	28	46
O=C(NCc1ccn(C2CCCC2)n1)NNc1nc2ccc(Cl)cc2s1	ZINC000853876245	GI	On-Demand	Reactive	CSNK1D	27	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000853876250	GG	On-Demand	Bother	GPR119	27	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1F	ZINC000853876255	EG	On-Demand	Anodyne	GPR119	44	43
CCCOc1cccc(CCNC(=O)NCCc2nnc(S)n2CC)c1	ZINC000853876264	GE	On-Demand	Anodyne	HRH2	27	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Cl)nc1	ZINC000853876272	FG	On-Demand	Anodyne	GPR119	51	43
O=C(NC[C@H]1CCCN(CC2CC2)C1)Nc1ccc(N2CCOCC2)cn1	ZINC000853876290	FE	On-Demand	Anodyne	CCR3	56	35
O=C(NC[C@H]1CCCN(CC2CC2)C1)Nc1ccc(N2CCOCC2)cn1	ZINC000853876290	FE	On-Demand	Anodyne	STAT6	51	31
O=C(NCCc1cc2ccccc2[nH]1)NCCc1nnc(S)n1C1CC1	ZINC000853876295	FE	On-Demand	Anodyne	PLD1	45	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Cl)cn1	ZINC000853876312	FG	On-Demand	Anodyne	F10	32	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(Cl)cn1	ZINC000853876312	FG	On-Demand	Anodyne	GPR119	48	43
Cn1ncnc1C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853876316	DD	On-Demand	Anodyne	GPR119	37	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnns1	ZINC000853876319	DD	On-Demand	Anodyne	GPR119	21	40
Cc1nc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)sc1-c1ccccc1	ZINC000853876359	FH	On-Demand	Anodyne	PIK3CG	17	44
Cc1nc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)sc1-c1ccccc1	ZINC000853876360	FH	On-Demand	Anodyne	PIK3CG	17	44
CC(=O)Nc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876391	GG	On-Demand	Anodyne	GPR119	36	42
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876422	EH	On-Demand	Anodyne	CCKAR	26	41
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876422	EH	On-Demand	Anodyne	CCKBR	36	41
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876422	EH	On-Demand	Anodyne	EPHX2	15	41
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876422	EH	On-Demand	Anodyne	GPR119	37	51
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876422	EH	On-Demand	Anodyne	LIMK2	17	42
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876422	EH	On-Demand	Anodyne	KCNK3	53	36
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853876422	EH	On-Demand	Anodyne	KCNK9	41	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1nccs1	ZINC000853876466	EF	On-Demand	Anodyne	MAP1	99	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1nccs1	ZINC000853876466	EF	On-Demand	Anodyne	GPR119	31	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccn1	ZINC000853876467	EF	On-Demand	Anodyne	GPR119	54	48
CC(=O)c1ccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1	ZINC000853876470	FH	On-Demand	Anodyne	GPR119	33	52
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1(C#N)CCCCC1	ZINC000853876472	DH	On-Demand	Mild	NMBR	47	31
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(F)cc1	ZINC000853876490	EG	On-Demand	Anodyne	GPR119	43	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)N=c1cc[nH]cc1	ZINC000853876492	EE	On-Demand	Anodyne	GPR119	30	40
CC(C)(C)OC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853876502	CD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853876504	CD	On-Demand	Anodyne	CACNA1I	42	32
Cn1ccnc1C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853876550	CD	On-Demand	Anodyne	CCR3	64	36
Cn1ccnc1C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853876550	CD	On-Demand	Anodyne	CACNA1I	53	33
Cn1ccnc1C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853876551	CD	On-Demand	Anodyne	CCR3	64	36
Cn1ccnc1C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853876551	CD	On-Demand	Anodyne	CACNA1I	53	33
CCCOc1cccc(CCNC(=O)NCCc2nnc(S)n2C(C)C)c1	ZINC000853876558	GG	On-Demand	Anodyne	HRH2	26	46
CCCOc1cccc(CCNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853876575	FG	On-Demand	Anodyne	HRH2	34	43
CCCOc1cccc(CCNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853876577	FG	On-Demand	Anodyne	HRH2	34	43
CCCOc1cccc(CCNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853876579	FG	On-Demand	Anodyne	HRH2	34	43
CCCOc1cccc(CCNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853876580	FG	On-Demand	Anodyne	HRH2	34	43
O=C(NC[C@H]1CCCN(CC2CC2)C1)Nc1ccc(Cl)nc1	ZINC000853876586	DF	On-Demand	Anodyne	CHRM4	15	41
O=C(NC[C@H]1CCCN(CC2CC2)C1)Nc1ccc(Cl)nc1	ZINC000853876586	DF	On-Demand	Anodyne	CCR3	94	42
COc1ncccc1NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853876592	FF	On-Demand	Anodyne	GPR119	54	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000853876603	GG	On-Demand	Bother	GPR119	37	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(C#N)c[nH]1	ZINC000853876666	EE	On-Demand	Mild	GPR119	20	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccnc1Cl	ZINC000853876703	FG	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccnc1Cl	ZINC000853876703	FG	On-Demand	Anodyne	G2YM83_BOTF4	62	37
O=C(NC[C@H]1CCCN(CC2CC2)C1)Nc1ccc2oc(=O)ccc2c1	ZINC000853876705	FG	On-Demand	Anodyne	CCR3	66	41
O=C(NCCOCCF)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853876707	DD	On-Demand	Bother	CACNA1C	27	42
O=C(NCCOCCF)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853876707	DD	On-Demand	Bother	CACNA1D	42	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000853876717	GG	On-Demand	Bother	GPR119	34	41
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	CA2	66	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	CA1	62	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	CCR3	58	42
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	CA4	52	45
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	CA12	48	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	CA9	50	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	NCE103	23	43
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	MTCA1	51	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	P96878_MYCTU	64	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876718	FD	On-Demand	Anodyne	NAMPT	43	43
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	CA2	66	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	CA1	62	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	CCR3	58	42
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	CA4	52	45
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	CA12	48	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	CA9	50	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	NCE103	23	43
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	MTCA1	51	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	P96878_MYCTU	64	48
NS(=O)(=O)c1ccc(NC(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853876719	FD	On-Demand	Anodyne	NAMPT	43	43
O=C(NC[C@H]1CCCN(CC2CC2)C1)Nc1ccccc1CN1C(=O)CNC1=O	ZINC000853876750	GD	On-Demand	Anodyne	CCR3	46	40
O=C(NCCOCCF)Nc1ccc(Cl)nc1	ZINC000853876768	CD	On-Demand	Anodyne	ADRB1	46	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc2c(c1)OCO2	ZINC000853876794	GG	On-Demand	Anodyne	GPR119	27	42
O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@H]3CCCCO3)C2)c2nonc12	ZINC000853876827	EF	On-Demand	Bother	GSTM2	90	41
O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@H]3CCCCO3)C2)c2nonc12	ZINC000853876827	EF	On-Demand	Bother	GSTP1	48	41
O=[N+]([O-])c1ccc(N2CCC[C@H]([C@@H]3CCCCO3)C2)c2nonc12	ZINC000853876828	EF	On-Demand	Bother	GSTM2	90	41
O=[N+]([O-])c1ccc(N2CCC[C@H]([C@@H]3CCCCO3)C2)c2nonc12	ZINC000853876828	EF	On-Demand	Bother	GSTP1	48	41
O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@@H]3CCCCO3)C2)c2nonc12	ZINC000853876829	EF	On-Demand	Bother	GSTM2	90	41
O=[N+]([O-])c1ccc(N2CCC[C@@H]([C@@H]3CCCCO3)C2)c2nonc12	ZINC000853876829	EF	On-Demand	Bother	GSTP1	48	41
O=[N+]([O-])c1ccc(N2CCC[C@H]([C@H]3CCCCO3)C2)c2nonc12	ZINC000853876830	EF	On-Demand	Bother	GSTM2	90	41
O=[N+]([O-])c1ccc(N2CCC[C@H]([C@H]3CCCCO3)C2)c2nonc12	ZINC000853876830	EF	On-Demand	Bother	GSTP1	48	41
Cc1cc(N2CCC[C@@H]([C@H]3CCCCO3)C2)nc(N)n1	ZINC000853876867	CE	On-Demand	Anodyne	HRH4	48	40
Cc1cc(N2CCC[C@@H]([C@@H]3CCCCO3)C2)nc(N)n1	ZINC000853876868	CE	On-Demand	Anodyne	HRH4	48	40
Cc1cc(N2CCC[C@H]([C@H]3CCCCO3)C2)nc(N)n1	ZINC000853876869	CE	On-Demand	Anodyne	HRH4	48	40
Cc1cc(N2CCC[C@H]([C@@H]3CCCCO3)C2)nc(N)n1	ZINC000853876870	CE	On-Demand	Anodyne	HRH4	48	40
CN(C)CCC[C@H]1CN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000853876875	GE	On-Demand	Bother	SLC27A4	48	30
CN(C)CCC[C@@H]1CN(C(=O)C(F)(F)Oc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000853876876	GE	On-Demand	Bother	SLC27A4	48	30
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2cccnc2s1	ZINC000853876912	FF	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccs1	ZINC000853876979	DE	On-Demand	Anodyne	GPR119	30	41
N#CC1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853877012	DG	On-Demand	Mild	GSTM2	110	44
N#CC1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853877012	DG	On-Demand	Mild	GSTP1	68	44
O=C(NC[C@H]1CCCN(CC2CC2)C1)Nc1cccc(N2CCOC2=O)c1	ZINC000853877021	FF	On-Demand	Anodyne	CCR3	60	42
CN1CCN(c2ccccc2NC(=O)NCCOCCF)CC1	ZINC000853877041	DD	On-Demand	Anodyne	DRD2	35	43
CN1CCN(c2ccccc2NC(=O)NCCOCCF)CC1	ZINC000853877041	DD	On-Demand	Anodyne	DRD3	53	43
CN1CCN(c2ccccc2NC(=O)NCCOCCF)CC1	ZINC000853877041	DD	On-Demand	Anodyne	KCNQ2	79	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccc(C#N)c1	ZINC000853877049	FG	On-Demand	Mild	GPR119	31	44
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877050	GF	On-Demand	Anodyne	DRD2	24	42
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877050	GF	On-Demand	Anodyne	SLC6A1	61	32
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877050	GF	On-Demand	Anodyne	CHRM4	16	44
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877050	GF	On-Demand	Anodyne	KCNQ2	76	40
CN1CCN(c2ccccc2NC(=O)NC[C@@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877050	GF	On-Demand	Anodyne	CCR3	63	42
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877051	GF	On-Demand	Anodyne	DRD2	24	42
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877051	GF	On-Demand	Anodyne	SLC6A1	61	32
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877051	GF	On-Demand	Anodyne	CHRM4	16	44
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877051	GF	On-Demand	Anodyne	KCNQ2	76	40
CN1CCN(c2ccccc2NC(=O)NC[C@H]2CCCN(CC3CC3)C2)CC1	ZINC000853877051	GF	On-Demand	Anodyne	CCR3	63	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccnc1	ZINC000853877055	EF	On-Demand	Anodyne	GPR119	47	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cccnc1	ZINC000853877055	EF	On-Demand	Anodyne	NAMPT	17	47
CCCOc1cccc(CCNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853877064	FD	On-Demand	Anodyne	HRH2	28	48
COc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853877069	FG	On-Demand	Anodyne	MTNR1A	20	45
COc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853877069	FG	On-Demand	Anodyne	MTNR1B	28	45
COc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853877069	FG	On-Demand	Anodyne	EPHX2	16	42
COc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853877069	FG	On-Demand	Anodyne	TAAR1	38	40
COc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853877069	FG	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc2c(c1)OCCO2	ZINC000853877070	GG	On-Demand	Anodyne	GPR119	26	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(C#N)cc1	ZINC000853877095	FG	On-Demand	Mild	CTRB_BOVIN	43	30
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(C#N)cc1	ZINC000853877095	FG	On-Demand	Mild	GPR119	32	42
COc1ccccc1[C@@H]1C[C@H]1Nc1ccc([N+](=O)[O-])c2nonc12	ZINC000853877121	EG	On-Demand	Bother	GSTM2	110	41
COc1ccccc1[C@@H]1C[C@H]1Nc1ccc([N+](=O)[O-])c2nonc12	ZINC000853877121	EG	On-Demand	Bother	GSTP1	70	41
COC(=O)c1sc(N2CCC([C@H]3CCCCO3)CC2)nc1Cl	ZINC000853877166	EG	On-Demand	Anodyne	PARE	64	34
COC(=O)c1sc(N2CCC([C@@H]3CCCCO3)CC2)nc1Cl	ZINC000853877167	EG	On-Demand	Anodyne	PARE	64	34
C#CCNC(=O)c1ccc(N2CCC([C@@H]3CCCCO3)CC2)nc1	ZINC000853877168	EE	On-Demand	Mild	HPGDS	17	45
C#CCNC(=O)c1ccc(N2CCC([C@H]3CCCCO3)CC2)nc1	ZINC000853877169	EE	On-Demand	Mild	HPGDS	17	45
C#CCNC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853877180	JD	On-Demand	Mild	TGM2	48	37
C#CCNC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853877180	JD	On-Demand	Mild	F13A1	64	37
C#CCNC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853877181	JD	On-Demand	Mild	TGM2	48	37
C#CCNC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1	ZINC000853877181	JD	On-Demand	Mild	F13A1	64	37
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853877215	GI	On-Demand	Anodyne	SCD1	35	46
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853877215	GI	On-Demand	Anodyne	SCD	30	46
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853877216	GI	On-Demand	Anodyne	SCD1	35	46
O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853877216	GI	On-Demand	Anodyne	SCD	30	46
COC[C@H](NC(=O)NC1CN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853877217	ED	On-Demand	Anodyne	MTNR1A	27	40
COC[C@H](NC(=O)NC1CN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853877217	ED	On-Demand	Anodyne	MTNR1B	30	40
COC[C@@H](NC(=O)NC1CN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853877218	ED	On-Demand	Anodyne	MTNR1A	27	40
COC[C@@H](NC(=O)NC1CN(C(=O)OC)C1)c1cccc(OC)c1	ZINC000853877218	ED	On-Demand	Anodyne	MTNR1B	30	40
O=C(Nc1ccc(N2CCOCC2)cn1)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853877248	ED	On-Demand	Anodyne	STAT6	51	31
O=C(Nc1ccc(N2CCOCC2)cn1)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853877249	ED	On-Demand	Anodyne	STAT6	51	31
COC(=O)c1ccc(CNC(=O)NC2CN(C(=O)OC)C2)c(F)c1	ZINC000853877296	EC	On-Demand	Anodyne	BDKRB1	28	42
Cn1ccnc1C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853877345	DD	On-Demand	Anodyne	GPR119	34	42
CC(=O)c1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853877351	FH	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1C(F)(F)F	ZINC000853877355	GI	On-Demand	Anodyne	RBP4	93	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1C(F)(F)F	ZINC000853877355	GI	On-Demand	Anodyne	GPR119	33	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1C(F)(F)F	ZINC000853877355	GI	On-Demand	Anodyne	SFRP1	51	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccccc1C(F)(F)F	ZINC000853877355	GI	On-Demand	Anodyne	WNT3	43	35
Cc1nc(C(=O)NC[C@H]2CCCN(CC3CC3)C2)no1	ZINC000853877376	CD	On-Demand	Anodyne	BMP1	21	44
Cc1nc(C(=O)NC[C@@H]2CCCN(CC3CC3)C2)no1	ZINC000853877377	CD	On-Demand	Anodyne	BMP1	21	44
C[C@H]1CN(c2ccc(NC(=O)NCCOCCF)cc2F)C[C@@H](C)O1	ZINC000853877386	FF	On-Demand	Anodyne	NPY2R	63	36
C[C@H]1CN(c2ccc(NC(=O)NCCOCCF)cc2F)C[C@H](C)O1	ZINC000853877388	FF	On-Demand	Anodyne	NPY2R	63	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccc(F)cc1	ZINC000853877408	FF	On-Demand	Anodyne	GPR119	39	41
N#CC1(CNc2nccc(N3CCCC3)n2)CCCCC1	ZINC000853877412	CF	On-Demand	Mild	MRGPRX1	19	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)c1ccc(Cl)cc1	ZINC000853877420	GG	On-Demand	Anodyne	GPR119	32	41
C[C@@](CO)(NC(=O)C(=O)C1CCSCC1)c1cccc(C(F)(F)F)c1	ZINC000853877435	GF	On-Demand	Anodyne	CCR2	48	35
O=C(NCCOCCF)Nc1cccnc1Cl	ZINC000853877438	CD	On-Demand	Anodyne	G2YM83_BOTF4	66	33
CC(C)(C)OC(=O)C(=O)NCc1ccc(F)c(S(N)(=O)=O)c1	ZINC000853877475	EC	On-Demand	Anodyne	CA2	26	43
CC(C)(C)OC(=O)C(=O)NCc1ccc(F)c(S(N)(=O)=O)c1	ZINC000853877475	EC	On-Demand	Anodyne	CA1	22	43
CC(C)(C)OC(=O)C(=O)NCc1ccc(F)c(S(N)(=O)=O)c1	ZINC000853877475	EC	On-Demand	Anodyne	CA4	18	40
CC(C)(C)OC(=O)C(=O)NCc1ccc(F)c(S(N)(=O)=O)c1	ZINC000853877475	EC	On-Demand	Anodyne	CA9	19	40
Cc1nc(NC(=O)NCCOCCF)sc1-c1ccccc1	ZINC000853877502	DG	On-Demand	Anodyne	PIK3CG	22	48
Cc1nc(NC(=O)NCCOCCF)sc1-c1ccccc1	ZINC000853877502	DG	On-Demand	Anodyne	PI4KB	41	45
Cc1ccc(F)c(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853877690	FH	On-Demand	Anodyne	GPR119	40	40
Cn1cc(C#N)cc1C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853877695	EE	On-Demand	Mild	GPR119	20	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1cc(F)ccc1F	ZINC000853877703	FH	On-Demand	Anodyne	GPR119	42	45
CC(=O)c1cc(C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n(C)c1	ZINC000853877778	FE	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(-c2ccccc2)n1	ZINC000853877798	GE	On-Demand	Anodyne	GPR119	36	41
CN1CCN(c2ccccc2NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)CC1	ZINC000853877867	FE	On-Demand	Anodyne	KCNQ2	69	36
CN1CCN(c2ccccc2NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)CC1	ZINC000853877869	FE	On-Demand	Anodyne	KCNQ2	69	36
NS(=O)(=O)c1cc(CNC(=O)N2CCCCC2)ccc1F	ZINC000853877882	DD	On-Demand	Anodyne	CA2	16	40
NS(=O)(=O)c1cc(CNC(=O)N2CCCCC2)ccc1F	ZINC000853877882	DD	On-Demand	Anodyne	CA1	15	40
NS(=O)(=O)c1cc(CNC(=O)N2CCCCC2)ccc1F	ZINC000853877882	DD	On-Demand	Anodyne	DPP7	56	37
COC(=O)c1sc(N2CCC[C@@H]([C@H]3CCCCO3)C2)nc1Cl	ZINC000853877883	EG	On-Demand	Anodyne	PARE	71	34
COC(=O)c1sc(N2CCC[C@@H]([C@@H]3CCCCO3)C2)nc1Cl	ZINC000853877884	EG	On-Demand	Anodyne	PARE	71	34
COC(=O)c1sc(N2CCC[C@H]([C@@H]3CCCCO3)C2)nc1Cl	ZINC000853877885	EG	On-Demand	Anodyne	PARE	71	34
COC(=O)c1sc(N2CCC[C@H]([C@H]3CCCCO3)C2)nc1Cl	ZINC000853877886	EG	On-Demand	Anodyne	PARE	71	34
Nc1nc(Cl)cc(N2CCC[C@@H]([C@H]3CCCCO3)C2)n1	ZINC000853877899	CE	On-Demand	Anodyne	HRH4	43	40
Nc1nc(Cl)cc(N2CCC[C@@H]([C@@H]3CCCCO3)C2)n1	ZINC000853877900	CE	On-Demand	Anodyne	HRH4	43	40
Nc1nc(Cl)cc(N2CCC[C@H]([C@@H]3CCCCO3)C2)n1	ZINC000853877901	CE	On-Demand	Anodyne	HRH4	43	40
Nc1nc(Cl)cc(N2CCC[C@H]([C@H]3CCCCO3)C2)n1	ZINC000853877902	CE	On-Demand	Anodyne	HRH4	43	40
COC(=O)c1cnc([C@H]2CCCN(C(=O)Nc3cccnc3Cl)C2)s1	ZINC000853877923	GG	On-Demand	Anodyne	G2YM83_BOTF4	58	33
COC(=O)c1cnc([C@@H]2CCCN(C(=O)Nc3cccnc3Cl)C2)s1	ZINC000853877925	GG	On-Demand	Anodyne	G2YM83_BOTF4	58	33
c1ccc2c(N3CCC([C@@H]4CCCCO4)CC3)nc(-c3ccncc3)nc2c1	ZINC000853877928	FI	On-Demand	Anodyne	PRKD1	26	46
c1ccc2c(N3CCC([C@H]4CCCCO4)CC3)nc(-c3ccncc3)nc2c1	ZINC000853877931	FI	On-Demand	Anodyne	PRKD1	26	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)n1ccnc1	ZINC000853877953	DD	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(F)c(F)c1	ZINC000853877990	FH	On-Demand	Anodyne	F13A1	17	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(F)c(F)c1	ZINC000853877990	FH	On-Demand	Anodyne	GPR119	45	40
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	CA2	61	42
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	CA1	51	42
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	CA7	36	41
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	CA4	52	41
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	CA14	31	41
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	CA12	39	45
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	CA9	42	45
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	MTCA1	46	42
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853878022	EC	On-Demand	Anodyne	P96878_MYCTU	58	42
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	CA2	61	42
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	CA1	51	42
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	CA7	36	41
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	CA4	52	41
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	CA14	31	41
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	CA12	39	45
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	CA9	42	45
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	MTCA1	46	42
NS(=O)(=O)c1ccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853878023	EC	On-Demand	Anodyne	P96878_MYCTU	58	42
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H]4CC[C@H]3[C@H](CO)C4)cc2F)C[C@@H](C)O1	ZINC000853878043	GG	On-Demand	Anodyne	NPY2R	46	34
C[C@H]1CN(c2ccc(NC(=O)N3C[C@H]4CC[C@H]3[C@@H](CO)C4)cc2F)C[C@@H](C)O1	ZINC000853878044	GG	On-Demand	Anodyne	NPY2R	46	34
O=C(Nc1cccc2cccnc12)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853878074	DF	On-Demand	Anodyne	WNT3	18	43
O=C(Nc1cccc2cccnc12)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853878075	DF	On-Demand	Anodyne	WNT3	18	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)Nc1ccc(-c2ncon2)cc1	ZINC000853878089	GG	On-Demand	Anodyne	MTOR	52	40
Cc1cccc(NC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853878122	EG	On-Demand	Anodyne	GRM5	17	41
C[C@@H]1CCN(c2ncncc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878149	EG	On-Demand	Anodyne	SIRT3	32	40
C[C@@H]1CCN(c2ncncc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878149	EG	On-Demand	Anodyne	SIRT2	28	40
C[C@@H]1CCN(c2ncncc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878149	EG	On-Demand	Anodyne	SIRT1	28	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000853878160	GG	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000853878160	GG	On-Demand	Anodyne	DGAT1	32	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000853878161	GG	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(N3CCCC3)nc2)C1	ZINC000853878161	GG	On-Demand	Anodyne	DGAT1	32	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000853878166	FG	On-Demand	Bother	NMBR	48	36
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000853878166	FG	On-Demand	Bother	EPHX2	25	49
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000853878167	FG	On-Demand	Bother	NMBR	48	36
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cccc([N+](=O)[O-])c2)C1	ZINC000853878167	FG	On-Demand	Bother	EPHX2	25	49
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853878169	FG	On-Demand	Anodyne	EPHX2	21	46
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(Cl)nc2)C1	ZINC000853878170	FG	On-Demand	Anodyne	EPHX2	21	46
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cccc(C#N)c2)C1	ZINC000853878178	EG	On-Demand	Mild	EPHX2	26	49
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cccc(C#N)c2)C1	ZINC000853878178	EG	On-Demand	Mild	MCHR1	26	44
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cccc(C#N)c2)C1	ZINC000853878179	EG	On-Demand	Mild	EPHX2	26	49
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cccc(C#N)c2)C1	ZINC000853878179	EG	On-Demand	Mild	MCHR1	26	44
CN1CCN(c2ccccc2NC(=O)NCC(C)(C)CC(F)(F)F)CC1	ZINC000853878190	FH	On-Demand	Anodyne	KCNQ2	81	42
CN1CCN(c2ccccc2NC(=O)NCC(C)(C)CC(F)(F)F)CC1	ZINC000853878190	FH	On-Demand	Anodyne	P2RY1	43	38
CC(=O)c1ccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000853878236	FG	On-Demand	Anodyne	EPHX2	34	54
CC(=O)c1ccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000853878237	FG	On-Demand	Anodyne	EPHX2	34	54
Cc1nc(NC(=O)NCC(C)(C)CC(F)(F)F)sc1C	ZINC000853878238	DH	On-Demand	Anodyne	PI4KB	16	42
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cc(F)ccc2F)C1	ZINC000853878245	FG	On-Demand	Anodyne	GPR119	17	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cc(F)ccc2F)C1	ZINC000853878246	FG	On-Demand	Anodyne	GPR119	17	41
COc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878282	EG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878282	EG	On-Demand	Anodyne	MTNR1B	18	40
COc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878282	EG	On-Demand	Anodyne	EPHX2	35	51
COc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878282	EG	On-Demand	Anodyne	TAAR1	37	40
COc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878283	EG	On-Demand	Anodyne	DRD4	40	31
COc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878283	EG	On-Demand	Anodyne	MTNR1B	18	40
COc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878283	EG	On-Demand	Anodyne	EPHX2	35	51
COc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878283	EG	On-Demand	Anodyne	TAAR1	37	40
C[C@@H]1CCN(c2ncc(Br)cn2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878295	GG	On-Demand	Anodyne	GPR119	15	42
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000853878312	GG	On-Demand	Anodyne	MTOR	36	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000853878312	GG	On-Demand	Anodyne	EPHX2	15	46
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000853878313	GG	On-Demand	Anodyne	MTOR	36	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(-c3ncon3)cc2)C1	ZINC000853878313	GG	On-Demand	Anodyne	EPHX2	15	46
CC(C)(CNC(=O)Nc1cccnc1Cl)CC(F)(F)F	ZINC000853878319	DH	On-Demand	Anodyne	P2RY1	43	36
CC(C)(CNC(=O)Nc1cccnc1Cl)CC(F)(F)F	ZINC000853878319	DH	On-Demand	Anodyne	G2YM83_BOTF4	71	36
CC(=O)c1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878338	FG	On-Demand	Anodyne	EPHX2	33	58
CC(=O)c1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878338	FG	On-Demand	Anodyne	AKR1C3	18	43
CC(=O)c1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878339	FG	On-Demand	Anodyne	EPHX2	33	58
CC(=O)c1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878339	FG	On-Demand	Anodyne	AKR1C3	18	43
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc3c(c2)OCO3)C1	ZINC000853878344	FF	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc3c(c2)OCO3)C1	ZINC000853878345	FF	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(C#N)cc2)C1	ZINC000853878350	EG	On-Demand	Mild	EPHX2	21	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(C#N)cc2)C1	ZINC000853878351	EG	On-Demand	Mild	EPHX2	21	48
C[C@H]1CN(c2ccc(NC(=O)N3CC4CC3(C)C4)cc2F)C[C@H](C)O1	ZINC000853878352	EG	On-Demand	Anodyne	NPY2R	61	34
C[C@H]1CN(c2ccc(NC(=O)N3CC4CC3(C)C4)cc2F)C[C@@H](C)O1	ZINC000853878353	EG	On-Demand	Anodyne	NPY2R	61	34
C[C@@H]1CCN(c2cnccn2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878372	DF	On-Demand	Anodyne	GPR119	15	46
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccccc2Cl)C1	ZINC000853878373	FH	On-Demand	Anodyne	LPL	31	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccccc2Cl)C1	ZINC000853878373	FH	On-Demand	Anodyne	EPHB3	44	31
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccccc2Cl)C1	ZINC000853878374	FH	On-Demand	Anodyne	LPL	31	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccccc2Cl)C1	ZINC000853878374	FH	On-Demand	Anodyne	EPHB3	44	31
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CA2	64	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CA1	57	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CA7	31	44
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CA4	42	42
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CA14	27	44
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	EPHX2	27	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	TGM2	24	45
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CA12	48	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CA9	50	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	F13A1	39	45
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	CYNT	37	43
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	MTCA1	51	42
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878376	GD	On-Demand	Anodyne	P96878_MYCTU	64	42
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CA2	64	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CA1	57	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CA7	31	44
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CA4	42	42
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CA14	27	44
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	EPHX2	27	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	TGM2	24	45
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CA12	48	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CA9	50	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	F13A1	39	45
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	CYNT	37	43
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	GPR119	29	45
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	MTCA1	51	42
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853878377	GD	On-Demand	Anodyne	P96878_MYCTU	64	42
FC1(F)CC12CCC(Nc1nccc(N3CCCC3)n1)CC2	ZINC000853878383	DG	On-Demand	Anodyne	MAPK9	34	43
FC1(F)CC12CCC(Nc1nccc(N3CCCC3)n1)CC2	ZINC000853878383	DG	On-Demand	Anodyne	MAPK8	37	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc3c(c2)C(=O)NC3=O)C1	ZINC000853878389	GE	On-Demand	Anodyne	CASP2	16	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc3c(c2)C(=O)NC3=O)C1	ZINC000853878390	GE	On-Demand	Anodyne	CASP2	16	41
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CC1	ZINC000853878420	CD	On-Demand	Anodyne	NPFFR2	20	40
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CC1	ZINC000853878420	CD	On-Demand	Anodyne	NPFFR1	27	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000853878421	GI	On-Demand	Anodyne	P2RY1	53	35
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000853878421	GI	On-Demand	Anodyne	RBP4	69	34
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000853878422	GI	On-Demand	Anodyne	P2RY1	53	35
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccccc2C(F)(F)F)C1	ZINC000853878422	GI	On-Demand	Anodyne	RBP4	69	34
C#CCCN(CCOC)C(=O)N[C@H](CCC=C)c1ccccc1	ZINC000853878445	DG	On-Demand	Mild	UTS2	58	35
C#CCCN(CCOC)C(=O)N[C@@H](CCC=C)c1ccccc1	ZINC000853878446	DG	On-Demand	Mild	UTS2	58	35
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(F)cc2)C1	ZINC000853878448	EG	On-Demand	Anodyne	P2RY1	43	34
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(F)cc2)C1	ZINC000853878448	EG	On-Demand	Anodyne	EPHX2	51	50
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(F)cc2)C1	ZINC000853878449	EG	On-Demand	Anodyne	P2RY1	43	34
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(F)cc2)C1	ZINC000853878449	EG	On-Demand	Anodyne	EPHX2	51	50
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc3c(c2)OCCO3)C1	ZINC000853878455	GF	On-Demand	Anodyne	EPHX2	19	43
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc3c(c2)OCCO3)C1	ZINC000853878456	GF	On-Demand	Anodyne	EPHX2	19	43
CC(C)(C)OC(=O)C(=O)NC[C@@]1(c2ccccc2)CC1(C)C	ZINC000853878457	DF	On-Demand	Anodyne	ICMT	45	35
CC(C)(C)OC(=O)C(=O)NC[C@]1(c2ccccc2)CC1(C)C	ZINC000853878458	DF	On-Demand	Anodyne	ICMT	45	35
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)nc2)C1	ZINC000853878460	GE	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)nc2)C1	ZINC000853878461	GE	On-Demand	Anodyne	GPR119	39	42
COc1cccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](NC(=O)OC(C)(C)C)C3)c1	ZINC000853878465	GH	On-Demand	Anodyne	EPHX2	16	41
COc1cccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](NC(=O)OC(C)(C)C)C3)c1	ZINC000853878466	GH	On-Demand	Anodyne	EPHX2	16	41
CCC(CC)(CNC(=O)c1nccn1C)c1ccc(F)cc1	ZINC000853878467	DG	On-Demand	Anodyne	CACNA1G	39	45
Cc1ccc(F)c(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878482	FH	On-Demand	Anodyne	GPR119	15	40
Cc1ccc(F)c(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853878483	FH	On-Demand	Anodyne	GPR119	15	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000853878544	FG	On-Demand	Bother	NMBR	59	35
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000853878544	FG	On-Demand	Bother	EPHX2	19	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000853878545	FG	On-Demand	Bother	NMBR	59	35
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc([N+](=O)[O-])cc2)C1	ZINC000853878545	FG	On-Demand	Bother	EPHX2	19	48
COC(=O)c1sc(N2C[C@H]3[C@H](OC)CS(=O)(=O)[C@H]3C2)nc1Cl	ZINC000853878550	FC	On-Demand	Anodyne	PARE	76	34
CON(C)CCNC(=O)NCCCc1ccccn1	ZINC000853878551	CC	On-Demand	Anodyne	HRH2	22	45
CON(C)CCNC(=O)NCCCc1ccccn1	ZINC000853878551	CC	On-Demand	Anodyne	MTNR1B	22	44
C[C@@H]1CCN(c2ncnc3c2ncn3C2CC2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878559	GG	On-Demand	Anodyne	OXGR1	52	31
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccccn2)C1	ZINC000853878562	DF	On-Demand	Anodyne	GPR119	19	44
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccccn2)C1	ZINC000853878564	DF	On-Demand	Anodyne	GPR119	19	44
CN1CCN(c2ccccc2NC(=O)NCc2cnccc2C(F)(F)F)CC1	ZINC000853878597	GG	On-Demand	Anodyne	KCNQ2	78	42
CN1CCN(c2ccccc2NC(=O)NCc2cnccc2C(F)(F)F)CC1	ZINC000853878597	GG	On-Demand	Anodyne	TRPV1	30	54
CN1CCN(c2ccccc2NC(=O)NCc2cnccc2C(F)(F)F)CC1	ZINC000853878597	GG	On-Demand	Anodyne	P2RX7	43	38
CN1CCN(c2ccccc2NC(=O)NCc2cnccc2C(F)(F)F)CC1	ZINC000853878597	GG	On-Demand	Anodyne	P2RY1	41	37
C[C@H](NC(=O)Nc1cccnc1Cl)c1ccc2c(c1)CCCO2	ZINC000853878603	EH	On-Demand	Anodyne	G2YM83_BOTF4	54	34
CCC(CC)(CNC(=O)n1ccnc1)c1ccc(F)cc1	ZINC000853878652	CG	On-Demand	Anodyne	CACNA1G	40	46
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878666	GF	On-Demand	Anodyne	EPHX2	27	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878666	GF	On-Demand	Anodyne	TGM2	15	45
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878666	GF	On-Demand	Anodyne	F13A1	24	45
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878666	GF	On-Demand	Anodyne	GPR119	44	49
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878666	GF	On-Demand	Anodyne	P96878_MYCTU	44	32
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878667	GF	On-Demand	Anodyne	EPHX2	27	48
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878667	GF	On-Demand	Anodyne	TGM2	15	45
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878667	GF	On-Demand	Anodyne	F13A1	24	45
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878667	GF	On-Demand	Anodyne	GPR119	44	49
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(S(C)(=O)=O)cc2)C1	ZINC000853878667	GF	On-Demand	Anodyne	P96878_MYCTU	44	32
COc1ncccc1NC(=O)N[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853878681	FF	On-Demand	Anodyne	P2RY1	44	38
COc1ncccc1NC(=O)N[C@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853878682	FF	On-Demand	Anodyne	P2RY1	44	38
CCC(CC)(CNC(=O)C(C)(F)F)c1ccc(F)cc1	ZINC000853878690	CH	On-Demand	Anodyne	CACNA1G	45	53
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cccnc2Cl)C1	ZINC000853878692	FG	On-Demand	Anodyne	G2YM83_BOTF4	72	39
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cccnc2Cl)C1	ZINC000853878693	FG	On-Demand	Anodyne	G2YM83_BOTF4	72	39
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc(F)cc2F)C1	ZINC000853878713	FG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc(F)cc2F)C1	ZINC000853878714	FG	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853878715	GG	On-Demand	Bother	GPR119	20	42
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853878716	GG	On-Demand	Bother	GPR119	20	42
Cc1ncc(CCNC(=O)N2CCC(CCC(=O)OC(C)(C)C)CC2)s1	ZINC000853878772	GH	On-Demand	Anodyne	SIRT3	40	38
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@](C)(C(F)F)O1	ZINC000853878782	GF	On-Demand	Anodyne	KCNQ2	69	38
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@](C)(C(F)F)O1	ZINC000853878783	GF	On-Demand	Anodyne	KCNQ2	69	38
C[C@@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@](C)(C(F)F)O1	ZINC000853878784	GF	On-Demand	Anodyne	KCNQ2	69	38
C[C@H]1CN(C(=O)Nc2ccccc2N2CCN(C)CC2)C[C@@](C)(C(F)F)O1	ZINC000853878785	GF	On-Demand	Anodyne	KCNQ2	69	38
COC[C@H](NC(=O)NCCc1cnc(C)s1)c1cccc(OC)c1	ZINC000853878799	EF	On-Demand	Anodyne	MTNR1A	44	39
COC[C@H](NC(=O)NCCc1cnc(C)s1)c1cccc(OC)c1	ZINC000853878799	EF	On-Demand	Anodyne	ROCK2	15	41
COC[C@@H](NC(=O)NCCc1cnc(C)s1)c1cccc(OC)c1	ZINC000853878800	EF	On-Demand	Anodyne	MTNR1A	44	39
COC[C@@H](NC(=O)NCCc1cnc(C)s1)c1cccc(OC)c1	ZINC000853878800	EF	On-Demand	Anodyne	ROCK2	15	41
Cc1ncc(CCNC(=O)N2CC[C@@H](Oc3ccccc3)C2)s1	ZINC000853878826	EF	On-Demand	Anodyne	EPHX2	23	43
Cc1ncc(CCNC(=O)N2CC[C@@H](Oc3ccccc3)C2)s1	ZINC000853878826	EF	On-Demand	Anodyne	SCD1	17	40
C[C@@H]1CCN(c2ncnc3c2nnn3C)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878843	FD	On-Demand	Anodyne	SIRT3	42	43
C[C@@H]1CCN(c2ncnc3c2nnn3C)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878843	FD	On-Demand	Anodyne	SIRT2	38	43
C[C@@H]1CCN(c2ncnc3c2nnn3C)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878843	FD	On-Demand	Anodyne	SIRT1	34	43
CN1CCN(c2ccccc2NC(=O)N2CC3CC2(C)C3)CC1	ZINC000853878863	DE	On-Demand	Anodyne	KCNQ2	74	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccccc2F)C1	ZINC000853878894	EG	On-Demand	Anodyne	P2RY1	54	34
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2ccccc2F)C1	ZINC000853878894	EG	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccccc2F)C1	ZINC000853878895	EG	On-Demand	Anodyne	P2RY1	54	34
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2ccccc2F)C1	ZINC000853878895	EG	On-Demand	Anodyne	GPR119	15	41
C[C@@H]1CCN(c2ncccn2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853878906	DF	On-Demand	Anodyne	GPR119	18	45
CC(C)(C)C(=O)NCCCC(=O)NNC(=O)NCCCc1ccccn1	ZINC000853878982	FD	On-Demand	Reactive	HRH2	15	42
COc1cccc(C2(NC(=O)NCCc3cnc(C)s3)CCC2)c1	ZINC000853878993	EG	On-Demand	Anodyne	MTNR1A	41	35
O=C(N1CC2(CCC2)[C@@H]1c1ccncc1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853879000	GH	On-Demand	Bother	CACNA1C	52	35
O=C(N1CC2(CCC2)[C@@H]1c1ccncc1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853879000	GH	On-Demand	Bother	CACNA1D	79	35
O=C(N1CC2(CCC2)[C@H]1c1ccncc1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853879001	GH	On-Demand	Bother	CACNA1C	52	35
O=C(N1CC2(CCC2)[C@H]1c1ccncc1)C(F)(F)Oc1cccc([N+](=O)[O-])c1	ZINC000853879001	GH	On-Demand	Bother	CACNA1D	79	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCCc1ccccn1	ZINC000853879027	FF	On-Demand	Anodyne	GPR119	30	43
C#CCCN(CCOC)C(=O)NCCc1cccc(OCC)c1	ZINC000853879032	DE	On-Demand	Mild	MTNR1A	29	40
C#CCCN(CCOC)C(=O)NCCc1cccc(OCC)c1	ZINC000853879032	DE	On-Demand	Mild	MTNR1B	24	40
C#CCCN(CCOC)C(=O)NCCc1cccc(OCC)c1	ZINC000853879032	DE	On-Demand	Mild	CRTM	58	37
C#CCCN(CCOC)C(=O)NCCc1cccc(OCC)c1	ZINC000853879032	DE	On-Demand	Mild	PDS	48	35
Cc1nc(NC(=O)N[C@H]2CCc3ccccc3-n3ccnc32)sc1C	ZINC000853879036	FH	On-Demand	Anodyne	NPY1R	25	42
Cc1nc(NC(=O)N[C@@H]2CCc3ccccc3-n3ccnc32)sc1C	ZINC000853879037	FH	On-Demand	Anodyne	NPY1R	25	42
C=CCC[C@H](NC(=O)NCCN(C)OC)c1ccccc1	ZINC000853879055	CE	On-Demand	Mild	UTS2	71	40
C=CCC[C@@H](NC(=O)NCCN(C)OC)c1ccccc1	ZINC000853879056	CE	On-Demand	Mild	UTS2	71	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cccnc2)C1	ZINC000853879063	DF	On-Demand	Anodyne	EPHX2	17	44
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2cccnc2)C1	ZINC000853879063	DF	On-Demand	Anodyne	NAMPT	31	44
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cccnc2)C1	ZINC000853879064	DF	On-Demand	Anodyne	EPHX2	17	44
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2cccnc2)C1	ZINC000853879064	DF	On-Demand	Anodyne	NAMPT	31	44
O=C(NCc1ccc(N=c2cc[nH]cc2)cc1)N1CCOCC1	ZINC000853879075	DD	On-Demand	Anodyne	NAMPT	26	42
C[C@@H]1CCN(c2ncc(C#N)cc2F)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853879083	EG	On-Demand	Mild	GPR119	22	41
CC(=O)Nc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879117	GG	On-Demand	Anodyne	EPHX2	30	52
CC(=O)Nc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879119	GG	On-Demand	Anodyne	EPHX2	30	52
C[C@H](NC(=O)Nc1ccccc1N1CCN(C)CC1)c1ccc2c(c1)CCCO2	ZINC000853879128	GH	On-Demand	Anodyne	KCNQ2	92	43
Cc1ncc(CCNC(=O)N2CCC[C@H](N3CCOCC3)CC2)s1	ZINC000853879136	FD	On-Demand	Anodyne	L3MBTL3	44	36
Cc1ncc(CCNC(=O)N2CCC[C@@H](N3CCOCC3)CC2)s1	ZINC000853879138	FD	On-Demand	Anodyne	L3MBTL3	44	36
O=[N+]([O-])c1ccc(NC2CCC3(CC2)CC3(F)F)c2nonc12	ZINC000853879161	DH	On-Demand	Bother	GSTM2	109	42
O=[N+]([O-])c1ccc(NC2CCC3(CC2)CC3(F)F)c2nonc12	ZINC000853879161	DH	On-Demand	Bother	GSTP1	68	42
O=[N+]([O-])c1ccc(NC2CCC3(CC2)CC3(F)F)c2nonc12	ZINC000853879161	DH	On-Demand	Bother	EPAS1	53	32
COC(=O)N(C)CCNC(=O)NCCCc1ccccn1	ZINC000853879194	CD	On-Demand	Anodyne	MTNR1B	17	43
Cc1cccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](NC(=O)OC(C)(C)C)C3)c1	ZINC000853879249	FH	On-Demand	Anodyne	CCKAR	19	43
Cc1cccc(NC(=O)N2C[C@H]3CC[C@H]2[C@H](NC(=O)OC(C)(C)C)C3)c1	ZINC000853879249	FH	On-Demand	Anodyne	CCKBR	21	43
Cc1cccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](NC(=O)OC(C)(C)C)C3)c1	ZINC000853879250	FH	On-Demand	Anodyne	CCKAR	19	43
Cc1cccc(NC(=O)N2C[C@H]3CC[C@H]2[C@@H](NC(=O)OC(C)(C)C)C3)c1	ZINC000853879250	FH	On-Demand	Anodyne	CCKBR	21	43
CCC(CC)(CNC(=O)c1noc(C)n1)c1ccc(F)cc1	ZINC000853879252	DG	On-Demand	Anodyne	CACNA1G	38	45
Cn1ccnc1C(=O)NC[C@]1(c2ccccc2)CC1(C)C	ZINC000853879260	CF	On-Demand	Anodyne	HCN1	69	32
Cn1ccnc1C(=O)NC[C@]1(c2ccccc2)CC1(C)C	ZINC000853879260	CF	On-Demand	Anodyne	HCN4	47	30
Cn1ccnc1C(=O)NC[C@@]1(c2ccccc2)CC1(C)C	ZINC000853879261	CF	On-Demand	Anodyne	HCN1	69	32
Cn1ccnc1C(=O)NC[C@@]1(c2ccccc2)CC1(C)C	ZINC000853879261	CF	On-Demand	Anodyne	HCN4	47	30
Cc1nc(NC(=O)N2CC3CC2(C)C3)sc1-c1ccccc1	ZINC000853879267	DI	On-Demand	Anodyne	PIK3CG	20	43
Cc1nc(NC(=O)N2CC3CC2(C)C3)sc1-c1ccccc1	ZINC000853879267	DI	On-Demand	Anodyne	PI4KB	40	39
O=C(NCC1(Cc2ccccc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853879291	EG	On-Demand	Anodyne	NPFFR2	16	40
O=C(NCC1(Cc2ccccc2)CC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853879291	EG	On-Demand	Anodyne	NPFFR1	15	40
O=C(NCC1(Cc2ccccc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853879292	EG	On-Demand	Anodyne	NPFFR2	16	40
O=C(NCC1(Cc2ccccc2)CC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853879292	EG	On-Demand	Anodyne	NPFFR1	15	40
O=C(NCC1(Cc2ccccc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853879294	EG	On-Demand	Anodyne	NPFFR2	16	40
O=C(NCC1(Cc2ccccc2)CC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853879294	EG	On-Demand	Anodyne	NPFFR1	15	40
O=C(NCC1(Cc2ccccc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853879296	EG	On-Demand	Anodyne	NPFFR2	16	40
O=C(NCC1(Cc2ccccc2)CC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853879296	EG	On-Demand	Anodyne	NPFFR1	15	40
Cn1c(S)nnc1CCNC(=O)NCC1(Cc2ccccc2)CC1	ZINC000853879326	ED	On-Demand	Anodyne	NPFFR2	19	40
Cn1c(S)nnc1CCNC(=O)NCC1(Cc2ccccc2)CC1	ZINC000853879326	ED	On-Demand	Anodyne	NPFFR1	25	40
Cc1ncc(CCNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)s1	ZINC000853879347	DE	On-Demand	Anodyne	CPT1A	62	35
Cc1ncc(CCNC(=O)N2CCCC[C@H]2c2nc[nH]n2)s1	ZINC000853879348	DE	On-Demand	Anodyne	CPT1A	62	35
COc1ccc(N2CC[C@H](NC(=O)NCCCc3ccccn3)C2)cc1	ZINC000853879398	FF	On-Demand	Clean	MTNR1A	23	43
COc1ccc(N2CC[C@H](NC(=O)NCCCc3ccccn3)C2)cc1	ZINC000853879398	FF	On-Demand	Clean	MTNR1B	23	43
C[C@H]1c2ccccc2OCCN1C(=O)Nc1ccccc1N1CCN(C)CC1	ZINC000853879413	GG	On-Demand	Anodyne	KCNQ2	70	40
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	CA2	77	48
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	CA1	68	43
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	CA7	44	45
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	CA4	60	43
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	CA14	40	46
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	TGM2	42	34
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	CA12	51	46
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	CA9	55	48
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	F13A1	53	34
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	MTCA1	50	42
CC(C)[C@H]1CN(C(=O)Nc2ccc(S(N)(=O)=O)cc2)CCN1	ZINC000853879437	EC	On-Demand	Anodyne	P96878_MYCTU	65	45
Cc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879455	EH	On-Demand	Anodyne	EPHX2	27	52
Cc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879455	EH	On-Demand	Anodyne	GPR119	15	46
Cc1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879455	EH	On-Demand	Anodyne	KCNK3	49	37
Cc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879456	EH	On-Demand	Anodyne	EPHX2	27	52
Cc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879456	EH	On-Demand	Anodyne	GPR119	15	46
Cc1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879456	EH	On-Demand	Anodyne	KCNK3	49	37
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)Nc2nccs2)C1	ZINC000853879488	EF	On-Demand	Anodyne	MAP1	74	34
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)Nc2nccs2)C1	ZINC000853879489	EF	On-Demand	Anodyne	MAP1	74	34
COC(=O)c1cccc(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879507	GF	On-Demand	Anodyne	EPHX2	33	56
COC(=O)c1cccc(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)c1	ZINC000853879508	GF	On-Demand	Anodyne	EPHX2	33	56
CN1CCN(c2ccccc2NC(=O)N2CCO[C@@](C)(C(F)F)C2)CC1	ZINC000853879515	FE	On-Demand	Anodyne	KCNQ2	74	39
CN1CCN(c2ccccc2NC(=O)N2CCO[C@](C)(C(F)F)C2)CC1	ZINC000853879516	FE	On-Demand	Anodyne	KCNQ2	74	39
C[C@H]1c2ccccc2OCCN1C(=O)Nc1cccnc1Cl	ZINC000853879545	DH	On-Demand	Anodyne	G2YM83_BOTF4	70	37
Cn1ccnc1C(=O)NCc1cnccc1C(F)(F)F	ZINC000853879567	CD	On-Demand	Anodyne	P2RX7	30	41
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1cccc(OCC)c1	ZINC000853879599	FF	On-Demand	Mild	CRTM	50	37
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1cccc(OCC)c1	ZINC000853879599	FF	On-Demand	Mild	PDS	52	36
Cc1nc(NC(=O)N2CCOc3ccccc3[C@H]2C)sc1C	ZINC000853879608	DH	On-Demand	Anodyne	TRPC6	26	41
Cc1nc(NC(=O)N2CCOc3ccccc3[C@H]2C)sc1C	ZINC000853879608	DH	On-Demand	Anodyne	TRPC3	17	41
Cc1nc(NC(=O)N2CCOc3ccccc3[C@@H]2C)sc1C	ZINC000853879609	DH	On-Demand	Anodyne	TRPC6	26	41
Cc1nc(NC(=O)N2CCOc3ccccc3[C@@H]2C)sc1C	ZINC000853879609	DH	On-Demand	Anodyne	TRPC3	17	41
Cc1ncc(CCNC(=O)N(CCN2CCOCC2)CC2CC2)s1	ZINC000853879610	FD	On-Demand	Anodyne	CASR	50	37
Cc1oc(-c2ccccc2)nc1C(=O)OCCOC(F)F	ZINC000853879635	CG	On-Demand	Anodyne	PPARG	88	44
Cc1oc(-c2ccccc2)nc1C(=O)OCCOC(F)F	ZINC000853879635	CG	On-Demand	Anodyne	PPARA	93	48
Cc1oc(-c2ccccc2)nc1C(=O)OCCOC(F)F	ZINC000853879635	CG	On-Demand	Anodyne	PDE8B	56	32
CCNC(=O)C(C)(C)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853879638	FF	On-Demand	Reactive	CSNK1D	43	45
Cc1nc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)ccc1C#N	ZINC000853879647	GG	On-Demand	Mild	NR3C2	31	40
Cc1nc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)ccc1C#N	ZINC000853879648	GG	On-Demand	Mild	NR3C2	31	40
CCCOc1ccc(OCC(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853879706	FF	On-Demand	Bother	PLA2G4B	49	35
O=C(NCCNS(=O)(=O)c1cccnc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853879712	GB	On-Demand	Anodyne	NAMPT	41	35
O=C(NCCNS(=O)(=O)c1cccnc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853879714	GB	On-Demand	Anodyne	NAMPT	41	35
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]cnc34)CC2)C1)C(F)(F)F	ZINC000853879726	GE	On-Demand	Anodyne	SIRT3	41	33
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]cnc34)CC2)C1)C(F)(F)F	ZINC000853879728	GE	On-Demand	Anodyne	SIRT3	41	33
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879730	GD	On-Demand	Mild	F2	27	43
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879730	GD	On-Demand	Mild	MMP13	37	51
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879730	GD	On-Demand	Mild	TRY2_BOVIN	70	38
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879730	GD	On-Demand	Mild	MMP2	26	51
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879730	GD	On-Demand	Mild	MMP12	61	42
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879730	GD	On-Demand	Mild	ADAMTS4	36	43
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879732	GD	On-Demand	Mild	F2	27	43
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879732	GD	On-Demand	Mild	MMP13	37	51
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879732	GD	On-Demand	Mild	TRY2_BOVIN	70	38
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879732	GD	On-Demand	Mild	MMP2	26	51
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879732	GD	On-Demand	Mild	MMP12	61	42
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879732	GD	On-Demand	Mild	ADAMTS4	36	43
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879734	GD	On-Demand	Mild	F2	27	43
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879734	GD	On-Demand	Mild	MMP13	37	51
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879734	GD	On-Demand	Mild	TRY2_BOVIN	70	38
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879734	GD	On-Demand	Mild	MMP2	26	51
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879734	GD	On-Demand	Mild	MMP12	61	42
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@H](C)O	ZINC000853879734	GD	On-Demand	Mild	ADAMTS4	36	43
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879735	GD	On-Demand	Mild	F2	27	43
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879735	GD	On-Demand	Mild	MMP13	37	51
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879735	GD	On-Demand	Mild	TRY2_BOVIN	70	38
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879735	GD	On-Demand	Mild	MMP2	26	51
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879735	GD	On-Demand	Mild	MMP12	61	42
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)[C@@H](C)O	ZINC000853879735	GD	On-Demand	Mild	ADAMTS4	36	43
C[C@@H]1CCN(c2cc(-n3ccnc3)ncn2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853879752	FF	On-Demand	Anodyne	NOS2	74	36
N#Cc1ccc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c(F)c1	ZINC000853879771	GH	On-Demand	Mild	SLC6A9	19	44
N#Cc1ccc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c(F)c1	ZINC000853879773	GH	On-Demand	Mild	SLC6A9	19	44
C#CCOCCOC(=O)CSc1nc2ccccc2n1CCC	ZINC000853879795	EF	On-Demand	Mild	HRH1	15	48
Cc1nc(NC(=O)N2CCO[C@](C)(C(F)F)C2)sc1-c1ccccc1	ZINC000853879862	FI	On-Demand	Anodyne	PIK3CG	23	42
Cc1nc(NC(=O)N2CCO[C@@](C)(C(F)F)C2)sc1-c1ccccc1	ZINC000853879864	FI	On-Demand	Anodyne	PIK3CG	23	42
Cn1c(S)nnc1CCNC(=O)NCCNS(=O)(=O)c1cccnc1	ZINC000853879907	GB	On-Demand	Anodyne	TBXAS1	41	38
Cn1c(S)nnc1CCNC(=O)NCCNS(=O)(=O)c1cccnc1	ZINC000853879907	GB	On-Demand	Anodyne	NAMPT	27	41
COc1ccc2c(NCc3c(C4CCC4)cnn3C)ccnc2c1	ZINC000853879928	DH	On-Demand	Anodyne	PDGFRB	17	42
COc1ccc2c(NCc3c(C4CCC4)cnn3C)ccnc2c1	ZINC000853879928	DH	On-Demand	Anodyne	HRP1_PLAFA	110	43
COc1ccc2c(NCc3c(C4CCC4)cnn3C)ccnc2c1	ZINC000853879928	DH	On-Demand	Anodyne	HNMT	63	37
O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)OCCOC(F)F	ZINC000853879939	FG	On-Demand	Anodyne	UTS2	66	36
O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)OCCOC(F)F	ZINC000853879940	FG	On-Demand	Anodyne	UTS2	66	36
O=C(OCCOC(F)F)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853880024	GD	On-Demand	Anodyne	ADAM17	16	46
O=C(OCCOC(F)F)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853880024	GD	On-Demand	Anodyne	MMP2	16	43
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853880026	GD	On-Demand	Anodyne	ADAM17	16	46
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853880026	GD	On-Demand	Anodyne	MMP2	16	43
Cc1nc(C(=O)NCc2cnccc2C(F)(F)F)no1	ZINC000853880027	CD	On-Demand	Anodyne	P2RX7	19	40
O=C(CCCOc1ccccc1)OCCOC(F)F	ZINC000853880062	CF	On-Demand	Anodyne	LTA4H	33	43
O=C(CCCOc1ccccc1)OCCOC(F)F	ZINC000853880062	CF	On-Demand	Anodyne	PLA2G4B	78	35
O=C(CCCOc1ccccc1)OCCOC(F)F	ZINC000853880062	CF	On-Demand	Anodyne	FAAH	17	41
O=C(CCCOc1ccccc1)OCCOC(F)F	ZINC000853880062	CF	On-Demand	Anodyne	ACR	15	40
CCOc1ccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880067	GF	On-Demand	Anodyne	SIGMAR1	19	46
CCOc1ccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880067	GF	On-Demand	Anodyne	MMP1	21	47
CCOc1ccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880068	GF	On-Demand	Anodyne	SIGMAR1	19	46
CCOc1ccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880068	GF	On-Demand	Anodyne	MMP1	21	47
O=C(N1CCC[C@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880103	GH	On-Demand	Anodyne	PDGFRB	30	44
O=C(N1CCC[C@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880103	GH	On-Demand	Anodyne	SIRT3	57	35
O=C(N1CCC[C@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880103	GH	On-Demand	Anodyne	SIRT2	51	31
O=C(N1CCC[C@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880103	GH	On-Demand	Anodyne	SIRT1	50	31
O=C(N1CCC[C@@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880104	GH	On-Demand	Anodyne	PDGFRB	30	44
O=C(N1CCC[C@@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880104	GH	On-Demand	Anodyne	SIRT3	57	35
O=C(N1CCC[C@@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880104	GH	On-Demand	Anodyne	SIRT2	51	31
O=C(N1CCC[C@@H](C2CCN(c3ncnc4ccccc34)CC2)C1)C(F)(F)F	ZINC000853880104	GH	On-Demand	Anodyne	SIRT1	50	31
O=C(OCCOC(F)F)c1cc2cc(Br)ccc2[nH]1	ZINC000853880116	EG	On-Demand	Anodyne	PYK	53	39
C[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853880143	CD	On-Demand	Anodyne	CA2	17	46
C[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853880143	CD	On-Demand	Anodyne	CTSG	30	40
C[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853880143	CD	On-Demand	Anodyne	CTRB1	45	43
C[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853880143	CD	On-Demand	Anodyne	CELA2A	28	43
C[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853880143	CD	On-Demand	Anodyne	CAPN2	43	33
C[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853880143	CD	On-Demand	Anodyne	ACE2	40	33
C[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853880143	CD	On-Demand	Anodyne	CTRB_BOVIN	45	32
COC(=O)c1cccc(NNC(=O)NCCCc2ccccn2)c1C	ZINC000853880176	EE	On-Demand	Reactive	FAS	17	44
C[C@H](NC(=O)c1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853880179	CE	On-Demand	Anodyne	CTSG	33	40
C[C@H](NC(=O)c1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853880179	CE	On-Demand	Anodyne	CTRB1	52	41
C[C@H](NC(=O)c1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853880179	CE	On-Demand	Anodyne	CELA2A	28	41
C[C@H](NC(=O)c1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853880182	CE	On-Demand	Anodyne	CTSG	33	40
C[C@H](NC(=O)c1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853880182	CE	On-Demand	Anodyne	CTRB1	52	41
C[C@H](NC(=O)c1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853880182	CE	On-Demand	Anodyne	CELA2A	28	41
C[C@H](NC(=O)c1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853880184	CE	On-Demand	Anodyne	CTSG	33	40
C[C@H](NC(=O)c1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853880184	CE	On-Demand	Anodyne	CTRB1	52	41
C[C@H](NC(=O)c1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853880184	CE	On-Demand	Anodyne	CELA2A	28	41
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853880252	GC	On-Demand	Anodyne	TBXA2R	22	45
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853880252	GC	On-Demand	Anodyne	TBXAS1	39	41
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853880252	GC	On-Demand	Anodyne	NAMPT	50	38
CN1CCN(c2ccccc2NC(=O)N2CC3(CCC3)[C@@H]2c2ccncc2)CC1	ZINC000853880259	GH	On-Demand	Anodyne	KCNQ2	68	35
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853880260	GC	On-Demand	Anodyne	TBXA2R	22	45
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853880260	GC	On-Demand	Anodyne	TBXAS1	39	41
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853880260	GC	On-Demand	Anodyne	NAMPT	50	38
CN1CCN(c2ccccc2NC(=O)N2CC3(CCC3)[C@H]2c2ccncc2)CC1	ZINC000853880261	GH	On-Demand	Anodyne	KCNQ2	68	35
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853880262	GC	On-Demand	Anodyne	TBXA2R	22	45
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853880262	GC	On-Demand	Anodyne	TBXAS1	39	41
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853880262	GC	On-Demand	Anodyne	NAMPT	50	38
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853880264	GC	On-Demand	Anodyne	TBXA2R	22	45
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853880264	GC	On-Demand	Anodyne	TBXAS1	39	41
O=C(NCCNS(=O)(=O)c1cccnc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853880264	GC	On-Demand	Anodyne	NAMPT	50	38
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	AKT2	58	54
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	AKT3	41	41
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	JAK3	30	51
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	JAK1	48	40
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	ROCK2	15	41
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	AKT1	28	45
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	SIRT3	57	34
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	SIRT2	51	33
O=C(N1CCC[C@@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880318	GF	On-Demand	Anodyne	SIRT1	50	30
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	AKT2	58	54
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	AKT3	41	41
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	JAK3	30	51
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	JAK1	48	40
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	ROCK2	15	41
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	AKT1	28	45
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	SIRT3	57	34
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	SIRT2	51	33
O=C(N1CCC[C@H](C2CCN(c3ncnc4[nH]ccc34)CC2)C1)C(F)(F)F	ZINC000853880321	GF	On-Demand	Anodyne	SIRT1	50	30
O=C(COc1cccc(Cl)c1)OCCOC(F)F	ZINC000853880325	CF	On-Demand	Anodyne	MAOB	15	51
O=C(COc1cccc(Cl)c1)OCCOC(F)F	ZINC000853880325	CF	On-Demand	Anodyne	PDS	66	43
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OCCOC(F)F)CC1	ZINC000853880398	FG	On-Demand	Bother	CACNA1D	47	33
Cn1ncc(C2CCC2)c1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853880456	EF	On-Demand	Bother	GSTM2	101	42
Cn1ncc(C2CCC2)c1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853880456	EF	On-Demand	Bother	GSTP1	61	42
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@](C)(C(F)F)O1	ZINC000853880463	DG	On-Demand	Anodyne	G2YM83_BOTF4	76	39
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@](C)(C(F)F)O1	ZINC000853880464	DG	On-Demand	Anodyne	G2YM83_BOTF4	76	39
C[C@@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@](C)(C(F)F)O1	ZINC000853880466	DG	On-Demand	Anodyne	G2YM83_BOTF4	76	39
C[C@H]1CN(C(=O)Nc2cccnc2Cl)C[C@@](C)(C(F)F)O1	ZINC000853880468	DG	On-Demand	Anodyne	G2YM83_BOTF4	76	39
CON(C)CCNC(=O)NCCNS(=O)(=O)c1cccnc1	ZINC000853880474	EB	On-Demand	Anodyne	TBXAS1	48	42
CON(C)CCNC(=O)NCCNS(=O)(=O)c1cccnc1	ZINC000853880474	EB	On-Demand	Anodyne	NAMPT	37	42
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3[C@H]4CCc5ccccc5[C@H]43)C2)cc1	ZINC000853880489	GG	On-Demand	Clean	MTNR1B	18	43
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3[C@@H]4CCc5ccccc5[C@@H]43)C2)cc1	ZINC000853880492	GG	On-Demand	Clean	MTNR1B	18	43
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3[C@H]4CCc5ccccc5[C@@H]43)C2)cc1	ZINC000853880494	GG	On-Demand	Clean	MTNR1B	18	43
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3[C@@H]4c5ccccc5CC[C@H]43)C2)cc1	ZINC000853880496	GG	On-Demand	Clean	MTNR1B	18	43
NC(=O)c1cnccc1N1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853880508	GE	On-Demand	Anodyne	LIPG	41	32
NC(=O)c1cnccc1N1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853880509	GE	On-Demand	Anodyne	LIPG	41	32
C#CCOCCOC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880510	DD	On-Demand	Mild	FKBP1A	99	50
C#CCOCCOC(=O)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880510	DD	On-Demand	Mild	PREP	94	46
C#CCOCCOC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880511	DD	On-Demand	Mild	FKBP1A	99	50
C#CCOCCOC(=O)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880511	DD	On-Demand	Mild	PREP	94	46
O=C(N1CCC[C@@H](C2CCN(c3ncnc4ccsc34)CC2)C1)C(F)(F)F	ZINC000853880514	GH	On-Demand	Anodyne	SIRT3	69	38
O=C(N1CCC[C@@H](C2CCN(c3ncnc4ccsc34)CC2)C1)C(F)(F)F	ZINC000853880514	GH	On-Demand	Anodyne	SIRT2	58	37
O=C(N1CCC[C@@H](C2CCN(c3ncnc4ccsc34)CC2)C1)C(F)(F)F	ZINC000853880514	GH	On-Demand	Anodyne	SIRT1	57	37
O=C(N1CCC[C@H](C2CCN(c3ncnc4ccsc34)CC2)C1)C(F)(F)F	ZINC000853880515	GH	On-Demand	Anodyne	SIRT3	69	38
O=C(N1CCC[C@H](C2CCN(c3ncnc4ccsc34)CC2)C1)C(F)(F)F	ZINC000853880515	GH	On-Demand	Anodyne	SIRT2	58	37
O=C(N1CCC[C@H](C2CCN(c3ncnc4ccsc34)CC2)C1)C(F)(F)F	ZINC000853880515	GH	On-Demand	Anodyne	SIRT1	57	37
CCc1ncnc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1F	ZINC000853880525	GG	On-Demand	Anodyne	SIRT3	45	33
CCc1ncnc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)c1F	ZINC000853880526	GG	On-Demand	Anodyne	SIRT3	45	33
C[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853880528	GF	On-Demand	Anodyne	CXCR3	30	41
C[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853880528	GF	On-Demand	Anodyne	CACNA1I	57	37
C[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853880528	GF	On-Demand	Anodyne	SIRT3	40	40
C[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853880528	GF	On-Demand	Anodyne	SIRT2	36	40
C[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853880528	GF	On-Demand	Anodyne	SIRT1	37	40
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880566	EG	On-Demand	Anodyne	FKBP1A	89	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880566	EG	On-Demand	Anodyne	CPT1A	91	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880566	EG	On-Demand	Anodyne	CPT2	46	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880566	EG	On-Demand	Anodyne	PREP	94	52
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880567	EG	On-Demand	Anodyne	FKBP1A	89	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880567	EG	On-Demand	Anodyne	CPT1A	91	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880567	EG	On-Demand	Anodyne	CPT2	46	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880567	EG	On-Demand	Anodyne	PREP	94	52
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880568	EG	On-Demand	Anodyne	FKBP1A	89	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880568	EG	On-Demand	Anodyne	CPT1A	91	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880568	EG	On-Demand	Anodyne	CPT2	46	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880568	EG	On-Demand	Anodyne	PREP	94	52
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880569	EG	On-Demand	Anodyne	FKBP1A	89	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880569	EG	On-Demand	Anodyne	CPT1A	91	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880569	EG	On-Demand	Anodyne	CPT2	46	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853880569	EG	On-Demand	Anodyne	PREP	94	52
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	FKBP1A	96	70
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	MMP13	28	42
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	ITGA4	31	41
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	AMY2	47	32
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	CAPNS1	21	43
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	MMP3	34	42
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	CAPN1	16	44
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	MMP7	42	42
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	MMP1	31	42
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880570	FE	On-Demand	Anodyne	WNT3	42	31
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	FKBP1A	96	70
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	MMP13	28	42
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	ITGA4	31	41
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	AMY2	47	32
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	CAPNS1	21	43
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	MMP3	34	42
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	CAPN1	16	44
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	MMP7	42	42
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	MMP1	31	42
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1	ZINC000853880571	FE	On-Demand	Anodyne	WNT3	42	31
O=C(COc1ccc([N+](=O)[O-])cc1)OCCOC(F)F	ZINC000853880575	CD	On-Demand	Bother	PLA2G4B	48	35
O=C(COc1ccc([N+](=O)[O-])cc1)OCCOC(F)F	ZINC000853880575	CD	On-Demand	Bother	ACR	16	48
Nc1cc([N+](=O)[O-])ccc1C(=O)OCCOC(F)F	ZINC000853880597	CD	On-Demand	Bother	CACNA1D	51	35
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853880619	FD	On-Demand	Anodyne	FKBP1A	31	47
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853880619	FD	On-Demand	Anodyne	CHRM5	24	42
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853880619	FD	On-Demand	Anodyne	EPHX2	20	47
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853880619	FD	On-Demand	Anodyne	TGM2	56	37
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2ccccc2)CC1	ZINC000853880619	FD	On-Demand	Anodyne	F13A1	54	37
O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)OCCOC(F)F	ZINC000853880642	FG	On-Demand	Anodyne	ALOX15	34	48
O=C(NCCNS(=O)(=O)c1cccnc1)N1CCC(N2CCOC2=O)CC1	ZINC000853880702	GB	On-Demand	Anodyne	NAMPT	46	35
C[C@@H]1CCN(c2ncc(Cl)cn2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853880724	EG	On-Demand	Anodyne	CACNA1I	46	33
CC(C)CN1CCC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853880725	EF	On-Demand	Anodyne	BIRC2	41	35
CC(C)CN1CCC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853880726	EF	On-Demand	Anodyne	BIRC2	41	35
CC(C)CN1CCC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853880727	EF	On-Demand	Anodyne	BIRC2	41	35
CC(C)CN1CCC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853880728	EF	On-Demand	Anodyne	BIRC2	41	35
Cn1nnc2c(N3CCC([C@@H]4CCCN(C(=O)C(F)(F)F)C4)CC3)ncnc21	ZINC000853880746	GD	On-Demand	Anodyne	SIRT3	46	36
Cn1nnc2c(N3CCC([C@H]4CCCN(C(=O)C(F)(F)F)C4)CC3)ncnc21	ZINC000853880747	GD	On-Demand	Anodyne	SIRT3	46	36
O=C(COc1ccccc1)NCC(=O)OCCOC(F)F	ZINC000853880748	DC	On-Demand	Anodyne	PLA2G4B	75	37
O=C(COc1ccccc1)NCC(=O)OCCOC(F)F	ZINC000853880748	DC	On-Demand	Anodyne	PDS	45	38
CC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853880777	CE	On-Demand	Anodyne	MME	20	40
CC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853880777	CE	On-Demand	Anodyne	CTSB	42	37
CC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853880777	CE	On-Demand	Anodyne	PAPA1_CARPA	40	40
CC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853880777	CE	On-Demand	Anodyne	CAPNS1	55	35
CC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853880777	CE	On-Demand	Anodyne	CAPN1	58	38
CC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853880777	CE	On-Demand	Anodyne	CAPN2	85	34
CC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853880777	CE	On-Demand	Anodyne	NPR	47	33
O=C(OCCOC(F)F)c1ccccc1NCCO	ZINC000853880778	CD	On-Demand	Anodyne	PRTN3	15	40
Cc1cc(C(=O)NCC(=O)OCc2onc(C)c2[N+](=O)[O-])ccc1[N+](=O)[O-]	ZINC000853880779	GD	On-Demand	Bother	GSTM2	45	34
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880784	GE	On-Demand	Anodyne	LTA4H	26	42
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880784	GE	On-Demand	Anodyne	SIGMAR1	16	45
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880784	GE	On-Demand	Anodyne	MMP1	37	48
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853880784	GE	On-Demand	Anodyne	PROKR1	53	32
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CCC(N2CCOC2=O)CC1	ZINC000853880822	GD	On-Demand	Anodyne	CALCRL	32	41
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CCC(N2CCOC2=O)CC1	ZINC000853880823	GD	On-Demand	Anodyne	CALCRL	32	41
O=C(N1CCC[C@@H](C2CCN(c3ncnc4n[nH]cc34)CC2)C1)C(F)(F)F	ZINC000853880824	GE	On-Demand	Anodyne	SIRT3	46	34
O=C(N1CCC[C@H](C2CCN(c3ncnc4n[nH]cc34)CC2)C1)C(F)(F)F	ZINC000853880825	GE	On-Demand	Anodyne	SIRT3	46	34
CC[C@H](C)[C@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853880828	CH	On-Demand	Anodyne	CHRM4	15	63
CC[C@@H](C)[C@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853880831	CH	On-Demand	Anodyne	CHRM4	15	63
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	ZINC000853880835	GC	On-Demand	Mild	MMP13	25	47
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	ZINC000853880835	GC	On-Demand	Mild	MMP2	19	47
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	ZINC000853880835	GC	On-Demand	Mild	MMP12	25	42
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	ZINC000853880836	GC	On-Demand	Mild	MMP13	25	47
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	ZINC000853880836	GC	On-Demand	Mild	MMP2	19	47
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	ZINC000853880836	GC	On-Demand	Mild	MMP12	25	42
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	ZINC000853880837	GC	On-Demand	Mild	MMP13	25	47
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	ZINC000853880837	GC	On-Demand	Mild	MMP2	19	47
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)O	ZINC000853880837	GC	On-Demand	Mild	MMP12	25	42
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	ZINC000853880838	GC	On-Demand	Mild	MMP13	25	47
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	ZINC000853880838	GC	On-Demand	Mild	MMP2	19	47
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)[C@H](C)O	ZINC000853880838	GC	On-Demand	Mild	MMP12	25	42
O=C(N1CCC[C@H](C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1)C(F)(F)F	ZINC000853880846	GH	On-Demand	Bother	SFRP1	40	31
O=C(N1CCC[C@@H](C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1)C(F)(F)F	ZINC000853880847	GH	On-Demand	Bother	SFRP1	40	31
O=C(N1CCC[C@H](C2CCN(c3ccc4ccccc4n3)CC2)C1)C(F)(F)F	ZINC000853880848	GI	On-Demand	Anodyne	HTR3A	21	45
O=C(N1CCC[C@@H](C2CCN(c3ccc4ccccc4n3)CC2)C1)C(F)(F)F	ZINC000853880849	GI	On-Demand	Anodyne	HTR3A	21	45
CCOc1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853880850	CE	On-Demand	Anodyne	PLA2G4B	96	40
CCOc1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853880850	CE	On-Demand	Anodyne	FAAH	17	40
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@@H](C)O	ZINC000853880859	FC	On-Demand	Mild	MMP13	20	41
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@@H](C)O	ZINC000853880859	FC	On-Demand	Mild	MMP12	57	40
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@@H](C)O	ZINC000853880859	FC	On-Demand	Mild	LEF	35	41
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@H](C)O	ZINC000853880860	FC	On-Demand	Mild	MMP13	20	41
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@H](C)O	ZINC000853880860	FC	On-Demand	Mild	MMP12	57	40
C#CCOCCOC(=O)[C@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@H](C)O	ZINC000853880860	FC	On-Demand	Mild	LEF	35	41
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@H](C)O	ZINC000853880861	FC	On-Demand	Mild	MMP13	20	41
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@H](C)O	ZINC000853880861	FC	On-Demand	Mild	MMP12	57	40
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@H](C)O	ZINC000853880861	FC	On-Demand	Mild	LEF	35	41
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@@H](C)O	ZINC000853880862	FC	On-Demand	Mild	MMP13	20	41
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@@H](C)O	ZINC000853880862	FC	On-Demand	Mild	MMP12	57	40
C#CCOCCOC(=O)[C@@H](NS(=O)(=O)c1ccc(C)c(C)c1)[C@@H](C)O	ZINC000853880862	FC	On-Demand	Mild	LEF	35	41
Cc1oc(-c2ccccc2)nc1C(=O)OCc1nnc2n1CCOCC2	ZINC000853880871	FE	On-Demand	Anodyne	PPARG	49	39
Cc1oc(-c2ccccc2)nc1C(=O)OCc1nnc2n1CCOCC2	ZINC000853880871	FE	On-Demand	Anodyne	PPARA	45	37
Cc1oc(-c2ccccc2)nc1C(=O)OCc1nnc2n1CCOCC2	ZINC000853880871	FE	On-Demand	Anodyne	PDE8B	63	40
COc1c(C)ncnc1N1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853880890	GF	On-Demand	Anodyne	PDE3B	41	32
COc1c(C)ncnc1N1CCC([C@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853880890	GF	On-Demand	Anodyne	SIRT3	41	33
COc1c(C)ncnc1N1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853880891	GF	On-Demand	Anodyne	PDE3B	41	32
COc1c(C)ncnc1N1CCC([C@@H]2CCCN(C(=O)C(F)(F)F)C2)CC1	ZINC000853880891	GF	On-Demand	Anodyne	SIRT3	41	33
O=C(CCCOc1cccc(Br)c1)OCCOC(F)F	ZINC000853880933	FG	On-Demand	Anodyne	HMOX2	20	43
O=C1CCC2=C(CCN(C(=O)NCCNS(=O)(=O)c3cccnc3)C2)N1	ZINC000853880961	GB	On-Demand	Anodyne	NAMPT	48	36
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000853880972	FF	On-Demand	Anodyne	DPP7	42	36
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000853880972	FF	On-Demand	Anodyne	L3MBTL3	49	38
O=C(N1CCC[C@H](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1)C(F)(F)F	ZINC000853880983	GH	On-Demand	Bother	SSTR1	43	43
O=C(N1CCC[C@@H](C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1)C(F)(F)F	ZINC000853880984	GH	On-Demand	Bother	SSTR1	43	43
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000853880999	FF	On-Demand	Anodyne	DPP7	42	36
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2)C1	ZINC000853880999	FF	On-Demand	Anodyne	L3MBTL3	49	38
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853881006	DE	On-Demand	Anodyne	FKBP1A	55	43
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853881006	DE	On-Demand	Anodyne	PREP	15	52
CC(C)CN1CCC[C@@H](CNC(=O)NC[C@H](O)c2cccc3ccccc23)C1	ZINC000853881015	GH	On-Demand	Anodyne	HTR4	58	40
CC(C)CN1CCC[C@H](CNC(=O)NC[C@H](O)c2cccc3ccccc23)C1	ZINC000853881017	GH	On-Demand	Anodyne	HTR4	58	40
CC(C)CN1CCC[C@@H](CNC(=O)NC[C@@H](O)c2cccc3ccccc23)C1	ZINC000853881019	GH	On-Demand	Anodyne	HTR4	58	40
CC(C)CN1CCC[C@H](CNC(=O)NC[C@@H](O)c2cccc3ccccc23)C1	ZINC000853881021	GH	On-Demand	Anodyne	HTR4	58	40
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853881024	GC	On-Demand	Anodyne	CALCRL	30	41
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853881026	GC	On-Demand	Anodyne	CALCRL	30	41
O=C(N[C@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853881028	GC	On-Demand	Anodyne	CALCRL	30	41
C[C@@H]1CCN(c2cc(Cl)nc(N)n2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881029	FF	On-Demand	Anodyne	PDPK1	18	41
C[C@@H]1CCN(c2cc(Cl)nc(N)n2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881029	FF	On-Demand	Anodyne	CACNA1I	46	33
O=C(N[C@@H]1CCCN(CC(F)(F)F)C1=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853881031	GC	On-Demand	Anodyne	CALCRL	30	41
CCCOc1ccc(OCC(=O)OCc2nnc3n2CCOCC3)cc1	ZINC000853881037	FD	On-Demand	Anodyne	PLA2G4B	50	32
O=C(N1CCC[C@@H](C2CCN(c3ncccc3Cl)CC2)C1)C(F)(F)F	ZINC000853881061	GH	On-Demand	Anodyne	TRPV1	21	47
O=C(N1CCC[C@H](C2CCN(c3ncccc3Cl)CC2)C1)C(F)(F)F	ZINC000853881063	GH	On-Demand	Anodyne	TRPV1	21	47
O=C(N1CCC[C@@H](C2CCN(c3ncnc4sccc34)CC2)C1)C(F)(F)F	ZINC000853881075	GH	On-Demand	Anodyne	SIRT3	51	34
O=C(N1CCC[C@@H](C2CCN(c3ncnc4sccc34)CC2)C1)C(F)(F)F	ZINC000853881075	GH	On-Demand	Anodyne	SIRT2	43	32
O=C(N1CCC[C@H](C2CCN(c3ncnc4sccc34)CC2)C1)C(F)(F)F	ZINC000853881078	GH	On-Demand	Anodyne	SIRT3	51	34
O=C(N1CCC[C@H](C2CCN(c3ncnc4sccc34)CC2)C1)C(F)(F)F	ZINC000853881078	GH	On-Demand	Anodyne	SIRT2	43	32
O=C(OCCOC(F)F)c1ccc(OC(F)F)cc1	ZINC000853881091	CF	On-Demand	Anodyne	ACR	47	33
C[C@@H]1CCN(c2ncnc3n[nH]cc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881125	EE	On-Demand	Anodyne	SIRT3	44	40
C[C@@H]1CCN(c2ncnc3n[nH]cc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881125	EE	On-Demand	Anodyne	SIRT2	40	40
C[C@@H]1CCN(c2ncnc3n[nH]cc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881125	EE	On-Demand	Anodyne	SIRT1	37	40
O=C(CCc1c[nH]c2ccccc12)OCc1nnc2n1CCOCC2	ZINC000853881133	EE	On-Demand	Anodyne	GHSR	41	38
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	HTR1D	18	48
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	TACR1	20	41
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	CCKAR	33	41
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	MPO	78	42
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	NMBR	19	45
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	MMP11	50	32
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	CCKBR	41	35
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	GHSR	48	36
O=C(CCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853881146	CF	On-Demand	Anodyne	MMP9	17	44
COc1ccc(-c2nnc(SCC(=O)OCCOC(F)F)o2)cc1	ZINC000853881147	FF	On-Demand	Anodyne	GSK3A	16	41
COc1ccc(-c2nnc(SCC(=O)OCCOC(F)F)o2)cc1	ZINC000853881147	FF	On-Demand	Anodyne	ALOX15	45	39
C#CCOCCOC(=O)CNC(=O)COc1ccccc1	ZINC000853881150	CC	On-Demand	Mild	PLA2G4B	68	38
Cn1cnnc1SCC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853881168	GD	On-Demand	Anodyne	ENPP1	54	30
C[C@@H]1CCN(c2ncnc3[nH]ccc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881180	EG	On-Demand	Anodyne	AKT2	44	42
C[C@@H]1CCN(c2ncnc3[nH]ccc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881180	EG	On-Demand	Anodyne	JAK3	24	48
C[C@@H]1CCN(c2ncnc3[nH]ccc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881180	EG	On-Demand	Anodyne	JAK1	19	41
C[C@@H]1CCN(c2ncnc3[nH]ccc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881180	EG	On-Demand	Anodyne	SIRT3	44	40
C[C@@H]1CCN(c2ncnc3[nH]ccc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881180	EG	On-Demand	Anodyne	SIRT2	41	40
C[C@@H]1CCN(c2ncnc3[nH]ccc23)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853881180	EG	On-Demand	Anodyne	SIRT1	37	40
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881194	EE	On-Demand	Anodyne	FKBP1A	111	51
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881194	EE	On-Demand	Anodyne	CPT1A	46	34
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881194	EE	On-Demand	Anodyne	CPT2	40	34
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881194	EE	On-Demand	Anodyne	PREP	92	51
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881194	EE	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881195	EE	On-Demand	Anodyne	FKBP1A	111	51
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881195	EE	On-Demand	Anodyne	CPT1A	46	34
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881195	EE	On-Demand	Anodyne	CPT2	40	34
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881195	EE	On-Demand	Anodyne	PREP	92	51
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1ccccc1	ZINC000853881195	EE	On-Demand	Anodyne	AMY2	44	30
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)OCCOC(F)F	ZINC000853881211	GE	On-Demand	Anodyne	F13A1	45	38
O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)OCCOC(F)F	ZINC000853881211	GE	On-Demand	Anodyne	NAMPT	27	40
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881240	GC	On-Demand	Mild	ADAM17	19	42
C#CCOCCOC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881241	GC	On-Demand	Mild	ADAM17	19	42
Nc1cc([N+](=O)[O-])ccc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853881273	CE	On-Demand	Bother	CACNA1C	47	41
Nc1cc([N+](=O)[O-])ccc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853881273	CE	On-Demand	Bother	CACNA1D	77	41
Nc1cc([N+](=O)[O-])ccc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853881274	CE	On-Demand	Bother	CACNA1C	47	41
Nc1cc([N+](=O)[O-])ccc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853881274	CE	On-Demand	Bother	CACNA1D	77	41
Nc1cc([N+](=O)[O-])ccc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853881275	CE	On-Demand	Bother	CACNA1C	47	41
Nc1cc([N+](=O)[O-])ccc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853881275	CE	On-Demand	Bother	CACNA1D	77	41
N#Cc1ccc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1Cl	ZINC000853881288	GI	On-Demand	Mild	PGR	18	42
N#Cc1ccc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1Cl	ZINC000853881288	GI	On-Demand	Mild	NR3C2	36	46
N#Cc1ccc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1Cl	ZINC000853881288	GI	On-Demand	Mild	AR	23	53
N#Cc1ccc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1Cl	ZINC000853881289	GI	On-Demand	Mild	PGR	18	42
N#Cc1ccc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1Cl	ZINC000853881289	GI	On-Demand	Mild	NR3C2	36	46
N#Cc1ccc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)cc1Cl	ZINC000853881289	GI	On-Demand	Mild	AR	23	53
CC[C@@H](O)CNC(=O)NCc1ccc(OC)c(C#N)c1	ZINC000853881307	CD	On-Demand	Mild	ADRB1	41	35
O=C(OCCOC(F)F)c1cc(S(=O)(=O)N2CCOCC2)ccc1F	ZINC000853881316	GD	On-Demand	Anodyne	PKM	40	36
C#CCOCCOC(=O)c1cc(OC)c(OC)cc1NC(=O)C1CCCCC1	ZINC000853881341	GG	On-Demand	Mild	HTR4	38	41
C#CCOCCOC(=O)c1cc(OC)c(OC)cc1NC(=O)C1CCCCC1	ZINC000853881341	GG	On-Demand	Mild	STK17B	43	42
O=C(COc1ccc2ccc(=O)oc2c1)OCCOC(F)F	ZINC000853881343	DD	On-Demand	Anodyne	ALDH2	44	36
O=C(COc1ccc2ccc(=O)oc2c1)OCCOC(F)F	ZINC000853881343	DD	On-Demand	Anodyne	MAOA	24	42
O=C(COc1ccc2ccc(=O)oc2c1)OCCOC(F)F	ZINC000853881343	DD	On-Demand	Anodyne	MAOB	24	50
NC(=O)c1ccc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)nn1	ZINC000853881357	GD	On-Demand	Anodyne	SCD1	46	48
NC(=O)c1ccc(N2CCC([C@@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)nn1	ZINC000853881357	GD	On-Demand	Anodyne	SCD	31	41
NC(=O)c1ccc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)nn1	ZINC000853881358	GD	On-Demand	Anodyne	SCD1	46	48
NC(=O)c1ccc(N2CCC([C@H]3CCCN(C(=O)C(F)(F)F)C3)CC2)nn1	ZINC000853881358	GD	On-Demand	Anodyne	SCD	31	41
C#CCOCCOC(=O)Cc1coc2cc(O)ccc12	ZINC000853881361	CD	On-Demand	Mild	ALDH2	79	36
CC(=O)N/C(=C/c1ccccc1)C(=O)OCCOC(F)F	ZINC000853881417	CD	On-Demand	Anodyne	TLR4	19	41
CC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853881418	CE	On-Demand	Anodyne	KCNK3	108	35
CC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853881418	CE	On-Demand	Anodyne	KCNK9	75	35
CC(=O)N/C(=C\c1ccccc1)C(=O)OCCOC(F)F	ZINC000853881419	CD	On-Demand	Anodyne	TLR4	19	41
Cc1cccc(C(=O)OCCOC(F)F)c1[N+](=O)[O-]	ZINC000853881492	CE	On-Demand	Bother	CACNA1D	45	37
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881498	GE	On-Demand	Anodyne	MMP13	42	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881498	GE	On-Demand	Anodyne	ADAM17	24	47
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881498	GE	On-Demand	Anodyne	MMP2	23	47
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881498	GE	On-Demand	Anodyne	MMP3	53	40
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881498	GE	On-Demand	Anodyne	MMP7	44	37
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881498	GE	On-Demand	Anodyne	MMP1	41	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881499	GE	On-Demand	Anodyne	MMP13	42	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881499	GE	On-Demand	Anodyne	ADAM17	24	47
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881499	GE	On-Demand	Anodyne	MMP2	23	47
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881499	GE	On-Demand	Anodyne	MMP3	53	40
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881499	GE	On-Demand	Anodyne	MMP7	44	37
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881499	GE	On-Demand	Anodyne	MMP1	41	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881533	GE	On-Demand	Anodyne	MMP13	42	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881533	GE	On-Demand	Anodyne	ADAM17	24	47
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881533	GE	On-Demand	Anodyne	MMP2	23	47
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881533	GE	On-Demand	Anodyne	MMP3	53	40
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881533	GE	On-Demand	Anodyne	MMP7	44	37
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881533	GE	On-Demand	Anodyne	MMP1	41	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881535	GE	On-Demand	Anodyne	MMP13	42	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881535	GE	On-Demand	Anodyne	ADAM17	24	47
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881535	GE	On-Demand	Anodyne	MMP2	23	47
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881535	GE	On-Demand	Anodyne	MMP3	53	40
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881535	GE	On-Demand	Anodyne	MMP7	44	37
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1	ZINC000853881535	GE	On-Demand	Anodyne	MMP1	41	41
CC(=O)Nc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853881581	ED	On-Demand	Anodyne	CASR	19	43
CCOc1ccc(OCC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853881628	GF	On-Demand	Anodyne	SIGMAR1	17	41
CCOc1ccc(OCC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853881628	GF	On-Demand	Anodyne	MMP1	20	47
CCOc1ccc(OCC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853881628	GF	On-Demand	Anodyne	PROKR1	52	31
CCOc1ccc(OCC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853881631	GF	On-Demand	Anodyne	SIGMAR1	17	41
CCOc1ccc(OCC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853881631	GF	On-Demand	Anodyne	MMP1	20	47
CCOc1ccc(OCC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853881631	GF	On-Demand	Anodyne	PROKR1	52	31
C[C@@H]1[C@@H](C(F)(F)F)OCCN1c1ccc([N+](=O)[O-])c2nonc12	ZINC000853881645	EE	On-Demand	Bother	GSTM2	96	42
C[C@@H]1[C@@H](C(F)(F)F)OCCN1c1ccc([N+](=O)[O-])c2nonc12	ZINC000853881645	EE	On-Demand	Bother	GSTP1	54	42
C[C@H]1[C@H](C(F)(F)F)OCCN1c1ccc([N+](=O)[O-])c2nonc12	ZINC000853881651	EE	On-Demand	Bother	GSTM2	96	42
C[C@H]1[C@H](C(F)(F)F)OCCN1c1ccc([N+](=O)[O-])c2nonc12	ZINC000853881651	EE	On-Demand	Bother	GSTP1	54	42
C#CCOCCOC(=O)c1cc(OC)c(OC)cc1NC(=O)C1CC1	ZINC000853881668	ED	On-Demand	Mild	HTR4	40	42
C[C@H](NC(=O)c1ccco1)C(=O)OCCOC(F)F	ZINC000853881687	CD	On-Demand	Anodyne	CAPN2	22	44
CC(C)c1cccc(COC(=O)[C@H](C)NC(=O)c2ccco2)c1	ZINC000853881745	DG	On-Demand	Anodyne	CAPNS1	46	30
CC(C)c1cccc(COC(=O)[C@H](C)NC(=O)c2ccco2)c1	ZINC000853881745	DG	On-Demand	Anodyne	CAPN1	30	40
CC(C)c1cccc(COC(=O)[C@H](C)NC(=O)c2ccco2)c1	ZINC000853881745	DG	On-Demand	Anodyne	CAPN2	47	40
CCOc1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853881755	CE	On-Demand	Anodyne	PLA2G4B	78	42
CCOc1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853881755	CE	On-Demand	Anodyne	PPO2	24	40
Cc1cc(OCC(=O)OCCOC(F)F)ccc1C(C)C	ZINC000853881784	DG	On-Demand	Anodyne	THRA	27	40
Cc1cc(OCC(=O)OCCOC(F)F)ccc1C(C)C	ZINC000853881784	DG	On-Demand	Anodyne	THRB	23	40
Cc1cc(OCC(=O)OCCOC(F)F)ccc1C(C)C	ZINC000853881784	DG	On-Demand	Anodyne	PLA2G4B	53	34
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1C	ZINC000853881792	CC	On-Demand	Mild	CA2	56	49
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1C	ZINC000853881792	CC	On-Demand	Mild	CA1	47	36
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1C	ZINC000853881792	CC	On-Demand	Mild	CA7	39	43
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1C	ZINC000853881792	CC	On-Demand	Mild	CA4	55	37
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1C	ZINC000853881792	CC	On-Demand	Mild	CA14	26	49
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1C	ZINC000853881792	CC	On-Demand	Mild	CA12	29	49
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1C	ZINC000853881792	CC	On-Demand	Mild	CA9	30	49
O=C(OCc1nnc2n1CCOCC2)C1(c2ccccc2)CC1	ZINC000853881824	DD	On-Demand	Anodyne	SLC12A5	47	34
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)OCCOC(F)F	ZINC000853881885	FE	On-Demand	Anodyne	F2	20	43
O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)OCCOC(F)F	ZINC000853881885	FE	On-Demand	Anodyne	TRY2_BOVIN	65	39
CCc1nc2ccccc2c(C(=O)OCCOC(F)F)c1C	ZINC000853881886	DH	On-Demand	Anodyne	TSPO	23	43
CCc1nc2ccccc2c(C(=O)OCCOC(F)F)c1C	ZINC000853881886	DH	On-Demand	Anodyne	TACR3	54	39
COc1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853881906	CD	On-Demand	Anodyne	PLA2G4B	86	37
COc1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853881906	CD	On-Demand	Anodyne	AOC3	30	47
O=C(Cc1coc2cc(O)ccc12)OCCOC(F)F	ZINC000853881922	CE	On-Demand	Anodyne	ALDH2	88	36
N#Cc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853881943	BD	On-Demand	Mild	ACR	19	40
O=C(Cn1c(COc2ccccc2)nc2ccccc21)OCCOC(F)F	ZINC000853881948	GG	On-Demand	Anodyne	NPY1R	40	33
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000853881958	EE	On-Demand	Anodyne	CA2	17	48
Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)OCCOC(F)F	ZINC000853881961	GI	On-Demand	Anodyne	NR1H4	41	33
CC(=O)N[C@@H](C(=O)OCc1cccc(C(C)C)c1)C(C)C	ZINC000853881969	CG	On-Demand	Anodyne	CTSB	28	42
CC(=O)N[C@@H](C(=O)OCc1cccc(C(C)C)c1)C(C)C	ZINC000853881969	CG	On-Demand	Anodyne	PAPA1_CARPA	51	52
CC(=O)N[C@@H](C(=O)OCc1cccc(C(C)C)c1)C(C)C	ZINC000853881969	CG	On-Demand	Anodyne	PGA	22	41
CC(=O)N[C@@H](C(=O)OCc1cccc(C(C)C)c1)C(C)C	ZINC000853881969	CG	On-Demand	Anodyne	CAPN2	41	38
CC(C)c1cccc(COC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853881977	EH	On-Demand	Anodyne	PTGS2	18	42
CC(C)c1cccc(COC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853881977	EH	On-Demand	Anodyne	LOX1.1	49	42
CC(C)c1cccc(COC(=O)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853881977	EH	On-Demand	Anodyne	O49150_SOLTU	47	42
O=C(CSCc1cccc(Cl)c1)OCCOC(F)F	ZINC000853882011	DG	On-Demand	Anodyne	CACNA2D1	18	50
O=C(COc1ccc(F)cc1)OCCOC(F)F	ZINC000853882013	CD	On-Demand	Anodyne	PLA2G4B	75	35
O=C(COc1ccc2ccccc2c1)OCCOC(F)F	ZINC000853882029	CG	On-Demand	Anodyne	PLA2G4B	51	35
O=C(CCNS(=O)(=O)c1cccc(Cl)c1)OCCOC(F)F	ZINC000853882100	FD	On-Demand	Anodyne	TBXA2R	45	36
O=C(OCCOC(F)F)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000853882123	FF	On-Demand	Anodyne	ITGAL	51	38
O=C(OCCOC(F)F)C1CCN(C(=O)/C=C\c2ccccc2)CC1	ZINC000853882123	FF	On-Demand	Anodyne	CCR2	19	41
O=C(OCCOC(F)F)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000853882124	FF	On-Demand	Anodyne	ITGAL	51	38
O=C(OCCOC(F)F)C1CCN(C(=O)/C=C/c2ccccc2)CC1	ZINC000853882124	FF	On-Demand	Anodyne	CCR2	19	41
Cc1ccc(C(=O)OCc2nnc3n2CCOCC3)cc1NC(=O)c1ccco1	ZINC000853882188	GE	On-Demand	Anodyne	MAPK14	16	40
O=C(Cc1cccs1)OCCOC(F)F	ZINC000853882209	BE	On-Demand	Anodyne	CA5B	32	40
O=C(Cc1cccs1)OCCOC(F)F	ZINC000853882209	BE	On-Demand	Anodyne	CA5A	31	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	PRSS1	15	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	ACE	36	43
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	MME	103	39
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	ANPEP	85	37
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CMA1	24	41
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTRA_BOVIN	17	55
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	FCER2	61	34
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTSB	47	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	PAPA1_CARPA	53	50
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CYSP_TRYCR	53	39
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTSG	30	41
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTSK	20	44
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTSL	47	50
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	NPFFR2	39	45
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTRB1	49	49
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CAPNS1	60	34
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CELA2A	29	44
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTSS	23	50
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CAPN1	65	47
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CAPN2	55	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	ACE2	69	39
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	LAP3	45	36
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTSV	18	41
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	PIN1	24	45
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	MMP1	20	45
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	FPR1	40	36
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	CTRB_BOVIN	70	44
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	PSMB5	16	46
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	BLA1_STEMA	62	39
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882253	FF	On-Demand	Anodyne	NPFFR1	48	45
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	PRSS1	15	40
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	ACE	36	43
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	MME	103	39
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	ANPEP	85	37
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CMA1	24	41
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTRA_BOVIN	17	55
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	FCER2	61	34
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTSB	47	40
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	PAPA1_CARPA	53	50
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CYSP_TRYCR	53	39
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTSG	30	41
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTSK	20	44
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTSL	47	50
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	NPFFR2	39	45
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTRB1	49	49
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CAPNS1	60	34
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CELA2A	29	44
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTSS	23	50
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CAPN1	65	47
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CAPN2	55	40
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	ACE2	69	39
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	LAP3	45	36
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTSV	18	41
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	PIN1	24	45
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	MMP1	20	45
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	FPR1	40	36
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	CTRB_BOVIN	70	44
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	PSMB5	16	46
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	BLA1_STEMA	62	39
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882255	FF	On-Demand	Anodyne	NPFFR1	48	45
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	HTR1D	18	46
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	TACR1	17	40
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	MPO	92	45
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	NMBR	15	44
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	MMP11	47	31
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	GHSR	44	37
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	MMP9	16	43
O=C(CCCc1c[nH]c2ccccc12)OCCOC(F)F	ZINC000853882271	CG	On-Demand	Anodyne	MC1R	32	42
O=C(COc1ccccc1)OCCOC(F)F	ZINC000853882273	BD	On-Demand	Anodyne	PLA2G4B	90	39
O=C(COc1ccccc1)OCCOC(F)F	ZINC000853882273	BD	On-Demand	Anodyne	AOC3	21	44
O=C(COc1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853882297	DF	On-Demand	Anodyne	PLA2G4B	41	37
O=C(COc1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853882297	DF	On-Demand	Anodyne	GALR3	50	32
O=C(COc1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853882297	DF	On-Demand	Anodyne	PDS	52	52
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853882325	FD	On-Demand	Anodyne	CA2	17	41
CC(=O)c1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853882325	FD	On-Demand	Anodyne	TBXA2R	42	34
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(OC)c(C#N)c2)C1	ZINC000853882328	EE	On-Demand	Mild	CCR5	23	49
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(OC)c(C#N)c2)C1	ZINC000853882329	EE	On-Demand	Mild	CCR5	23	49
O=C(Cc1coc2cc(O)ccc12)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882338	CG	On-Demand	Anodyne	ALDH2	70	33
O=C(Cc1coc2cc(O)ccc12)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882339	CG	On-Demand	Anodyne	ALDH2	70	33
O=C(Cc1coc2cc(O)ccc12)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882340	CG	On-Demand	Anodyne	ALDH2	70	33
CC(=O)c1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853882374	FC	On-Demand	Anodyne	CA2	24	43
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882382	CF	On-Demand	Bother	CACNA1D	54	36
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882382	CF	On-Demand	Bother	SNCA	44	34
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882387	DG	On-Demand	Anodyne	UTS2	46	37
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882388	DG	On-Demand	Anodyne	UTS2	46	37
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882389	DG	On-Demand	Anodyne	UTS2	46	37
C#CCOCCOC(=O)[C@H](C)NC(=O)c1ccc(Cl)cc1	ZINC000853882390	DD	On-Demand	Mild	UTS2	48	39
COc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853882415	DD	On-Demand	Anodyne	DRD4	48	37
C#CCOCCOC(=O)c1ccc(O)c(Cl)c1	ZINC000853882433	CD	On-Demand	Mild	ADCYAP1R1	58	33
O=C(CCc1ccc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853882440	DH	On-Demand	Anodyne	CYP2E1	18	43
CCOc1ccccc1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882447	GF	On-Demand	Anodyne	SIGMAR1	21	43
CCOc1ccccc1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882447	GF	On-Demand	Anodyne	SSTR5	43	39
CCOc1ccccc1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882447	GF	On-Demand	Anodyne	MMP1	15	43
CCOc1ccccc1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882448	GF	On-Demand	Anodyne	SIGMAR1	21	43
CCOc1ccccc1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882448	GF	On-Demand	Anodyne	SSTR5	43	39
CCOc1ccccc1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882448	GF	On-Demand	Anodyne	MMP1	15	43
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853882456	DD	On-Demand	Bother	CACNA1C	45	37
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853882456	DD	On-Demand	Bother	CACNA1D	73	36
COc1cccc(OC)c1C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882462	DE	On-Demand	Bother	CACNA1D	65	35
O=C(OCCOC(F)F)c1c(Cl)cccc1Cl	ZINC000853882466	CG	On-Demand	Anodyne	ELANE	23	41
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000853882476	FF	On-Demand	Anodyne	FKBP1A	36	47
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)C12CC3CC(CC(C3)C1)C2	ZINC000853882477	FF	On-Demand	Anodyne	FKBP1A	36	47
CCCCCOc1ccc(C(=O)OCc2nnc3n2CCOCC3)cc1	ZINC000853882488	FF	On-Demand	Anodyne	PLA2G4B	83	39
C#CCOCCOC(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882495	CE	On-Demand	Mild	SNCA	42	31
Cc1cc(OCC(=O)OCCOC(F)F)ccc1Cl	ZINC000853882508	CF	On-Demand	Anodyne	PLA2G4B	44	33
Cc1cc(OCC(=O)OCCOC(F)F)ccc1Cl	ZINC000853882508	CF	On-Demand	Anodyne	MCL1	22	43
O=C(OCc1nnc2n1CCOCC2)c1cccc([N+](=O)[O-])c1	ZINC000853882514	DD	On-Demand	Bother	CACNA1C	59	38
O=C(OCc1nnc2n1CCOCC2)c1cccc([N+](=O)[O-])c1	ZINC000853882514	DD	On-Demand	Bother	CACNA1D	84	38
C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCCOC(F)F	ZINC000853882516	DE	On-Demand	Anodyne	UTS2	48	38
O=C(CNC(=O)c1ccccc1)OCCOC(F)F	ZINC000853882520	CD	On-Demand	Anodyne	CA2	16	45
O=C(CNC(=O)c1ccccc1)OCCOC(F)F	ZINC000853882520	CD	On-Demand	Anodyne	CTRB1	34	41
CC[C@@](C)(NC(=O)NCc1ccc(OC)c(C#N)c1)C1CC1	ZINC000853882525	DF	On-Demand	Mild	MT-ND1	22	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	ACE	20	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	SSTR2	49	42
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	OPRM1	15	57
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MME	28	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	EDNRB	52	38
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	EDNRA	37	50
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	TACR1	38	64
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MC4R	54	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	CCKAR	124	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	CTSL	25	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	BRS3	30	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	NMBR	27	54
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MC3R	73	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MC5R	81	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MMP2	30	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MMP8	38	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MMP14	27	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	GRPR	77	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	ECE1	66	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	LNPEP	20	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	SSTR3	23	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MMP11	104	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	CCKBR	97	49
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	GHSR	78	52
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MMP9	28	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MC1R	107	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	AKT1	26	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MMP7	15	42
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	MMP1	22	45
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	NPR	31	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	KISS1R	74	36
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	ERAP2	47	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCCOC(F)F	ZINC000853882528	ED	On-Demand	Anodyne	HPN	21	41
O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)OCCOC(F)F	ZINC000853882533	GF	On-Demand	Anodyne	NAMPT	26	40
COc1cccc(OC)c1C(=O)OCCOC(F)F	ZINC000853882554	CE	On-Demand	Anodyne	ALS	46	37
COc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853882566	BE	On-Demand	Anodyne	DRD4	44	34
COc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853882566	BE	On-Demand	Anodyne	MTNR1A	42	43
COc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853882566	BE	On-Demand	Anodyne	MTNR1B	42	43
COc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853882566	BE	On-Demand	Anodyne	ACR	20	40
Cc1ccc(C(=O)OCCOC(F)F)cc1S(=O)(=O)N1CCOCC1	ZINC000853882580	GD	On-Demand	Anodyne	CNR2	18	55
O=C(OCCOC(F)F)c1cc2c(F)cccc2s1	ZINC000853882583	CG	On-Demand	Anodyne	F9	42	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882591	CG	On-Demand	Bother	CACNA1C	49	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882591	CG	On-Demand	Bother	CACNA1D	83	41
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882592	CG	On-Demand	Bother	CACNA1C	49	41
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882592	CG	On-Demand	Bother	CACNA1D	83	41
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882593	CG	On-Demand	Bother	CACNA1C	49	41
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1Cl	ZINC000853882593	CG	On-Demand	Bother	CACNA1D	83	41
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000853882621	FE	On-Demand	Anodyne	PKM	24	40
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)N2CCCCC2)c1	ZINC000853882621	FE	On-Demand	Anodyne	AKR1C3	64	42
O=C(OCCOC(F)F)c1ccco1	ZINC000853882626	BD	On-Demand	Anodyne	GLRA1	15	42
O=C(Cc1ccccc1[N+](=O)[O-])OCCOC(F)F	ZINC000853882635	CD	On-Demand	Bother	COLA	117	40
C#CCOCCOC(=O)c1cc(Cl)c(N)cc1OC	ZINC000853882654	CD	On-Demand	Mild	HTR4	116	66
O=C(OCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853882668	CD	On-Demand	Bother	CACNA1C	64	43
O=C(OCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853882668	CD	On-Demand	Bother	CACNA1D	99	43
O=C(OCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853882668	CD	On-Demand	Bother	ACR	17	40
O=C(OCCOC(F)F)c1c2c(nc3ccccc13)CCC2	ZINC000853882677	DG	On-Demand	Anodyne	ACHE	84	46
O=C(OCCOC(F)F)c1c2c(nc3ccccc13)CCC2	ZINC000853882677	DG	On-Demand	Anodyne	BCHE	128	46
O=C(OCCOC(F)F)c1ccc([N+](=O)[O-])cc1Cl	ZINC000853882681	CF	On-Demand	Bother	CACNA1D	47	35
O=C(OCCOC(F)F)c1ccc([N+](=O)[O-])cc1Cl	ZINC000853882681	CF	On-Demand	Bother	SNCA	44	33
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882685	FH	On-Demand	Anodyne	SLC6A3	15	51
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882685	FH	On-Demand	Anodyne	KCNQ2	23	40
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882685	FH	On-Demand	Anodyne	SIGMAR1	20	43
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882685	FH	On-Demand	Anodyne	CCR5	16	41
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882685	FH	On-Demand	Anodyne	MMP1	22	41
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882687	FH	On-Demand	Anodyne	SLC6A3	15	51
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882687	FH	On-Demand	Anodyne	KCNQ2	23	40
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882687	FH	On-Demand	Anodyne	SIGMAR1	20	43
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882687	FH	On-Demand	Anodyne	CCR5	16	41
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853882687	FH	On-Demand	Anodyne	MMP1	22	41
O=C(COc1cccc2ccccc12)OCCOC(F)F	ZINC000853882710	CG	On-Demand	Anodyne	ALB	22	40
O=C(COc1cccc2ccccc12)OCCOC(F)F	ZINC000853882710	CG	On-Demand	Anodyne	MCL1	38	40
Cc1ccc(C(=O)OCCOC(F)F)cc1S(=O)(=O)N1CCCCC1	ZINC000853882743	GF	On-Demand	Anodyne	CNR2	15	57
COc1cc(N)c(Cl)cc1C(=O)OCCOC(F)F	ZINC000853882757	CE	On-Demand	Anodyne	HTR4	120	65
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	MME	65	38
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	ANPEP	48	34
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	FCER2	46	37
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	CYSP_TRYCR	43	34
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	CAPNS1	56	32
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	CAPN1	41	41
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	ACE2	50	36
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	CTRB_BOVIN	50	36
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccs1	ZINC000853882764	FF	On-Demand	Anodyne	BLA1_STEMA	54	33
O=C(CCc1ccccc1)OCCOC(F)F	ZINC000853882780	BE	On-Demand	Anodyne	FFAR1	43	40
O=C(CCc1ccccc1)OCCOC(F)F	ZINC000853882780	BE	On-Demand	Anodyne	AKR1C3	18	40
N#Cc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853882787	BD	On-Demand	Mild	ACR	15	42
N#Cc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853882787	BD	On-Demand	Mild	CTRB_BOVIN	46	34
O=C(OCCOC(F)F)c1ccccn1	ZINC000853882793	BD	On-Demand	Anodyne	GRM4	26	43
CC(C)c1cccc(COC(=O)c2ccccn2)c1	ZINC000853882798	CH	On-Demand	Anodyne	PLM1_PLAFA	47	35
O=C(Cc1ccc(Cl)c(Cl)c1)OCCOC(F)F	ZINC000853882801	CG	On-Demand	Anodyne	OPRK1	18	40
O=C(Cc1ccc(Cl)c(Cl)c1)OCCOC(F)F	ZINC000853882801	CG	On-Demand	Anodyne	TPSAB1	40	32
O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)OCCOC(F)F	ZINC000853882802	GD	On-Demand	Anodyne	NAMPT	19	40
CN(C)S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853882804	DD	On-Demand	Anodyne	CA2	18	44
CN(C)S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853882804	DD	On-Demand	Anodyne	CA14	15	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	ACE	19	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MME	25	42
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	EDNRB	54	36
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	EDNRA	31	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	TACR1	31	60
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MC4R	44	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	CCKAR	99	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	BRS3	26	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	NMBR	46	29
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MC3R	66	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MC5R	69	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MMP2	26	45
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	GRPR	89	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	ECE1	61	42
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	LNPEP	19	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MMP11	82	38
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	CCKBR	59	42
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	GHSR	61	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MMP9	24	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	MC1R	90	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	AKT1	40	35
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	NPR	27	42
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	KISS1R	67	35
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853882808	GE	On-Demand	Bother	ERAP2	42	40
O=C(CCOc1ccccc1)OCCOC(F)F	ZINC000853882823	CE	On-Demand	Anodyne	LTA4H	37	43
O=C(CCOc1ccccc1)OCCOC(F)F	ZINC000853882823	CE	On-Demand	Anodyne	PLA2G4B	64	33
COc1cc(N)c(Cl)cc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882836	CG	On-Demand	Anodyne	HTR4	132	62
COc1cc(N)c(Cl)cc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882837	CG	On-Demand	Anodyne	HTR4	132	62
COc1cc(N)c(Cl)cc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882838	CG	On-Demand	Anodyne	HTR4	132	62
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	ACE	21	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	SSTR2	54	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	OPRM1	15	55
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	GHRHR	27	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MME	28	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	EDNRB	51	37
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	EDNRA	40	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	TACR1	39	62
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MC4R	53	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	CCKAR	134	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	BRS3	28	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	NMBR	41	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MC3R	72	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MC5R	78	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MMP2	29	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MMP8	35	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MMP14	23	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	GRPR	78	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	ECE1	67	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	LNPEP	19	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	SSTR3	23	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MMP11	88	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	CCKBR	120	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	GHSR	77	51
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MMP9	27	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MC1R	104	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	C5AR1	37	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	MMP1	22	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	NPR	30	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	KISS1R	71	34
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	ERAP2	44	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853882840	EF	On-Demand	Anodyne	HPN	21	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	ACE	21	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	SSTR2	54	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	OPRM1	15	55
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	GHRHR	27	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MME	28	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	EDNRB	51	37
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	EDNRA	40	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	TACR1	39	62
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MC4R	53	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	CCKAR	134	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	BRS3	28	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	NMBR	41	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MC3R	72	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MC5R	78	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MMP2	29	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MMP8	35	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MMP14	23	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	GRPR	78	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	ECE1	67	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	LNPEP	19	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	SSTR3	23	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MMP11	88	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	CCKBR	120	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	GHSR	77	51
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MMP9	27	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MC1R	104	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	C5AR1	37	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	MMP1	22	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	NPR	30	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	KISS1R	71	34
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	ERAP2	44	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853882841	EF	On-Demand	Anodyne	HPN	21	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	ACE	21	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	SSTR2	54	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	OPRM1	15	55
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	GHRHR	27	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MME	28	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	EDNRB	51	37
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	EDNRA	40	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	TACR1	39	62
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MC4R	53	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	CCKAR	134	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	BRS3	28	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	NMBR	41	48
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MC3R	72	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MC5R	78	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MMP2	29	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MMP8	35	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MMP14	23	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	GRPR	78	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	ECE1	67	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	LNPEP	19	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	SSTR3	23	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MMP11	88	41
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	CCKBR	120	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	GHSR	77	51
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MMP9	27	44
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MC1R	104	47
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	C5AR1	37	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	MMP1	22	43
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	NPR	30	46
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	KISS1R	71	34
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	ERAP2	44	40
CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853882842	EF	On-Demand	Anodyne	HPN	21	40
N#Cc1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853882853	CD	On-Demand	Mild	PLA2G4B	68	33
O=C(COc1ccc(Br)cc1)OCCOC(F)F	ZINC000853882855	EF	On-Demand	Anodyne	PLA2G4B	70	34
O=C(COc1cccc(Br)c1)OCCOC(F)F	ZINC000853882865	EF	On-Demand	Anodyne	PDS	33	40
O=C(OCCOC(F)F)c1ccc(O)c(Cl)c1	ZINC000853882878	CE	On-Demand	Anodyne	ADCYAP1R1	54	32
COc1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853882886	CE	On-Demand	Anodyne	PLA2G4B	58	32
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)N2CCOCC2)c1	ZINC000853882903	FD	On-Demand	Anodyne	AKR1C3	59	44
O=C(OCc1nnc2n1CCOCC2)c1c2c(nc3ccccc13)CCC2	ZINC000853882906	FE	On-Demand	Anodyne	ACHE	67	41
O=C(OCc1nnc2n1CCOCC2)c1c2c(nc3ccccc13)CCC2	ZINC000853882906	FE	On-Demand	Anodyne	BCHE	97	41
CC[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853882933	CF	On-Demand	Anodyne	CHRM4	23	42
N#Cc1ccccc1OCC(=O)OCCOC(F)F	ZINC000853882940	CD	On-Demand	Mild	ADRB1	48	38
O=C(OCCOC(F)F)c1ccc2c(c1)OCO2	ZINC000853882948	CD	On-Demand	Anodyne	EDNRA	18	40
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	DRD4	17	43
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	HCRTR1	19	40
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	SIGMAR1	22	43
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	SSTR5	45	37
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	HCRTR2	20	40
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	MMP1	15	41
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	HCN1	56	35
CCOc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882953	FG	On-Demand	Anodyne	HCN4	45	35
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	DRD4	17	43
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	HCRTR1	19	40
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	SIGMAR1	22	43
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	SSTR5	45	37
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	HCRTR2	20	40
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	MMP1	15	41
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	HCN1	56	35
CCOc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853882954	FG	On-Demand	Anodyne	HCN4	45	35
CC(C)c1cccc(COC(=O)C2CC2)c1	ZINC000853882957	BG	On-Demand	Anodyne	AMY2	43	30
O=C(OCCOC(F)F)c1ccc(F)cc1F	ZINC000853882962	CE	On-Demand	Anodyne	CES2	15	43
O=C(/C=C\c1ccccc1)OCCOC(F)F	ZINC000853882965	BE	On-Demand	Anodyne	F3	18	44
O=C(/C=C\c1ccccc1)OCCOC(F)F	ZINC000853882965	BE	On-Demand	Anodyne	AKR1B10	39	56
O=C(/C=C/c1ccccc1)OCCOC(F)F	ZINC000853882966	BE	On-Demand	Anodyne	F3	18	44
O=C(/C=C/c1ccccc1)OCCOC(F)F	ZINC000853882966	BE	On-Demand	Anodyne	AKR1B10	39	56
CC(=O)c1cccc(OCC(=O)OCCOC(F)F)c1	ZINC000853882974	CE	On-Demand	Anodyne	PLA2G4B	49	44
O=C(OCCOC(F)F)c1cc(Cl)ccc1O	ZINC000853882977	CE	On-Demand	Anodyne	KCNMA1	23	40
O=C(/C=C\c1ccc(Cl)cc1)OCCOC(F)F	ZINC000853882978	CG	On-Demand	Anodyne	AKR1B10	34	47
O=C(/C=C/c1ccc(Cl)cc1)OCCOC(F)F	ZINC000853882979	CG	On-Demand	Anodyne	AKR1B10	34	47
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)N2CCCCCC2)c1	ZINC000853882991	GF	On-Demand	Anodyne	PKM	24	40
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)N2CCCCCC2)c1	ZINC000853882991	GF	On-Demand	Anodyne	AKR1C3	64	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCOc1ncccc1F	ZINC000853882998	GE	On-Demand	Anodyne	GPR119	40	39
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)OCCOC(F)F)c2)C[C@H](C)O1	ZINC000853883009	GD	On-Demand	Anodyne	AKR1C3	53	36
C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)OCCOC(F)F)c2)C[C@@H](C)O1	ZINC000853883010	GD	On-Demand	Anodyne	AKR1C3	53	36
C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)OCCOC(F)F)c2)C[C@@H](C)O1	ZINC000853883011	GD	On-Demand	Anodyne	AKR1C3	53	36
C#CCOCCOC(=O)c1ccccc1C(=O)N(C)C1CCCCC1	ZINC000853883032	EF	On-Demand	Mild	AMY2	47	33
CCOc1ccccc1C(=O)NCC(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853883047	FD	On-Demand	Bother	HCN1	59	39
CCOc1ccccc1C(=O)NCC(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853883047	FD	On-Demand	Bother	HCN4	44	34
C#CCOCCOC(=O)c1cccc(S(=O)(=O)N2CCN(C(C)=O)CC2)c1	ZINC000853883067	GC	On-Demand	Mild	F13A1	40	37
C#CCOCCOC(=O)c1cccc(S(=O)(=O)N2CCN(C(C)=O)CC2)c1	ZINC000853883067	GC	On-Demand	Mild	AKR1C3	57	42
O=C(/C=C/c1ccsc1)OCCOC(F)F	ZINC000853883074	BF	On-Demand	Anodyne	AKR1B10	34	42
O=C(/C=C\c1ccsc1)OCCOC(F)F	ZINC000853883075	BF	On-Demand	Anodyne	AKR1B10	34	42
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000853883104	ED	On-Demand	Anodyne	SFRP1	71	36
CC(C)c1cccc(COC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)c1	ZINC000853883117	FD	On-Demand	Anodyne	MAOB	15	45
C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)OCCOC(F)F)c2)C1	ZINC000853883137	GF	On-Demand	Anodyne	AKR1C3	54	37
N#CCC(=O)Nc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853883157	CF	On-Demand	Mild	ACR	62	37
N#CCC(=O)Nc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853883158	CF	On-Demand	Mild	ACR	62	37
N#CCC(=O)Nc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853883160	CF	On-Demand	Mild	ACR	62	37
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000853883204	ED	On-Demand	Anodyne	TGM2	48	34
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)N2CCCC2)cc1	ZINC000853883204	ED	On-Demand	Anodyne	F13A1	47	40
O=C(Cc1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853883240	CG	On-Demand	Anodyne	PDS	44	45
CC(=O)N1CCC[C@H]1C(=O)OC[C@@H]1CCCCC1(C)C	ZINC000853883256	CF	On-Demand	Anodyne	FKBP1A	36	40
CC(=O)N1CCC[C@H]1C(=O)OC[C@H]1CCCCC1(C)C	ZINC000853883257	CF	On-Demand	Anodyne	FKBP1A	36	40
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)OCCOC(F)F)c1	ZINC000853883259	GC	On-Demand	Anodyne	CA2	20	41
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)OCCOC(F)F)c1	ZINC000853883259	GC	On-Demand	Anodyne	CA1	16	41
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)OCCOC(F)F)c1	ZINC000853883259	GC	On-Demand	Anodyne	CA7	24	41
NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)OCCOC(F)F)c1	ZINC000853883259	GC	On-Demand	Anodyne	SLC6A9	18	40
C#CCOCCOC(=O)[C@@H]1CCCN1C(C)=O	ZINC000853883304	BC	On-Demand	Mild	FKBP1A	57	41
CCc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853883309	FG	On-Demand	Anodyne	LTA4H	16	40
CCc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853883309	FG	On-Demand	Anodyne	SIGMAR1	15	42
CCc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853883309	FG	On-Demand	Anodyne	MMP1	24	46
CC(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853883324	CC	On-Demand	Anodyne	FKBP1A	56	41
CC(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853883324	CC	On-Demand	Anodyne	TPP2	29	40
COc1ccccc1N1C[C@@H](C(=O)OCCOC(F)F)CC1=O	ZINC000853883356	ED	On-Demand	Anodyne	HTR1A	45	37
COc1ccccc1N1C[C@H](C(=O)OCCOC(F)F)CC1=O	ZINC000853883357	ED	On-Demand	Anodyne	HTR1A	45	37
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	CA2	26	45
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	CA1	25	42
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	CA4	27	40
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	CA14	16	42
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	CA12	18	45
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	CA9	18	45
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	MTCA1	35	40
CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCCOC(F)F)cc1	ZINC000853883360	GD	On-Demand	Anodyne	P96878_MYCTU	42	40
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCCOC(F)F	ZINC000853883374	CE	On-Demand	Bother	AKR1B10	24	43
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCCOC(F)F	ZINC000853883376	CE	On-Demand	Bother	AKR1B10	24	43
CC(C)c1cccc(COC(=O)Cc2nn(C)c(=O)c3ccccc23)c1	ZINC000853883380	FG	On-Demand	Anodyne	IMDH_CRYPV	30	47
CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)OCCOC(F)F)c1	ZINC000853883386	GG	On-Demand	Anodyne	AMY2	45	32
CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853883411	CE	On-Demand	Anodyne	HCN1	52	34
CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853883411	CE	On-Demand	Anodyne	HCN4	43	34
CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853883411	CE	On-Demand	Anodyne	KCNK3	27	40
CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853883411	CE	On-Demand	Anodyne	KCNK9	25	40
O=C(COc1ccc(I)cc1)OCCOC(F)F	ZINC000853883423	FE	On-Demand	Anodyne	PLA2G4B	70	34
O=C(CCOc1cccc(Br)c1)OCCOC(F)F	ZINC000853883434	EG	On-Demand	Anodyne	HMOX2	19	41
O=C(CCOc1cccc(Br)c1)OCCOC(F)F	ZINC000853883434	EG	On-Demand	Anodyne	PDS	33	40
O=C(OCCOC(F)F)c1cccs1	ZINC000853883435	BE	On-Demand	Anodyne	GLRA1	15	42
C#CCOCCOC(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000853883442	FC	On-Demand	Mild	CA2	15	51
O=C(OCCOC(F)F)C1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000853883506	FG	On-Demand	Anodyne	LIPG	48	37
O=C(NCCc1nnc(-c2ccccc2)o1)N1CCC(N2CCOC2=O)CC1	ZINC000853883512	GD	On-Demand	Anodyne	CALCRL	23	46
C#CCOCCOC(=O)CNC(=O)c1ccccc1C	ZINC000853883529	CC	On-Demand	Mild	ECR	20	40
C#CCOCCOC(=O)CNC(=O)c1ccccc1C	ZINC000853883529	CC	On-Demand	Mild	E3UJZ5_SPOLI	15	40
O=C(OCc1nnc2n1CCOCC2)c1cccc(S(=O)(=O)NC2CC2)c1	ZINC000853883534	GC	On-Demand	Anodyne	SFRP1	48	35
O=C(OCc1nnc2n1CCOCC2)c1cccc(C(F)(F)F)c1	ZINC000853883548	EE	On-Demand	Anodyne	CCR2	43	35
O=C(/C=C/c1ccc2c(c1)OCO2)OCCOC(F)F	ZINC000853883549	CE	On-Demand	Anodyne	DYRK2	55	33
O=C(/C=C\c1ccc2c(c1)OCO2)OCCOC(F)F	ZINC000853883550	CE	On-Demand	Anodyne	DYRK2	55	33
CCN(CC)S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853883552	FE	On-Demand	Anodyne	CA2	15	42
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853883578	GD	On-Demand	Anodyne	CA2	18	49
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853883578	GD	On-Demand	Anodyne	CA1	16	49
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853883578	GD	On-Demand	Anodyne	CA12	16	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853883578	GD	On-Demand	Anodyne	CA9	19	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853883579	GD	On-Demand	Anodyne	CA2	18	49
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853883579	GD	On-Demand	Anodyne	CA1	16	49
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853883579	GD	On-Demand	Anodyne	CA12	16	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853883579	GD	On-Demand	Anodyne	CA9	19	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853883580	GD	On-Demand	Anodyne	CA2	18	49
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853883580	GD	On-Demand	Anodyne	CA1	16	49
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853883580	GD	On-Demand	Anodyne	CA12	16	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853883580	GD	On-Demand	Anodyne	CA9	19	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	CA2	33	56
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	CA1	35	43
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	CA4	29	56
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	CA12	25	45
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	CA9	27	45
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	IDO1	37	41
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	MTCA1	39	40
CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCCOC(F)F)cc1	ZINC000853883581	GD	On-Demand	Anodyne	P96878_MYCTU	46	40
C#CCOCCOC(=O)CNC(=O)c1ccccc1OCC	ZINC000853883586	DD	On-Demand	Mild	HCN1	70	42
C#CCOCCOC(=O)CNC(=O)c1ccccc1OCC	ZINC000853883586	DD	On-Demand	Mild	HCN4	50	39
C#CCOCCOC(=O)CNC(=O)c1ccccc1OCC	ZINC000853883586	DD	On-Demand	Mild	KCNK3	34	43
C#CCOCCOC(=O)CNC(=O)c1ccccc1OCC	ZINC000853883586	DD	On-Demand	Mild	KCNK9	30	43
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1	ZINC000853883588	GF	On-Demand	Anodyne	AKR1C3	63	42
CCc1ccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853883598	CF	On-Demand	Bother	GSTM2	24	48
CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883606	CD	On-Demand	Anodyne	SLC18A2	20	40
CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883606	CD	On-Demand	Anodyne	SIGMAR1	18	45
CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883606	CD	On-Demand	Anodyne	MMP1	32	51
CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883606	CD	On-Demand	Anodyne	PROKR1	47	31
CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883607	CD	On-Demand	Anodyne	SLC18A2	20	40
CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883607	CD	On-Demand	Anodyne	SIGMAR1	18	45
CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883607	CD	On-Demand	Anodyne	MMP1	32	51
CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883607	CD	On-Demand	Anodyne	PROKR1	47	31
CN(C(=O)c1ccccc1C(=O)OCCOC(F)F)C1CCCCC1	ZINC000853883610	FG	On-Demand	Anodyne	AMY2	52	37
O=C(OCCOC(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000853883633	EF	On-Demand	Bother	TAAR1	27	46
O=C(OCCOC(F)F)c1cccc(OC[C@H]2CCCO2)c1	ZINC000853883640	DF	On-Demand	Anodyne	CHRNA10	38	43
O=C(OCCOC(F)F)c1cccc(OC[C@@H]2CCCO2)c1	ZINC000853883641	DF	On-Demand	Anodyne	CHRNA10	38	43
CCOc1ccccc1C(=O)NCC(=O)OCc1ncsc1Br	ZINC000853883651	GF	On-Demand	Anodyne	HCN1	68	40
CCOc1ccccc1C(=O)NCC(=O)OCc1ncsc1Br	ZINC000853883651	GF	On-Demand	Anodyne	HCN4	48	39
C#CCOCCOC(=O)Cn1cnc2cc(-c3ccc(OC)cc3)sc2c1=O	ZINC000853883652	GE	On-Demand	Mild	MCHR1	30	44
O=C(OCCOC(F)F)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1	ZINC000853883658	GI	On-Demand	Anodyne	LIPE	26	48
COc1ccc(-c2nc(C)c(C(=O)OCCOC(F)F)s2)cc1OC	ZINC000853883704	FH	On-Demand	Anodyne	DCK	50	41
COc1ccc(-c2nc(C)c(C(=O)OCCOC(F)F)s2)cc1OC	ZINC000853883704	FH	On-Demand	Anodyne	PPARD	34	43
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883724	GI	On-Demand	Anodyne	CHRM2	21	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883724	GI	On-Demand	Anodyne	TPSAB1	27	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883724	GI	On-Demand	Anodyne	L3MBTL3	31	43
O=C(OCC1C[C@H]2C[C@@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883725	GI	On-Demand	Anodyne	CHRM2	21	44
O=C(OCC1C[C@H]2C[C@@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883725	GI	On-Demand	Anodyne	TPSAB1	27	41
O=C(OCC1C[C@H]2C[C@@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883725	GI	On-Demand	Anodyne	L3MBTL3	31	43
O=C(OCC1C[C@@H]2C[C@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883726	GI	On-Demand	Anodyne	CHRM2	21	44
O=C(OCC1C[C@@H]2C[C@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883726	GI	On-Demand	Anodyne	TPSAB1	27	41
O=C(OCC1C[C@@H]2C[C@H]2C1)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853883726	GI	On-Demand	Anodyne	L3MBTL3	31	43
O=C(OCc1nnc2n1CCOCC2)C1CCN(c2nc3ccccc3o2)CC1	ZINC000853883736	GD	On-Demand	Anodyne	PDE6D	50	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	ACE	34	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CELA1	16	53
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	ELANE	35	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	MME	57	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	ANPEP	46	33
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CASP3	24	56
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	BMP1	22	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	KLK3	95	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CTSB	82	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	PAPA1_CARPA	89	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CYSP_TRYCR	63	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CTSK	56	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CTSL	54	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	PGA	22	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CAPNS1	79	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	MMP3	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	MMP8	16	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	HLA-DRB1	56	38
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	MMP11	61	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CTSS	25	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CAPN1	109	52
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CASP1	32	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CTRC	15	51
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CAPN2	168	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	ACE2	52	36
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CASP6	22	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	CASP9	46	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	TPSAB1	35	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	NPR	91	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	PSMB5	54	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	Q6PRC7_IXORI	26	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853883774	DE	On-Demand	Anodyne	PDS	43	32
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000853883777	ED	On-Demand	Anodyne	CA2	16	40
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)NC2CC2)cc1	ZINC000853883777	ED	On-Demand	Anodyne	SFRP1	49	32
CC(C)c1cccc(COC(=O)[C@@H](C)NC(=O)C(C)(C)C)c1	ZINC000853883788	DG	On-Demand	Anodyne	CAPNS1	52	31
CC(C)c1cccc(COC(=O)[C@@H](C)NC(=O)C(C)(C)C)c1	ZINC000853883788	DG	On-Demand	Anodyne	CAPN1	41	36
CC(C)c1cccc(COC(=O)[C@@H](C)NC(=O)C(C)(C)C)c1	ZINC000853883788	DG	On-Demand	Anodyne	CAPN2	64	35
CC(C)c1cccc(COC(=O)[C@H](C)NC(=O)C(C)(C)C)c1	ZINC000853883789	DG	On-Demand	Anodyne	CAPNS1	52	31
CC(C)c1cccc(COC(=O)[C@H](C)NC(=O)C(C)(C)C)c1	ZINC000853883789	DG	On-Demand	Anodyne	CAPN1	41	36
CC(C)c1cccc(COC(=O)[C@H](C)NC(=O)C(C)(C)C)c1	ZINC000853883789	DG	On-Demand	Anodyne	CAPN2	64	35
C[C@H](CC(=O)OCCOC(F)F)NC(=O)c1ccccc1	ZINC000853883804	DD	On-Demand	Anodyne	CTRB1	43	41
C[C@H](CC(=O)OCCOC(F)F)NC(=O)c1ccccc1	ZINC000853883804	DD	On-Demand	Anodyne	CELA2A	27	41
C[C@H](CC(=O)OCCOC(F)F)NC(=O)c1ccccc1	ZINC000853883804	DD	On-Demand	Anodyne	CTRB_BOVIN	44	31
CCOc1ccccc1C(=O)NCC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853883853	DE	On-Demand	Anodyne	KCNA3	39	44
CCOc1ccccc1C(=O)NCC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853883853	DE	On-Demand	Anodyne	HCN1	84	45
CCOc1ccccc1C(=O)NCC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853883853	DE	On-Demand	Anodyne	HCN4	63	42
CCOc1ccccc1C(=O)NCC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853883853	DE	On-Demand	Anodyne	KCNK3	39	42
CCOc1ccccc1C(=O)NCC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853883853	DE	On-Demand	Anodyne	KCNK9	34	42
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853883854	DE	On-Demand	Anodyne	KCNA3	39	44
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853883854	DE	On-Demand	Anodyne	HCN1	84	45
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853883854	DE	On-Demand	Anodyne	HCN4	63	42
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853883854	DE	On-Demand	Anodyne	KCNK3	39	42
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853883854	DE	On-Demand	Anodyne	KCNK9	34	42
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853883856	DE	On-Demand	Anodyne	KCNA3	39	44
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853883856	DE	On-Demand	Anodyne	HCN1	84	45
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853883856	DE	On-Demand	Anodyne	HCN4	63	42
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853883856	DE	On-Demand	Anodyne	KCNK3	39	42
CCOc1ccccc1C(=O)NCC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853883856	DE	On-Demand	Anodyne	KCNK9	34	42
CCOc1ccccc1CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883878	GG	On-Demand	Anodyne	SIGMAR1	19	42
CCOc1ccccc1CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883878	GG	On-Demand	Anodyne	MBTPS1	53	37
CCOc1ccccc1CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883879	GG	On-Demand	Anodyne	SIGMAR1	19	42
CCOc1ccccc1CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853883879	GG	On-Demand	Anodyne	MBTPS1	53	37
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000853883890	GF	On-Demand	Anodyne	TGM2	44	34
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)N2CCCCCC2)cc1	ZINC000853883890	GF	On-Demand	Anodyne	F13A1	46	39
O=C(OCCOC(F)F)c1cc(Br)ccc1O	ZINC000853883918	DF	On-Demand	Anodyne	PYK	64	34
Cc1c(C(=O)OCCOC(F)F)cccc1[N+](=O)[O-]	ZINC000853883919	CE	On-Demand	Bother	CACNA1C	41	38
Cc1c(C(=O)OCCOC(F)F)cccc1[N+](=O)[O-]	ZINC000853883919	CE	On-Demand	Bother	CACNA1D	63	38
CCOc1ccccc1C(=O)NCC(=O)OCCOC(F)F	ZINC000853883930	DD	On-Demand	Anodyne	KCNA3	19	45
CCOc1ccccc1C(=O)NCC(=O)OCCOC(F)F	ZINC000853883930	DD	On-Demand	Anodyne	HCN1	86	44
CCOc1ccccc1C(=O)NCC(=O)OCCOC(F)F	ZINC000853883930	DD	On-Demand	Anodyne	HCN4	60	41
CCOc1ccccc1C(=O)NCC(=O)OCCOC(F)F	ZINC000853883930	DD	On-Demand	Anodyne	KCNK3	47	44
CCOc1ccccc1C(=O)NCC(=O)OCCOC(F)F	ZINC000853883930	DD	On-Demand	Anodyne	KCNK9	45	44
O=C(OCCOC(F)F)c1cccnc1Cl	ZINC000853883941	CE	On-Demand	Anodyne	G2YM83_BOTF4	65	33
C=CCc1cc(C(=O)OCCOC(F)F)cc(OC)c1OC	ZINC000853883994	DF	On-Demand	Mild	SLC29A1	15	46
O=C(OCCOC(F)F)[C@@H]1C[C@@H]1c1ccc(F)cc1	ZINC000853883998	CF	On-Demand	Anodyne	SLC6A3	31	40
O=C(OCCOC(F)F)[C@H]1C[C@@H]1c1ccc(F)cc1	ZINC000853883999	CF	On-Demand	Anodyne	SLC6A3	31	40
O=C(OCCOC(F)F)[C@H]1C[C@H]1c1ccc(F)cc1	ZINC000853884000	CF	On-Demand	Anodyne	SLC6A3	31	40
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000853884001	CF	On-Demand	Anodyne	SLC6A3	31	40
C#CCCN(CCOC)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000853884016	DF	On-Demand	Mild	UTS2	55	36
C#CCCN(CCOC)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000853884017	DF	On-Demand	Mild	UTS2	55	36
O=C(OCc1nnc2n1CCOCC2)C1(c2ccccc2)CCC1	ZINC000853884038	EE	On-Demand	Anodyne	SLC12A5	57	35
O=C(Cn1c(Cc2ccccc2)nc2ccccc21)OCCOC(F)F	ZINC000853884045	FG	On-Demand	Anodyne	PDE6D	48	34
CNc1snc(C)c1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884047	GE	On-Demand	Anodyne	MMP1	15	40
CNc1snc(C)c1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884048	GE	On-Demand	Anodyne	MMP1	15	40
Cc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853884097	BE	On-Demand	Anodyne	KCNK3	55	39
Cc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853884097	BE	On-Demand	Anodyne	KCNK9	44	39
O=C(COc1ccc(Cl)cc1)OCCOC(F)F	ZINC000853884101	CF	On-Demand	Anodyne	PLA2G4B	70	34
COc1ccc2c(CC(=O)OCCOC(F)F)coc2c1	ZINC000853884120	DF	On-Demand	Anodyne	ALDH2	86	36
COc1ccc2c(CC(=O)OCCOC(F)F)coc2c1	ZINC000853884120	DF	On-Demand	Anodyne	NQO2	30	46
COc1ccc2c(CC(=O)OCCOC(F)F)coc2c1	ZINC000853884120	DF	On-Demand	Anodyne	MTNR1A	56	46
COc1ccc2c(CC(=O)OCCOC(F)F)coc2c1	ZINC000853884120	DF	On-Demand	Anodyne	MTNR1B	38	46
O=C(OCCOC(F)F)c1cccc(Cl)c1	ZINC000853884130	CF	On-Demand	Anodyne	PDS	23	40
O=C(CNC(=O)c1cccc(F)c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884135	CE	On-Demand	Anodyne	CCR2	53	38
O=C(CNC(=O)c1cccc(F)c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884136	CE	On-Demand	Anodyne	CCR2	53	38
O=C(CNC(=O)c1cccc(F)c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884137	CE	On-Demand	Anodyne	CCR2	53	38
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	F2	48	40
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	PLG	29	43
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	ACE	52	42
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	FKBP1A	120	48
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	CELA1	32	43
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	ELANE	50	43
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	CTRA_BOVIN	55	33
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	TRY1_BOVIN	68	35
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	PREP	83	43
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	CELA2A	49	33
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	LGMN	88	48
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	KLK5	22	40
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	XIAP	50	39
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	BRCA1	62	33
CC(=O)N1CCC[C@H]1C(=O)OCc1cccc(C(C)C)c1	ZINC000853884139	CF	On-Demand	Anodyne	SLC12A5	55	36
CC(C)c1cccc(COC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c1	ZINC000853884161	FF	On-Demand	Anodyne	ELANE	55	37
O=C(NCCOc1ncccc1C(F)(F)F)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853884162	GF	On-Demand	Anodyne	RBP4	64	35
O=C(NCCOc1ncccc1C(F)(F)F)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853884165	GF	On-Demand	Anodyne	RBP4	64	35
O=C(NCCOc1ncccc1C(F)(F)F)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853884168	GF	On-Demand	Anodyne	RBP4	64	35
O=C(NCCOc1ncccc1C(F)(F)F)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853884171	GF	On-Demand	Anodyne	RBP4	64	35
C/C=C\c1ccc(OCC(=O)OCCOC(F)F)c(OC)c1	ZINC000853884193	DF	On-Demand	Anodyne	TUBB1	42	36
C/C=C/c1ccc(OCC(=O)OCCOC(F)F)c(OC)c1	ZINC000853884195	DF	On-Demand	Anodyne	TUBB1	42	36
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000853884202	FE	On-Demand	Anodyne	TGM2	44	34
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000853884202	FE	On-Demand	Anodyne	F13A1	46	39
N#CCC(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853884212	CD	On-Demand	Mild	ACR	60	36
O=C(CCc1ncc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853884282	DG	On-Demand	Anodyne	FAAH	57	39
O=C(CCc1ncc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853884282	DG	On-Demand	Anodyne	CES1	33	41
O=C(CCc1ncc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853884282	DG	On-Demand	Anodyne	CES1D	52	31
C#CCOCCOC(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000853884293	CD	On-Demand	Mild	CACNA1C	41	39
C#CCOCCOC(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000853884293	CD	On-Demand	Mild	CACNA1D	61	39
O=C(OCCOC(F)F)[C@H]1CCCCN1C1=NS(=O)(=O)c2ccccc21	ZINC000853884318	GD	On-Demand	Anodyne	FKBP1A	42	36
O=C(OCCOC(F)F)[C@@H]1CCCCN1C1=NS(=O)(=O)c2ccccc21	ZINC000853884319	GD	On-Demand	Anodyne	FKBP1A	42	36
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	CASP3	21	41
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	KLK3	60	35
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	CTSB	44	38
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	CAPNS1	54	32
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	CAPN1	71	38
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	CASP1	21	40
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	CAPN2	83	36
CC(C)c1cccc(COC(=O)C[C@@H](NC(N)=O)c2ccccc2)c1	ZINC000853884341	EH	On-Demand	Anodyne	NPR	67	33
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	CASP3	21	41
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	KLK3	60	35
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	CTSB	44	38
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	CAPNS1	54	32
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	CAPN1	71	38
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	CASP1	21	40
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	CAPN2	83	36
CC(C)c1cccc(COC(=O)C[C@H](NC(N)=O)c2ccccc2)c1	ZINC000853884342	EH	On-Demand	Anodyne	NPR	67	33
CCOc1ccccc1C(=O)OCc1nnc2n1CCOCC2	ZINC000853884360	DD	On-Demand	Anodyne	HCN1	59	40
CCOc1ccccc1C(=O)OCc1nnc2n1CCOCC2	ZINC000853884360	DD	On-Demand	Anodyne	HCN4	46	35
C#CCOCCOC(=O)c1cc(Br)ccc1O	ZINC000853884373	CD	On-Demand	Mild	PYK	61	36
C/C=C/C=C\C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884374	DE	On-Demand	Anodyne	MMP1	17	45
C/C=C/C=C/C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884375	DE	On-Demand	Anodyne	MMP1	17	45
C/C=C/C=C/C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884376	DE	On-Demand	Anodyne	MMP1	17	45
O=C(CCNS(=O)(=O)c1ccccc1)OCCOC(F)F	ZINC000853884377	DD	On-Demand	Anodyne	TBXA2R	44	37
C/C=C/C=C\C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884378	DE	On-Demand	Anodyne	MMP1	17	45
CCC(=O)OCc1cccc(C(C)C)c1	ZINC000853884380	BG	On-Demand	Anodyne	CAPN2	44	32
Cc1sc2ncnc(N3CCC(C(=O)OCCOC(F)F)CC3)c2c1C	ZINC000853884417	GG	On-Demand	Anodyne	SIRT3	42	34
O=C(NCCc1nnc(-c2ccccc2)o1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853884432	FD	On-Demand	Anodyne	CALCRL	15	45
O=C(NCCc1nnc(-c2ccccc2)o1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853884434	FD	On-Demand	Anodyne	CALCRL	15	45
CC(C)c1cccc(COC(=O)CCNC(=O)c2ccco2)c1	ZINC000853884445	DG	On-Demand	Anodyne	NPR	41	32
O=C(/C=C\c1cccc(F)c1)OCCOC(F)F	ZINC000853884446	CF	On-Demand	Anodyne	NR1H4	26	43
O=C(/C=C\c1cccc(F)c1)OCCOC(F)F	ZINC000853884446	CF	On-Demand	Anodyne	AKR1C3	18	40
O=C(/C=C\c1cccc(F)c1)OCCOC(F)F	ZINC000853884446	CF	On-Demand	Anodyne	AKR1B10	35	41
O=C(/C=C/c1cccc(F)c1)OCCOC(F)F	ZINC000853884448	CF	On-Demand	Anodyne	NR1H4	26	43
O=C(/C=C/c1cccc(F)c1)OCCOC(F)F	ZINC000853884448	CF	On-Demand	Anodyne	AKR1C3	18	40
O=C(/C=C/c1cccc(F)c1)OCCOC(F)F	ZINC000853884448	CF	On-Demand	Anodyne	AKR1B10	35	41
COCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884461	CC	On-Demand	Anodyne	MMP1	25	50
COCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884461	CC	On-Demand	Anodyne	PROKR1	46	30
COCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884462	CC	On-Demand	Anodyne	MMP1	25	50
COCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853884462	CC	On-Demand	Anodyne	PROKR1	46	30
O=C(CN1C(=O)c2ccccc2S1(=O)=O)OCCOC(F)F	ZINC000853884474	EC	On-Demand	Anodyne	ELANE	23	48
O=C(OCCOC(F)F)c1cc(F)ccc1F	ZINC000853884490	CE	On-Demand	Anodyne	CES2	22	43
O=C(OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853884510	CG	On-Demand	Anodyne	CCR2	42	37
O=C(OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853884510	CG	On-Demand	Anodyne	PDS	41	40
C#CCOCCOC(=O)c1ccc(NC(=O)CC#N)cc1	ZINC000853884528	CD	On-Demand	Mild	ACR	58	35
Cn1nc(CC(=O)OCCOC(F)F)c2ccccc2c1=O	ZINC000853884548	DD	On-Demand	Anodyne	IMDH_CRYPV	31	48
O=C(CCc1nc(-c2cccs2)no1)OCc1nnc2n1CCOCC2	ZINC000853884564	GD	On-Demand	Anodyne	ETHR	36	40
O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)OCCOC(F)F	ZINC000853884583	GE	On-Demand	Anodyne	F13A1	43	38
O=C(OCc1nnc2n1CCOCC2)c1ccc(CN2CCCCC2)cc1	ZINC000853884591	FE	On-Demand	Anodyne	HRH3	18	43
O=C(COc1ccc(N2CCCC2=O)cc1)OCCOC(F)F	ZINC000853884608	ED	On-Demand	Anodyne	PLA2G4B	47	32
NC(=O)COc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853884611	CC	On-Demand	Anodyne	PLA2G4B	61	36
NC(=O)COc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853884611	CC	On-Demand	Anodyne	ACR	52	38
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccc(F)cc2)C1	ZINC000853884632	EE	On-Demand	Anodyne	L3MBTL3	55	38
O=C(OCCOC(F)F)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853884635	GG	On-Demand	Anodyne	CHRM2	20	41
O=C(OCCOC(F)F)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853884635	GG	On-Demand	Anodyne	L3MBTL3	26	42
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(N)=O)C2)c1	ZINC000853884645	DF	On-Demand	Anodyne	F2	20	44
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(N)=O)C2)c1	ZINC000853884645	DF	On-Demand	Anodyne	PLG	18	47
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(N)=O)C2)c1	ZINC000853884645	DF	On-Demand	Anodyne	FKBP1A	78	39
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(N)=O)C2)c1	ZINC000853884645	DF	On-Demand	Anodyne	TRY2_BOVIN	61	47
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(N)=O)C2)c1	ZINC000853884645	DF	On-Demand	Anodyne	DPP7	44	38
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(N)=O)C2)c1	ZINC000853884646	DF	On-Demand	Anodyne	F2	20	44
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(N)=O)C2)c1	ZINC000853884646	DF	On-Demand	Anodyne	PLG	18	47
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(N)=O)C2)c1	ZINC000853884646	DF	On-Demand	Anodyne	FKBP1A	78	39
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(N)=O)C2)c1	ZINC000853884646	DF	On-Demand	Anodyne	TRY2_BOVIN	61	47
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(N)=O)C2)c1	ZINC000853884646	DF	On-Demand	Anodyne	DPP7	44	38
CON(C)CCNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000853884649	CD	On-Demand	Mild	PAPA1_CARPA	44	38
CON(C)CCNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000853884649	CD	On-Demand	Mild	CTSL	21	40
CON(C)CCNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000853884649	CD	On-Demand	Mild	CTSS	17	40
CON(C)CCNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000853884649	CD	On-Demand	Mild	UTS2	69	41
CON(C)CCNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000853884650	CD	On-Demand	Mild	PAPA1_CARPA	44	38
CON(C)CCNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000853884650	CD	On-Demand	Mild	CTSL	21	40
CON(C)CCNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000853884650	CD	On-Demand	Mild	CTSS	17	40
CON(C)CCNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000853884650	CD	On-Demand	Mild	UTS2	69	41
Cc1cc(OCC(=O)OCc2cccc(C(C)C)c2)no1	ZINC000853884697	CG	On-Demand	Anodyne	NR1H4	66	35
O=C(OCCOC(F)F)c1cc2cc(F)ccc2s1	ZINC000853884709	CG	On-Demand	Anodyne	PIN1	27	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	ACE	41	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CELA1	22	54
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	ELANE	35	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	MME	47	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CTRA_BOVIN	46	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CASP3	26	54
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	BMP1	22	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	KLK3	94	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CTSB	78	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	PAPA1_CARPA	84	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CYSP_TRYCR	63	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CTSK	53	51
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CTSL	54	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	PGA	21	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CAPNS1	84	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	HLA-DRB1	52	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CELA2A	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	REN	22	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	LGMN	15	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	MMP11	44	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CTSS	32	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CAPN1	105	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CASP1	33	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CAPN2	160	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	PLAU	17	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CASP6	21	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	CASP9	44	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	TPSAB1	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	NPR	86	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	NAAA	38	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	PSMB5	56	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853884719	DF	On-Demand	Anodyne	SLC12A5	50	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	ACE	41	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CELA1	22	54
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	ELANE	35	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	MME	47	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CTRA_BOVIN	46	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CASP3	26	54
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	BMP1	22	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	KLK3	94	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CTSB	78	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	PAPA1_CARPA	84	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CYSP_TRYCR	63	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CTSK	53	51
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CTSL	54	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	PGA	21	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CAPNS1	84	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	HLA-DRB1	52	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CELA2A	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	REN	22	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	LGMN	15	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	MMP11	44	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CTSS	32	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CAPN1	105	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CASP1	33	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CAPN2	160	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	PLAU	17	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CASP6	21	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	CASP9	44	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	TPSAB1	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	NPR	86	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	NAAA	38	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	PSMB5	56	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853884720	DF	On-Demand	Anodyne	SLC12A5	50	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	ACE	41	46
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CELA1	22	54
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	ELANE	35	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	MME	47	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CTRA_BOVIN	46	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CASP3	26	54
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	BMP1	22	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	KLK3	94	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CTSB	78	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	PAPA1_CARPA	84	42
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CYSP_TRYCR	63	44
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CTSK	53	51
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CTSL	54	45
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	PGA	21	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CAPNS1	84	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	HLA-DRB1	52	37
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CELA2A	40	31
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	REN	22	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	LGMN	15	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	MMP11	44	34
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CTSS	32	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CAPN1	105	50
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CASP1	33	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CAPN2	160	48
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	PLAU	17	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CASP6	21	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	CASP9	44	47
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	TPSAB1	20	43
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	NPR	86	40
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	NAAA	38	41
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	PSMB5	56	49
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853884721	DF	On-Demand	Anodyne	SLC12A5	50	34
COc1ccc2c(C)c(CCC(=O)OCCOC(F)F)c(=O)oc2c1	ZINC000853884802	FF	On-Demand	Anodyne	MAOA	17	51
COc1ccc2c(C)c(CCC(=O)OCCOC(F)F)c(=O)oc2c1	ZINC000853884802	FF	On-Demand	Anodyne	MAOB	46	51
COc1ccc2c(C)c(CCC(=O)OCCOC(F)F)c(=O)oc2c1	ZINC000853884802	FF	On-Demand	Anodyne	NQO1	48	49
CON(C)CCNC(=O)NCc1cccc(-c2ccccn2)c1	ZINC000853884855	DE	On-Demand	Anodyne	PDS	46	32
C#CCOCCOC(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000853884868	GD	On-Demand	Mild	CA2	35	43
C#CCOCCOC(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000853884868	GD	On-Demand	Mild	CA4	28	40
C#CCOCCOC(=O)c1cc(C)n(Cc2ccc(S(N)(=O)=O)cc2)c1C	ZINC000853884868	GD	On-Demand	Mild	CA9	24	43
C#CCOCCOC(=O)c1ccc(C)c(S(N)(=O)=O)c1	ZINC000853884881	CC	On-Demand	Mild	CA2	17	48
CC(C)(C)OC(=O)NCc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853884888	EG	On-Demand	Anodyne	PDS	53	35
O=C(NCc1cccc(-c2ccccn2)c1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853884892	FE	On-Demand	Anodyne	NPSR1	25	40
O=C(NCc1cccc(-c2ccccn2)c1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853884893	FE	On-Demand	Anodyne	NPSR1	25	40
C#CCOCCOC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853884894	FF	On-Demand	Mild	CHRM2	17	41
C#CCOCCOC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1	ZINC000853884894	FF	On-Demand	Mild	L3MBTL3	26	41
O=C(OCCOC(F)F)C1CCN(c2nc3ccccc3o2)CC1	ZINC000853884903	EF	On-Demand	Anodyne	PDE6D	60	40
O=C(OCCOC(F)F)[C@H]1COc2ccc(Cl)cc2C1	ZINC000853884905	DF	On-Demand	Anodyne	ROCK2	18	43
O=C(OCCOC(F)F)[C@@H]1COc2ccc(Cl)cc2C1	ZINC000853884906	DF	On-Demand	Anodyne	ROCK2	18	43
O=C(OCCOC(F)F)c1ccc(CN2CCCCC2)cc1	ZINC000853884909	DG	On-Demand	Anodyne	HRH3	32	46
O=C(OCCOC(F)F)c1ccc(CN2CCCCC2)cc1	ZINC000853884909	DG	On-Demand	Anodyne	SIGMAR1	15	43
COc1ccc(-c2nc(C(=O)OCCOC(F)F)cs2)cc1OC	ZINC000853884928	FG	On-Demand	Anodyne	DCK	45	42
COc1ccc(-c2nc(C(=O)OCCOC(F)F)cs2)cc1OC	ZINC000853884928	FG	On-Demand	Anodyne	PRKCZ	22	40
Cc1ccc(C(=O)OCCOC(F)F)cc1S(N)(=O)=O	ZINC000853884942	DD	On-Demand	Anodyne	CA2	35	41
Cc1ccc(C(=O)OCCOC(F)F)cc1S(N)(=O)=O	ZINC000853884942	DD	On-Demand	Anodyne	CA1	24	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000853885030	GG	On-Demand	Mild	CCR5	23	40
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000853885031	GG	On-Demand	Mild	CCR5	23	40
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000853885032	GG	On-Demand	Mild	CCR5	23	40
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000853885033	GG	On-Demand	Mild	CCR5	23	40
C#CCOCCOC(=O)CCNC(=O)c1ccc(C(C)(C)C)cc1	ZINC000853885055	EE	On-Demand	Mild	CYNT	25	44
C#CCOCCOC(=O)CNC(=O)c1cccc(OC)c1	ZINC000853885060	CC	On-Demand	Mild	DRD4	53	41
C#CCOCCOC(=O)CNC(=O)c1cccc(OC)c1	ZINC000853885060	CC	On-Demand	Mild	MTNR1A	43	40
C#CCOCCOC(=O)CNC(=O)c1cccc(OC)c1	ZINC000853885060	CC	On-Demand	Mild	MTNR1B	41	40
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2ccccc2F)CC1	ZINC000853885061	GE	On-Demand	Anodyne	FKBP1A	24	40
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2ccccc2F)CC1	ZINC000853885061	GE	On-Demand	Anodyne	EPHX2	24	52
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA2	92	44
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA1	72	38
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA7	71	37
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA5B	53	35
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA4	74	44
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA5A	57	35
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA12	51	38
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CA9	52	38
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	CAH_METTE	44	36
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	NCE103	41	36
NS(=O)(=O)c1ccc(Br)c(C(=O)OCCOC(F)F)c1	ZINC000853885064	FD	On-Demand	Anodyne	P96878_MYCTU	47	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc(F)n1	ZINC000853885078	FF	On-Demand	Anodyne	PDE8B	42	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc(F)n1	ZINC000853885078	FF	On-Demand	Anodyne	GPR119	32	40
O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853885082	GD	On-Demand	Anodyne	CACNA1B	41	34
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)OCCOC(F)F)c1	ZINC000853885126	GF	On-Demand	Anodyne	FKBP1A	33	42
C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)OCCOC(F)F)c1	ZINC000853885126	GF	On-Demand	Anodyne	AKR1C3	54	41
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)OCCOC(F)F)c1	ZINC000853885127	GF	On-Demand	Anodyne	FKBP1A	33	42
C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)OCCOC(F)F)c1	ZINC000853885127	GF	On-Demand	Anodyne	AKR1C3	54	41
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000853885138	DC	On-Demand	Mild	CA2	41	51
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000853885138	DC	On-Demand	Mild	CA1	34	40
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000853885138	DC	On-Demand	Mild	CA7	23	42
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000853885138	DC	On-Demand	Mild	CA4	42	42
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000853885138	DC	On-Demand	Mild	CA12	22	51
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1F	ZINC000853885138	DC	On-Demand	Mild	CA9	22	42
CCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853885158	DD	On-Demand	Anodyne	CA2	29	42
CCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853885158	DD	On-Demand	Anodyne	CA1	20	42
CCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853885158	DD	On-Demand	Anodyne	CA4	17	42
Cn1nccc1[C@@H]1OCCC[C@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853885168	FE	On-Demand	Bother	GSTM2	104	40
Cn1nccc1[C@@H]1OCCC[C@H]1CNc1ccc([N+](=O)[O-])c2nonc12	ZINC000853885168	FE	On-Demand	Bother	GSTP1	65	40
O=C(CNC(=O)c1ccc(F)cc1)OCCOC(F)F	ZINC000853885200	CD	On-Demand	Anodyne	CA2	15	44
COc1cccc(C(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853885201	DE	On-Demand	Anodyne	DRD4	55	42
COc1cccc(C(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853885201	DE	On-Demand	Anodyne	MTNR1A	38	40
COc1cccc(C(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853885201	DE	On-Demand	Anodyne	MTNR1B	33	40
COc1cccc(C(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853885202	DE	On-Demand	Anodyne	DRD4	55	42
COc1cccc(C(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853885202	DE	On-Demand	Anodyne	MTNR1A	38	40
COc1cccc(C(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853885202	DE	On-Demand	Anodyne	MTNR1B	33	40
COc1cccc(C(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853885203	DE	On-Demand	Anodyne	DRD4	55	42
COc1cccc(C(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853885203	DE	On-Demand	Anodyne	MTNR1A	38	40
COc1cccc(C(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853885203	DE	On-Demand	Anodyne	MTNR1B	33	40
C[C@@H](CNC(=O)NC(C)(C)c1cccc(C#N)c1)CNC(=O)OC(C)(C)C	ZINC000853885213	FG	On-Demand	Mild	IMDH_CRYPV	43	32
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1Cl	ZINC000853885225	DC	On-Demand	Mild	CA2	45	49
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1Cl	ZINC000853885225	DC	On-Demand	Mild	CA1	40	45
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1Cl	ZINC000853885225	DC	On-Demand	Mild	CA7	25	43
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1Cl	ZINC000853885225	DC	On-Demand	Mild	CA4	49	45
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1Cl	ZINC000853885225	DC	On-Demand	Mild	CA12	25	49
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1Cl	ZINC000853885225	DC	On-Demand	Mild	CA9	23	49
O=C(Cc1ccccc1)NCC(=O)OCCOC(F)F	ZINC000853885231	CD	On-Demand	Anodyne	CA7	15	43
O=C(Cc1ccccc1)NCC(=O)OCCOC(F)F	ZINC000853885231	CD	On-Demand	Anodyne	CA5B	42	43
O=C(Cc1ccccc1)NCC(=O)OCCOC(F)F	ZINC000853885231	CD	On-Demand	Anodyne	CA5A	44	43
CN(C)CC1CCC(NC(=O)N[C@]2(C)CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853885241	GF	On-Demand	Anodyne	EPHX2	17	48
CN(C)CC1CCC(NC(=O)N[C@@]2(C)CCN(C(=O)OC(C)(C)C)C2)CC1	ZINC000853885242	GF	On-Demand	Anodyne	EPHX2	17	48
CC(C)(C)N1C[C@@H](CNC(=O)NCc2cccc(F)n2)CC1=O	ZINC000853885263	DD	On-Demand	Anodyne	PDE8B	41	33
CC(C)(C)N1C[C@H](CNC(=O)NCc2cccc(F)n2)CC1=O	ZINC000853885264	DD	On-Demand	Anodyne	PDE8B	41	33
Cc1ccc(CC2CN(C(=O)NCc3cccc(F)n3)C2)cc1	ZINC000853885273	DF	On-Demand	Anodyne	PDE8B	42	33
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853885276	FE	On-Demand	Anodyne	CA2	26	42
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853885276	FE	On-Demand	Anodyne	CA1	18	42
CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853885276	FE	On-Demand	Anodyne	CA14	18	40
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	PGC	28	41
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	CTSB	32	40
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	PAPA1_CARPA	48	44
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	CTSL	17	44
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	PGA	16	41
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	TACR3	17	43
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	REN	45	42
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	NPY5R	20	42
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	CAPN1	22	40
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853885309	GE	On-Demand	Anodyne	FPR1	54	43
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	PGC	28	41
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	CTSB	32	40
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	PAPA1_CARPA	48	44
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	CTSL	17	44
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	PGA	16	41
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	TACR3	17	43
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	REN	45	42
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	NPY5R	20	42
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	CAPN1	22	40
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853885311	GE	On-Demand	Anodyne	FPR1	54	43
COC(=O)[C@@H]1CCN(C(=O)NCc2cccc(F)n2)C[C@@H]1C	ZINC000853885313	DD	On-Demand	Anodyne	PDE8B	41	33
O=C(OCc1nnc2n1CCOCC2)C1(c2ccccc2)CCCC1	ZINC000853885321	EE	On-Demand	Anodyne	SLC12A5	57	35
CC(C)(C(=O)OCCOC(F)F)c1ccccc1	ZINC000853885323	CF	On-Demand	Anodyne	AMY2	74	43
O=C(/C=C\c1ccc(O)cc1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885324	CF	On-Demand	Anodyne	F3	25	45
O=C(/C=C\c1ccc(O)cc1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885324	CF	On-Demand	Anodyne	SSSIM	15	46
O=C(/C=C\c1ccc(O)cc1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885324	CF	On-Demand	Anodyne	AKR1B10	36	53
O=C(/C=C/c1ccc(O)cc1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885325	CF	On-Demand	Anodyne	F3	25	45
O=C(/C=C/c1ccc(O)cc1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885325	CF	On-Demand	Anodyne	SSSIM	15	46
O=C(/C=C/c1ccc(O)cc1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885325	CF	On-Demand	Anodyne	AKR1B10	36	53
O=C(/C=C\c1ccc(O)cc1)OCC1C[C@@H]2C[C@@H]2C1	ZINC000853885326	CF	On-Demand	Anodyne	F3	25	45
O=C(/C=C\c1ccc(O)cc1)OCC1C[C@@H]2C[C@@H]2C1	ZINC000853885326	CF	On-Demand	Anodyne	SSSIM	15	46
O=C(/C=C\c1ccc(O)cc1)OCC1C[C@@H]2C[C@@H]2C1	ZINC000853885326	CF	On-Demand	Anodyne	AKR1B10	36	53
O=C(/C=C/c1ccc(O)cc1)OCC1C[C@@H]2C[C@@H]2C1	ZINC000853885327	CF	On-Demand	Anodyne	F3	25	45
O=C(/C=C/c1ccc(O)cc1)OCC1C[C@@H]2C[C@@H]2C1	ZINC000853885327	CF	On-Demand	Anodyne	SSSIM	15	46
O=C(/C=C/c1ccc(O)cc1)OCC1C[C@@H]2C[C@@H]2C1	ZINC000853885327	CF	On-Demand	Anodyne	AKR1B10	36	53
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853885344	FD	On-Demand	Anodyne	CA2	21	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853885344	FD	On-Demand	Anodyne	CA1	20	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853885344	FD	On-Demand	Anodyne	CA4	15	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853885344	FD	On-Demand	Anodyne	CA12	19	43
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853885344	FD	On-Demand	Anodyne	CA9	23	43
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853885344	FD	On-Demand	Anodyne	IDO1	36	40
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853885345	FD	On-Demand	Anodyne	CA2	21	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853885345	FD	On-Demand	Anodyne	CA1	20	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853885345	FD	On-Demand	Anodyne	CA4	15	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853885345	FD	On-Demand	Anodyne	CA12	19	43
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853885345	FD	On-Demand	Anodyne	CA9	23	43
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853885345	FD	On-Demand	Anodyne	IDO1	36	40
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853885346	FD	On-Demand	Anodyne	CA2	21	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853885346	FD	On-Demand	Anodyne	CA1	20	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853885346	FD	On-Demand	Anodyne	CA4	15	45
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853885346	FD	On-Demand	Anodyne	CA12	19	43
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853885346	FD	On-Demand	Anodyne	CA9	23	43
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853885346	FD	On-Demand	Anodyne	IDO1	36	40
C[C@@H](CNC(=O)N[C@H](c1cccs1)C(C)(C)CO)CNC(=O)OC(C)(C)C	ZINC000853885347	GG	On-Demand	Anodyne	PAPA1_CARPA	26	40
NC(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853885357	CD	On-Demand	Anodyne	ACR	73	41
O=C(/C=C/c1ccccc1F)OCCOC(F)F	ZINC000853885391	CF	On-Demand	Anodyne	AKR1B10	38	40
O=C(/C=C\c1ccccc1F)OCCOC(F)F	ZINC000853885393	CF	On-Demand	Anodyne	AKR1B10	38	40
O=C(OCCOC(F)F)c1ccc(-n2cnnn2)cc1	ZINC000853885400	CD	On-Demand	Anodyne	KCNJ1	41	35
O=C(OCCOC(F)F)[C@@H]1CC(=O)N(c2ccccc2Cl)C1	ZINC000853885421	EE	On-Demand	Anodyne	KCNQ2	41	32
O=C(OCCOC(F)F)[C@H]1CC(=O)N(c2ccccc2Cl)C1	ZINC000853885423	EE	On-Demand	Anodyne	KCNQ2	41	32
O=C(CSc1nnc(-c2ccco2)o1)OCCOC(F)F	ZINC000853885439	DE	On-Demand	Anodyne	ALOX15	49	33
COc1cccc(C(=O)NCC(=O)OCCOC(F)F)c1	ZINC000853885442	DD	On-Demand	Anodyne	DRD4	53	41
COc1cccc(C(=O)NCC(=O)OCCOC(F)F)c1	ZINC000853885442	DD	On-Demand	Anodyne	NQO2	17	40
COc1cccc(C(=O)NCC(=O)OCCOC(F)F)c1	ZINC000853885442	DD	On-Demand	Anodyne	MTNR1A	53	43
COc1cccc(C(=O)NCC(=O)OCCOC(F)F)c1	ZINC000853885442	DD	On-Demand	Anodyne	MTNR1B	49	43
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA2	96	47
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA6	21	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA1	75	39
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA7	70	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA13	24	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA5B	50	36
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA4	78	47
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA5A	53	36
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA14	38	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA12	55	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA9	55	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CAH_METTE	45	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	NCE103	44	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	CA15	26	42
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	MTCA1	54	35
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	P96878_MYCTU	53	35
NS(=O)(=O)c1ccc(F)c(C(=O)OCCOC(F)F)c1	ZINC000853885444	DC	On-Demand	Anodyne	A6YCJ1_9METZ	27	42
C#CCOCCOC(=O)CSc1nnc(-c2ccco2)o1	ZINC000853885445	DD	On-Demand	Mild	ALOX15	58	33
O=C(NCc1cccc(F)n1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853885466	DD	On-Demand	Anodyne	CPT1A	106	39
O=C(NCc1cccc(F)n1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853885467	DD	On-Demand	Anodyne	CPT1A	106	39
CS(=O)(=O)Nc1ccccc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853885469	DE	On-Demand	Anodyne	PRTN3	47	38
O=C(NCc1cccc(F)n1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853885473	DF	On-Demand	Anodyne	EPHX2	32	50
O=C(NCc1cccc(F)n1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853885473	DF	On-Demand	Anodyne	PDE8B	41	32
O=C(NCc1cccc(F)n1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853885473	DF	On-Demand	Anodyne	SCD1	17	41
CS(=O)(=O)Nc1ccccc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885474	DE	On-Demand	Anodyne	PRTN3	47	38
CS(=O)(=O)Nc1ccccc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853885476	DE	On-Demand	Anodyne	PRTN3	47	38
C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)OCCOC(F)F	ZINC000853885519	FF	On-Demand	Anodyne	ENPP1	54	31
Cc1c(C(=O)OCCOC(F)F)cnn1-c1cccc(C(F)(F)F)c1	ZINC000853885524	FH	On-Demand	Anodyne	PDS	34	40
CCN1CC[C@@H](N(CC)C(=O)NCc2cccc(F)n2)C1	ZINC000853885530	CD	On-Demand	Anodyne	CCR5	59	36
CCN1CC[C@@H](N(CC)C(=O)NCc2cccc(F)n2)C1	ZINC000853885530	CD	On-Demand	Anodyne	PDE8B	41	31
CCN1CC[C@H](N(CC)C(=O)NCc2cccc(F)n2)C1	ZINC000853885531	CD	On-Demand	Anodyne	CCR5	59	36
CCN1CC[C@H](N(CC)C(=O)NCc2cccc(F)n2)C1	ZINC000853885531	CD	On-Demand	Anodyne	PDE8B	41	31
O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853885554	FF	On-Demand	Bother	TAAR1	17	42
O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885555	FF	On-Demand	Bother	TAAR1	17	42
O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853885556	FF	On-Demand	Bother	TAAR1	17	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853885564	EE	On-Demand	Anodyne	CA2	40	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853885564	EE	On-Demand	Anodyne	CA1	35	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853885564	EE	On-Demand	Anodyne	CA4	40	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853885564	EE	On-Demand	Anodyne	CA9	22	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853885565	EE	On-Demand	Anodyne	CA2	40	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853885565	EE	On-Demand	Anodyne	CA1	35	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853885565	EE	On-Demand	Anodyne	CA4	40	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853885565	EE	On-Demand	Anodyne	CA9	22	41
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853885566	EE	On-Demand	Anodyne	CA2	40	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853885566	EE	On-Demand	Anodyne	CA1	35	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853885566	EE	On-Demand	Anodyne	CA4	40	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853885566	EE	On-Demand	Anodyne	CA9	22	41
C[C@@H](CCNC(=O)NC[C@@H](C)CNC(=O)OC(C)(C)C)N(C)C	ZINC000853885574	ED	On-Demand	Anodyne	CHRNA4	19	43
C#CCOCCOC(=O)CNC(=O)c1ccccc1OC	ZINC000853885577	CC	On-Demand	Mild	KCNA3	46	43
C#CCOCCOC(=O)CNC(=O)c1ccccc1OC	ZINC000853885577	CC	On-Demand	Mild	HCN1	41	40
C#CCOCCOC(=O)CNC(=O)c1ccccc1OC	ZINC000853885577	CC	On-Demand	Mild	KCNK3	41	40
C#CCOCCOC(=O)CNC(=O)c1ccccc1OC	ZINC000853885577	CC	On-Demand	Mild	KCNK9	35	40
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000853885579	FC	On-Demand	Mild	CA2	17	47
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000853885579	FC	On-Demand	Mild	CA1	16	47
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000853885579	FC	On-Demand	Mild	CA4	15	47
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000853885579	FC	On-Demand	Mild	CA12	17	40
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000853885579	FC	On-Demand	Mild	CA9	15	42
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000853885579	FC	On-Demand	Mild	IDO1	37	41
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853885591	EE	On-Demand	Anodyne	TBXA2R	48	34
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885592	EE	On-Demand	Anodyne	TBXA2R	48	34
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853885593	EE	On-Demand	Anodyne	TBXA2R	48	34
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853885599	FE	On-Demand	Anodyne	CPT1A	68	34
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853885600	FE	On-Demand	Anodyne	CPT1A	68	34
O=C(NCc1cccc(F)n1)N1CCc2nnc(N3CCCC3)cc2C1	ZINC000853885605	FD	On-Demand	Anodyne	MAPK1	23	42
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(Cl)cc1	ZINC000853885613	EC	On-Demand	Mild	TBXA2R	45	35
O=C(CNS(=O)(=O)c1ccc(Br)cc1)OCCOC(F)F	ZINC000853885629	GD	On-Demand	Anodyne	IDO1	20	41
C#CCOCCOC(=O)c1ccccc1NS(C)(=O)=O	ZINC000853885658	CC	On-Demand	Mild	PRTN3	47	42
Cc1oc(-c2ccccc2)nc1CC(=O)OCc1nnc2n1CCOCC2	ZINC000853885660	FE	On-Demand	Anodyne	PPARG	78	44
Cc1oc(-c2ccccc2)nc1CC(=O)OCc1nnc2n1CCOCC2	ZINC000853885660	FE	On-Demand	Anodyne	PPARA	81	40
Cc1oc(-c2ccccc2)nc1CC(=O)OCc1nnc2n1CCOCC2	ZINC000853885660	FE	On-Demand	Anodyne	PDE8B	68	44
CC(C)c1cccc(COC(=O)C2CCN(S(C)(=O)=O)CC2)c1	ZINC000853885664	EF	On-Demand	Anodyne	TRY2_BOVIN	64	43
CC(C)c1cccc(COC(=O)C2CCN(S(C)(=O)=O)CC2)c1	ZINC000853885664	EF	On-Demand	Anodyne	CCR5	18	40
O=C(OCCOC(F)F)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000853885681	GG	On-Demand	Anodyne	EPHX2	20	41
O=C(OCCOC(F)F)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000853885681	GG	On-Demand	Anodyne	MLYCD	18	42
O=C(OCCOC(F)F)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000853885681	GG	On-Demand	Anodyne	L3MBTL3	71	38
O=C(NCc1cccc(F)n1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853885683	EF	On-Demand	Anodyne	PDE8B	41	33
C#CCOCCOC(=O)c1cc2cc(C)ccc2[nH]1	ZINC000853885684	CE	On-Demand	Mild	TUBB2B	33	44
Cn1nccc1[C@@H]1OCCC[C@H]1CNc1ncnc2c1cnn2C(C)(C)C	ZINC000853885729	FF	On-Demand	Anodyne	TNK2	48	33
O=C(OCCOC(F)F)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl	ZINC000853885744	GF	On-Demand	Anodyne	Q9FYV8_MAIZE	41	38
CCOC(=O)c1cc(C(=O)OCCOC(F)F)cc([N+](=O)[O-])c1	ZINC000853885773	EE	On-Demand	Bother	CACNA1C	41	42
CCOC(=O)c1cc(C(=O)OCCOC(F)F)cc([N+](=O)[O-])c1	ZINC000853885773	EE	On-Demand	Bother	CACNA1D	61	42
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	CA2	36	52
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	CA1	38	44
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	CA7	20	40
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	CA4	33	52
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	CA14	21	40
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	CA12	28	47
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	CA9	30	44
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	IDO1	39	43
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	MTCA1	39	42
CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853885774	FC	On-Demand	Anodyne	P96878_MYCTU	47	42
O=C(NCc1cccc(F)n1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853885808	GE	On-Demand	Anodyne	HTR1A	22	40
O=C(CNS(=O)(=O)c1ccc(Cl)cc1)OCCOC(F)F	ZINC000853885809	ED	On-Demand	Anodyne	TBXA2R	47	37
CN1C[C@@H](CNC(=O)NCc2cccc(F)n2)CC1=O	ZINC000853885817	CC	On-Demand	Anodyne	PDE8B	43	34
CN1C[C@H](CNC(=O)NCc2cccc(F)n2)CC1=O	ZINC000853885818	CC	On-Demand	Anodyne	PDE8B	43	34
O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)OCCOC(F)F	ZINC000853885827	FD	On-Demand	Anodyne	TBXA2R	50	37
CC(C)(C(=O)OCc1nnc2n1CCOCC2)c1ccccc1	ZINC000853885833	DD	On-Demand	Anodyne	AMY2	51	29
O=C(NCCC(=O)OCCOC(F)F)NC12CC3CC(CC(C3)C1)C2	ZINC000853885845	FE	On-Demand	Anodyne	EPHX2	102	61
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2cccc(F)n2)cc1	ZINC000853885877	GD	On-Demand	Anodyne	ADRB2	42	51
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2cccc(F)n2)cc1	ZINC000853885877	GD	On-Demand	Anodyne	ADRB1	77	51
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2cccc(F)n2)cc1	ZINC000853885877	GD	On-Demand	Anodyne	ADRB3	48	42
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2cccc(F)n2)cc1	ZINC000853885878	GD	On-Demand	Anodyne	ADRB2	42	51
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2cccc(F)n2)cc1	ZINC000853885878	GD	On-Demand	Anodyne	ADRB1	77	51
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2cccc(F)n2)cc1	ZINC000853885878	GD	On-Demand	Anodyne	ADRB3	48	42
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1cccc(F)n1	ZINC000853885884	CD	On-Demand	Anodyne	PDE8B	40	32
CS(=O)(=O)C1CN(C(=O)NCc2cccc(F)n2)C1	ZINC000853885887	CC	On-Demand	Anodyne	PDE8B	42	33
C[C@@H]1CN(C(=O)NCc2cccc(F)n2)C[C@]1(C)CO	ZINC000853885964	CD	On-Demand	Anodyne	PDE8B	40	32
C[C@@H]1CN(C(=O)NCc2cccc(F)n2)C[C@@]1(C)CO	ZINC000853885965	CD	On-Demand	Anodyne	PDE8B	40	32
Cn1nccc1[C@@H]1OCCC[C@H]1CNc1ncnc2c1CCC2	ZINC000853885974	DE	On-Demand	Anodyne	TNK2	57	37
O=C(/C=C\c1ccc(O)cc1)OCCOC(F)F	ZINC000853885978	CE	On-Demand	Anodyne	F3	26	46
O=C(/C=C\c1ccc(O)cc1)OCCOC(F)F	ZINC000853885978	CE	On-Demand	Anodyne	SSSIM	15	47
O=C(/C=C\c1ccc(O)cc1)OCCOC(F)F	ZINC000853885978	CE	On-Demand	Anodyne	AKR1B10	43	62
O=C(/C=C/c1ccc(O)cc1)OCCOC(F)F	ZINC000853885979	CE	On-Demand	Anodyne	F3	26	46
O=C(/C=C/c1ccc(O)cc1)OCCOC(F)F	ZINC000853885979	CE	On-Demand	Anodyne	SSSIM	15	47
O=C(/C=C/c1ccc(O)cc1)OCCOC(F)F	ZINC000853885979	CE	On-Demand	Anodyne	AKR1B10	43	62
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000853885993	ED	On-Demand	Bother	SLC6A9	15	50
O=C(CNC(=O)c1cccc(Br)c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853885997	FF	On-Demand	Anodyne	CCR2	27	40
O=C(CNC(=O)c1cccc(Br)c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853885998	FF	On-Demand	Anodyne	CCR2	27	40
O=C(CNC(=O)c1cccc(Br)c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853885999	FF	On-Demand	Anodyne	CCR2	27	40
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NCc2cccc(F)n2)C3)cn1	ZINC000853886006	FD	On-Demand	Anodyne	MAPK1	37	40
O=C(NCc1cccc(F)n1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853886013	ED	On-Demand	Anodyne	L3MBTL3	68	39
O=C(NCc1cccc(F)n1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853886014	ED	On-Demand	Anodyne	L3MBTL3	68	39
C#CCOCCOC(=O)CNS(=O)(=O)c1ccc(Br)cc1	ZINC000853886016	GC	On-Demand	Mild	IDO1	15	40
O=C(CNC(=O)c1ccc(C(F)(F)F)cc1)OCCOC(F)F	ZINC000853886017	EE	On-Demand	Anodyne	PPARD	18	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA2	106	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA1	88	43
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA7	81	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA5B	51	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA4	90	44
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA5A	54	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA14	48	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA12	61	40
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CA9	61	42
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	CAH_METTE	49	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	NCE103	44	39
NS(=O)(=O)c1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853886025	ED	On-Demand	Anodyne	P96878_MYCTU	46	35
Cn1nccc1[C@@H]1OCCC[C@H]1CNc1ncnc(F)c1Br	ZINC000853886050	FF	On-Demand	Anodyne	TNK2	53	35
C[C@@H]1CN(C(=O)NCc2cccc(F)n2)C[C@@H](C)C1O	ZINC000853886061	CD	On-Demand	Anodyne	PDE8B	44	36
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA2	130	58
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA6	26	47
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA1	105	57
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA7	82	47
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA5B	47	35
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA4	88	57
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA5A	49	35
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA14	69	55
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA12	79	57
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	CA9	82	57
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	NCE103	29	47
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	MTCA1	44	39
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	P96878_MYCTU	55	39
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886069	CC	On-Demand	Anodyne	A6YCJ1_9METZ	26	43
O=C(NCc1cccc(F)n1)N(CCN1CCOCC1)CC1CC1	ZINC000853886096	ED	On-Demand	Anodyne	CASR	57	42
O=C(NCc1cccc(F)n1)N(CCN1CCOCC1)CC1CC1	ZINC000853886096	ED	On-Demand	Anodyne	PDE8B	48	32
CN(C)CC1CCC(NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853886101	GH	On-Demand	Reactive	LCK	18	44
CN(C)CC1CCC(NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853886101	GH	On-Demand	Reactive	CSNK1D	29	40
NC(=O)Nc1ccc(C(=O)OCc2nnc3n2CCOCC3)cc1	ZINC000853886113	EC	On-Demand	Anodyne	MTOR	30	40
NC(=O)Nc1ccc(C(=O)OCc2nnc3n2CCOCC3)cc1	ZINC000853886113	EC	On-Demand	Anodyne	PIK3CG	24	40
NC(=O)Nc1ccc(C(=O)OCc2nnc3n2CCOCC3)cc1	ZINC000853886113	EC	On-Demand	Anodyne	ACR	48	32
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886123	GF	On-Demand	Anodyne	FKBP1A	22	42
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886123	GF	On-Demand	Anodyne	MMP13	28	40
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886123	GF	On-Demand	Anodyne	MMP3	24	40
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886123	GF	On-Demand	Anodyne	MMP7	35	40
C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886123	GF	On-Demand	Anodyne	MMP1	29	40
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886125	GF	On-Demand	Anodyne	FKBP1A	22	42
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886125	GF	On-Demand	Anodyne	MMP13	28	40
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886125	GF	On-Demand	Anodyne	MMP3	24	40
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886125	GF	On-Demand	Anodyne	MMP7	35	40
C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886125	GF	On-Demand	Anodyne	MMP1	29	40
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc2ccccc2c1	ZINC000853886131	FF	On-Demand	Anodyne	IMDH_CRYPV	54	46
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)nc1	ZINC000853886137	GD	On-Demand	Anodyne	F10	17	42
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)nc1	ZINC000853886137	GD	On-Demand	Anodyne	MMP13	27	41
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)nc1	ZINC000853886137	GD	On-Demand	Anodyne	MMP1	19	42
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)nc1	ZINC000853886137	GD	On-Demand	Anodyne	PROKR1	47	30
COc1cccc(C(=O)NCC(=O)OCc2onc(C)c2[N+](=O)[O-])c1	ZINC000853886145	ED	On-Demand	Bother	DRD4	46	36
COc1cccc(C(=O)NCC(=O)OCc2onc(C)c2[N+](=O)[O-])c1	ZINC000853886145	ED	On-Demand	Bother	TAAR1	26	41
CC[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886148	DE	On-Demand	Anodyne	MMP1	26	45
CC[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886148	DE	On-Demand	Anodyne	PROKR1	48	33
CC[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886149	DE	On-Demand	Anodyne	MMP1	26	45
CC[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886149	DE	On-Demand	Anodyne	PROKR1	48	33
COc1ccc2c(NC[C@@H]3CCCO[C@H]3c3ccnn3C)ccnc2c1	ZINC000853886221	FH	On-Demand	Anodyne	HRP1_PLAFA	103	40
COc1ccc2c(NC[C@@H]3CCCO[C@H]3c3ccnn3C)ccnc2c1	ZINC000853886221	FH	On-Demand	Anodyne	HNMT	61	34
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	CA2	98	55
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	CA1	73	48
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	CA7	66	45
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	CA14	70	52
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	CA12	71	52
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	CA9	66	52
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	NCE103	19	45
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	MTCA1	40	36
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853886275	CD	On-Demand	Anodyne	P96878_MYCTU	50	36
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	CA2	98	55
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	CA1	73	48
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	CA7	66	45
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	CA14	70	52
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	CA12	71	52
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	CA9	66	52
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	NCE103	19	45
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	MTCA1	40	36
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853886276	CD	On-Demand	Anodyne	P96878_MYCTU	50	36
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	CA2	98	55
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	CA1	73	48
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	CA7	66	45
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	CA4	56	48
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	CA14	70	52
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	CA12	71	52
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	CA9	66	52
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	NCE103	19	45
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	MTCA1	40	36
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853886277	CD	On-Demand	Anodyne	P96878_MYCTU	50	36
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)s1	ZINC000853886302	GF	On-Demand	Anodyne	TRY2_BOVIN	18	40
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)s1	ZINC000853886302	GF	On-Demand	Anodyne	MMP1	27	46
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)s1	ZINC000853886302	GF	On-Demand	Anodyne	PROKR1	59	32
CS(=O)(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886322	DD	On-Demand	Anodyne	GRIN1	25	41
CS(=O)(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853886322	DD	On-Demand	Anodyne	ACR	52	34
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1OC	ZINC000853886323	DC	On-Demand	Mild	CA2	30	46
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1OC	ZINC000853886323	DC	On-Demand	Mild	CA7	20	41
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1OC	ZINC000853886323	DC	On-Demand	Mild	CA4	26	41
C[C@@H]1CCN(C(=O)NCc2cccc(F)n2)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000853886326	GG	On-Demand	Anodyne	PDE8B	40	32
C[C@@H]1CCCN(C(=O)NCc2cccc(F)n2)[C@@H]1CCO	ZINC000853886328	CD	On-Demand	Anodyne	TRPC6	46	34
C[C@@H]1CCCN(C(=O)NCc2cccc(F)n2)[C@H]1CCO	ZINC000853886330	CD	On-Demand	Anodyne	TRPC6	46	34
COc1ccc(O[C@H](C)C(=O)OCCOC(F)F)cc1	ZINC000853886333	CE	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(O[C@H](C)C(=O)OCCOC(F)F)cc1	ZINC000853886333	CE	On-Demand	Anodyne	MTNR1B	28	40
COc1ccc(O[C@@H](C)C(=O)OCCOC(F)F)cc1	ZINC000853886334	CE	On-Demand	Anodyne	MTNR1A	32	40
COc1ccc(O[C@@H](C)C(=O)OCCOC(F)F)cc1	ZINC000853886334	CE	On-Demand	Anodyne	MTNR1B	28	40
COc1ccc(-c2nc(CC(=O)OCCOC(F)F)cs2)cc1OC	ZINC000853886335	FG	On-Demand	Anodyne	DCK	46	46
COc1ccc(-c2nc(CC(=O)OCCOC(F)F)cs2)cc1OC	ZINC000853886335	FG	On-Demand	Anodyne	PPARD	20	44
Cc1ccc(C(=O)OCCOC(F)F)cc1NS(C)(=O)=O	ZINC000853886338	DD	On-Demand	Anodyne	TRPV1	30	40
COC[C@H](NC(=O)NCc1cccc(F)n1)c1cccc(OC)c1	ZINC000853886353	EE	On-Demand	Anodyne	ROCK1	20	40
COC[C@H](NC(=O)NCc1cccc(F)n1)c1cccc(OC)c1	ZINC000853886353	EE	On-Demand	Anodyne	ROCK2	20	40
COC[C@@H](NC(=O)NCc1cccc(F)n1)c1cccc(OC)c1	ZINC000853886354	EE	On-Demand	Anodyne	ROCK1	20	40
COC[C@@H](NC(=O)NCc1cccc(F)n1)c1cccc(OC)c1	ZINC000853886354	EE	On-Demand	Anodyne	ROCK2	20	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886355	FD	On-Demand	Anodyne	SIGMAR1	23	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886355	FD	On-Demand	Anodyne	CCR3	45	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886355	FD	On-Demand	Anodyne	MLNR	54	34
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886355	FD	On-Demand	Anodyne	MCHR1	27	46
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886355	FD	On-Demand	Anodyne	PDE8B	40	30
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886356	FD	On-Demand	Anodyne	SIGMAR1	23	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886356	FD	On-Demand	Anodyne	CCR3	45	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886356	FD	On-Demand	Anodyne	MLNR	54	34
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886356	FD	On-Demand	Anodyne	MCHR1	27	46
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NCc1cccc(F)n1	ZINC000853886356	FD	On-Demand	Anodyne	PDE8B	40	30
Cc1oc(-c2ccccc2)nc1CC(=O)OCCOC(F)F	ZINC000853886359	DF	On-Demand	Anodyne	PPARG	110	49
Cc1oc(-c2ccccc2)nc1CC(=O)OCCOC(F)F	ZINC000853886359	DF	On-Demand	Anodyne	PPARA	119	54
Cc1oc(-c2ccccc2)nc1CC(=O)OCCOC(F)F	ZINC000853886359	DF	On-Demand	Anodyne	PDE8B	62	36
CC(C)(C)OC(=O)[C@]12COC[C@H]1CN(C(=O)NCc1cccc(F)n1)C2	ZINC000853886367	FD	On-Demand	Anodyne	PDE8B	41	32
CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)COc1c(CO)cc(F)cc1CO	ZINC000853886376	JH	On-Demand	Anodyne	PRKCZ	42	40
CC/C=C(/C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886392	DF	On-Demand	Anodyne	MMP1	18	44
CC/C=C(/C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886392	DF	On-Demand	Anodyne	PROKR1	47	31
CC/C=C(\C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886393	DF	On-Demand	Anodyne	MMP1	18	44
CC/C=C(\C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886393	DF	On-Demand	Anodyne	PROKR1	47	31
CC/C=C(/C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886394	DF	On-Demand	Anodyne	MMP1	18	44
CC/C=C(/C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886394	DF	On-Demand	Anodyne	PROKR1	47	31
CC/C=C(\C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886395	DF	On-Demand	Anodyne	MMP1	18	44
CC/C=C(\C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853886395	DF	On-Demand	Anodyne	PROKR1	47	31
CS(=O)(=O)Nc1ccccc1C(=O)OCCOC(F)F	ZINC000853886406	DD	On-Demand	Anodyne	PRTN3	49	43
O=C(CCNS(=O)(=O)c1ccc(F)cc1)OCCOC(F)F	ZINC000853886430	ED	On-Demand	Anodyne	CA2	15	50
O=C(CCNS(=O)(=O)c1ccc(F)cc1)OCCOC(F)F	ZINC000853886430	ED	On-Demand	Anodyne	TBXA2R	51	41
O=C(CCNS(=O)(=O)c1ccc(F)cc1)OCCOC(F)F	ZINC000853886430	ED	On-Demand	Anodyne	CA1	15	43
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(N2CCOCC2)cc1	ZINC000853886435	GD	On-Demand	Anodyne	PIK3CD	15	46
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(N2CCOCC2)cc1	ZINC000853886435	GD	On-Demand	Anodyne	MTOR	40	38
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(N2CCOCC2)cc1	ZINC000853886435	GD	On-Demand	Anodyne	EPHX2	24	42
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(N2CCOCC2)cc1	ZINC000853886435	GD	On-Demand	Anodyne	PIK3CB	20	46
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(N2CCOCC2)cc1	ZINC000853886435	GD	On-Demand	Anodyne	EPHB4	40	34
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(N2CCOCC2)cc1	ZINC000853886435	GD	On-Demand	Anodyne	STAT6	76	42
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA2	89	76
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA6	16	44
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA1	69	53
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA7	55	51
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA4	62	53
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA14	43	76
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA12	53	76
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	CA9	49	76
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	NCE103	20	44
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	P96878_MYCTU	44	35
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1	ZINC000853886472	CC	On-Demand	Mild	A6YCJ1_9METZ	19	40
O=C(Cc1ccccc1)NCCC(=O)OCCOC(F)F	ZINC000853886499	DD	On-Demand	Anodyne	CA7	15	47
O=C(Cc1ccccc1)NCCC(=O)OCCOC(F)F	ZINC000853886499	DD	On-Demand	Anodyne	CA5B	39	47
O=C(Cc1ccccc1)NCCC(=O)OCCOC(F)F	ZINC000853886499	DD	On-Demand	Anodyne	CA5A	40	47
CC(C)c1cccc(COC(=O)c2ccc(CNC(N)=O)cc2)c1	ZINC000853886527	EG	On-Demand	Anodyne	PRSS1	19	40
CC(C)c1cccc(COC(=O)c2ccc(CNC(N)=O)cc2)c1	ZINC000853886527	EG	On-Demand	Anodyne	FURIN	52	36
CC(C)c1cccc(COC(=O)c2ccc(CNC(N)=O)cc2)c1	ZINC000853886527	EG	On-Demand	Anodyne	TPSAB1	20	40
CC(C)c1cccc(COC(=O)c2ccc(CNC(N)=O)cc2)c1	ZINC000853886527	EG	On-Demand	Anodyne	PDS	52	43
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853886534	GD	On-Demand	Anodyne	CCR2	42	39
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853886535	GD	On-Demand	Anodyne	CCR2	42	39
CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853886536	GD	On-Demand	Anodyne	CCR2	42	39
O=C(OCCOC(F)F)c1cccc(NC(=O)C2CC2)c1	ZINC000853886541	CE	On-Demand	Anodyne	KCNK3	27	44
O=C(OCCOC(F)F)c1cc(C2CC2)nc2ccccc12	ZINC000853886564	DH	On-Demand	Anodyne	TACR3	22	48
CCOc1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853886565	DF	On-Demand	Anodyne	PLA2G4B	55	34
COC[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)C1CC1	ZINC000853886566	EG	On-Demand	Reactive	CSNK1D	42	44
COC[C@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)C1CC1	ZINC000853886567	EG	On-Demand	Reactive	CSNK1D	42	44
CS(=O)(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853886573	CC	On-Demand	Anodyne	FKBP1A	39	40
C=CCC[C@H](NC(=O)NCCN(C)OC)c1ccc(C(F)(F)F)cc1	ZINC000853886595	FH	On-Demand	Mild	UTS2	53	35
C=CCC[C@@H](NC(=O)NCCN(C)OC)c1ccc(C(F)(F)F)cc1	ZINC000853886596	FH	On-Demand	Mild	UTS2	53	35
NC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853886614	CD	On-Demand	Anodyne	KCNK3	78	34
NC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853886614	CD	On-Demand	Anodyne	KCNK9	46	33
CS(=O)(=O)N1CCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853886619	ED	On-Demand	Anodyne	SRD5A1	19	43
O=C(OCCOC(F)F)C1CCN(C(=O)Nc2ccccc2)CC1	ZINC000853886620	EF	On-Demand	Anodyne	FKBP1A	23	46
O=C(OCCOC(F)F)C1CCN(C(=O)Nc2ccccc2)CC1	ZINC000853886620	EF	On-Demand	Anodyne	EPHX2	32	40
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA2	125	56
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA6	24	46
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA1	104	49
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA7	73	49
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA13	28	46
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA5B	50	41
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA4	86	51
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA5A	52	41
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA14	50	42
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA12	76	49
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA9	84	49
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CAH_METTE	30	46
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CYNT	31	44
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	NCE103	40	56
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	CA15	17	46
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	P96878_MYCTU	47	43
NS(=O)(=O)c1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853886629	DD	On-Demand	Anodyne	A6YCJ1_9METZ	25	46
O=C(OCCOC(F)F)c1cc(F)c(Cl)cc1Cl	ZINC000853886631	DH	On-Demand	Anodyne	Q9FYV8_MAIZE	33	40
O=C(CCc1ccc2ccccc2n1)OCCOC(F)F	ZINC000853886668	CF	On-Demand	Anodyne	CYSLTR1	52	49
CC(C)c1cccc(COC(=O)Cn2ccccc2=O)c1	ZINC000853886675	CF	On-Demand	Anodyne	CAPNS1	46	30
COC[C@@H](NC(=O)NNc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000853886699	DD	On-Demand	Reactive	CACNA1D	54	34
COC[C@H](NC(=O)NNc1ccc([N+](=O)[O-])cc1F)C1CC1	ZINC000853886700	DD	On-Demand	Reactive	CACNA1D	54	34
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1	ZINC000853886735	GE	On-Demand	Anodyne	EPHX2	22	42
C#CCCN(CCOC)C(=O)NCC(C)(C)c1cccc(OC)c1	ZINC000853886736	EF	On-Demand	Mild	DRD4	40	31
C[C@@H](CNC(=O)N[C@H]1CCc2ccc(O)cc21)CNC(=O)OC(C)(C)C	ZINC000853886751	FF	On-Demand	Anodyne	NQO2	19	40
O=C(OCCOC(F)F)c1cc2ccccc2s1	ZINC000853886772	CG	On-Demand	Anodyne	PIN1	31	45
O=C(OCCOC(F)F)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000853886786	DG	On-Demand	Bother	CACNA1D	41	33
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OCCOC(F)F	ZINC000853886798	FD	On-Demand	Anodyne	F2	22	45
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OCCOC(F)F	ZINC000853886798	FD	On-Demand	Anodyne	TRY2_BOVIN	67	45
CC(C)c1cccc(COC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)c1	ZINC000853886802	GJ	On-Demand	Anodyne	FKBP1A	42	42
CC(C)c1cccc(COC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)c1	ZINC000853886802	GJ	On-Demand	Anodyne	SLC6A3	15	40
CC(C)c1cccc(COC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)c1	ZINC000853886802	GJ	On-Demand	Anodyne	TRY2_BOVIN	28	40
CC(C)c1cccc(COC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)c1	ZINC000853886802	GJ	On-Demand	Anodyne	PDE6D	53	37
COC(=O)c1cn(CC(=O)OCCOC(F)F)c2ccccc12	ZINC000853886836	EE	On-Demand	Anodyne	CNR1	15	41
COC(=O)c1cn(CC(=O)OCCOC(F)F)c2ccccc12	ZINC000853886836	EE	On-Demand	Anodyne	CNR2	24	42
COc1cccc(C(C)(C)CNC(=O)NCCN(C)OC)c1	ZINC000853886857	DD	On-Demand	Anodyne	DRD4	40	30
COc1cccc(C(C)(C)CNC(=O)NCCN(C)OC)c1	ZINC000853886857	DD	On-Demand	Anodyne	MTNR1A	55	41
COc1cccc(C(C)(C)CNC(=O)NCCN(C)OC)c1	ZINC000853886857	DD	On-Demand	Anodyne	MTNR1B	49	41
C#CCOCCOC(=O)c1sc2nc(C)cc(C)c2c1N	ZINC000853886873	DE	On-Demand	Mild	CHRM4	29	51
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853886899	GG	On-Demand	Anodyne	CHRM3	15	43
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853886899	GG	On-Demand	Anodyne	REN	40	37
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853886899	GG	On-Demand	Anodyne	EPHX2	23	45
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853886899	GG	On-Demand	Anodyne	GPR119	24	41
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853886899	GG	On-Demand	Anodyne	SFRP1	43	34
C[C@@H](CNC(=O)OC(C)(C)C)CNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853886899	GG	On-Demand	Anodyne	WNT3	51	31
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA2	108	48
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA1	90	42
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA7	60	41
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA13	32	41
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA5B	41	40
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA4	76	48
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA5A	43	40
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA14	41	39
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA12	60	40
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	CA9	70	41
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	NCE103	28	47
CC(C)c1cccc(COC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853886909	FG	On-Demand	Anodyne	P96878_MYCTU	29	40
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA2	92	52
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA6	19	43
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA1	82	51
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA7	60	48
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA13	22	43
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA4	68	51
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA14	40	51
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA12	60	51
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CA9	67	51
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CAH_METTE	24	43
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	CYNT	25	40
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	NCE103	28	52
C#CCOCCOC(=O)CCc1ccc(S(N)(=O)=O)cc1	ZINC000853886917	DC	On-Demand	Mild	A6YCJ1_9METZ	22	41
O=C(OCCOC(F)F)[C@@H]1CC(=O)N(C2CCCC2)C1	ZINC000853886921	CD	On-Demand	Anodyne	INHA	18	43
O=C(OCCOC(F)F)[C@H]1CC(=O)N(C2CCCC2)C1	ZINC000853886922	CD	On-Demand	Anodyne	INHA	18	43
COc1cccc(C(C)(C)CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853886965	FD	On-Demand	Anodyne	DRD4	40	30
NC(=O)Nc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853887000	EC	On-Demand	Anodyne	CASR	18	44
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA2	96	52
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA6	19	43
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA1	85	43
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA7	60	45
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA13	23	43
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA4	64	45
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA14	58	38
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA12	71	45
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CA9	77	45
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CAH_METTE	24	43
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	CYNT	25	40
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	NCE103	20	52
NS(=O)(=O)c1ccc(CCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853887008	DD	On-Demand	Anodyne	A6YCJ1_9METZ	23	41
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA2	96	52
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA6	19	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA1	85	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA7	60	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA13	23	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA4	64	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA14	58	38
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA12	71	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CA9	77	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CAH_METTE	24	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	CYNT	25	40
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	NCE103	20	52
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853887009	DD	On-Demand	Anodyne	A6YCJ1_9METZ	23	41
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA2	96	52
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA6	19	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA1	85	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA7	60	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA13	23	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA4	64	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA14	58	38
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA12	71	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CA9	77	45
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CAH_METTE	24	43
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	CYNT	25	40
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	NCE103	20	52
NS(=O)(=O)c1ccc(CCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853887010	DD	On-Demand	Anodyne	A6YCJ1_9METZ	23	41
C[C@@H]1Oc2ccccc2N(CC(=O)OCc2nnc3n2CCOCC3)C1=O	ZINC000853887030	FC	On-Demand	Anodyne	HEMY	26	43
CCOC(=O)Nc1ccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853887069	EF	On-Demand	Bother	GSTM2	15	40
NS(=O)(=O)c1ccc(NCC(=O)OCC2C[C@@H]3C[C@H]3C2)c([N+](=O)[O-])c1	ZINC000853887085	FD	On-Demand	Bother	CA2	24	41
NS(=O)(=O)c1ccc(NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000853887087	FD	On-Demand	Bother	CA2	24	41
NS(=O)(=O)c1ccc(NCC(=O)OCC2C[C@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000853887090	FD	On-Demand	Bother	CA2	24	41
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1CSCN1C(=O)c1ccccc1	ZINC000853887093	EF	On-Demand	Anodyne	PREP	20	42
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CSCN1C(=O)c1ccccc1	ZINC000853887097	EF	On-Demand	Anodyne	PREP	20	42
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CSCN1C(=O)c1ccccc1	ZINC000853887100	EF	On-Demand	Anodyne	PREP	20	42
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887106	EF	On-Demand	Anodyne	FKBP1A	38	48
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887106	EF	On-Demand	Anodyne	SLC6A1	69	35
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887106	EF	On-Demand	Anodyne	AMY2	42	29
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887106	EF	On-Demand	Anodyne	EPHX2	17	41
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887106	EF	On-Demand	Anodyne	DPP7	43	43
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887109	EF	On-Demand	Anodyne	FKBP1A	38	48
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887109	EF	On-Demand	Anodyne	SLC6A1	69	35
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887109	EF	On-Demand	Anodyne	AMY2	42	29
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887109	EF	On-Demand	Anodyne	EPHX2	17	41
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Nc2ccccc2)C1	ZINC000853887109	EF	On-Demand	Anodyne	DPP7	43	43
Cc1cc(C)c2c(N)c(C(=O)OCCOC(F)F)sc2n1	ZINC000853887159	DF	On-Demand	Clean	CHRM4	32	53
COC[C@H](NC(=O)NOCC(C)C)c1cccc(OC)c1	ZINC000853887163	CE	On-Demand	Anodyne	MTNR1A	42	47
COC[C@H](NC(=O)NOCC(C)C)c1cccc(OC)c1	ZINC000853887163	CE	On-Demand	Anodyne	MTNR1B	45	47
COC[C@@H](NC(=O)NOCC(C)C)c1cccc(OC)c1	ZINC000853887166	CE	On-Demand	Anodyne	MTNR1A	42	47
COC[C@@H](NC(=O)NOCC(C)C)c1cccc(OC)c1	ZINC000853887166	CE	On-Demand	Anodyne	MTNR1B	45	47
C#CCOCCOC(=O)CCc1ccc2ccccc2n1	ZINC000853887169	CE	On-Demand	Mild	CYSLTR1	44	48
Cc1nn(-c2ccccc2)c(C)c1CC(=O)OCCOC(F)F	ZINC000853887196	DF	On-Demand	Anodyne	P2RX7	21	53
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1	ZINC000853887198	EE	On-Demand	Anodyne	PLG	18	42
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1	ZINC000853887198	EE	On-Demand	Anodyne	FKBP1A	95	44
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1	ZINC000853887198	EE	On-Demand	Anodyne	TRY2_BOVIN	50	39
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1	ZINC000853887198	EE	On-Demand	Anodyne	PREP	40	38
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1	ZINC000853887198	EE	On-Demand	Anodyne	AMY2	44	30
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1	ZINC000853887198	EE	On-Demand	Anodyne	LGMN	55	42
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2S(C)(=O)=O)c1	ZINC000853887198	EE	On-Demand	Anodyne	CAPN1	15	44
CC(C)c1cccc(COC(=O)[C@@]23CCC(=O)N2CCS3)c1	ZINC000853887265	DF	On-Demand	Anodyne	SLC12A5	58	33
CC(C)c1cccc(COC(=O)[C@]23CCC(=O)N2CCS3)c1	ZINC000853887266	DF	On-Demand	Anodyne	SLC12A5	58	33
CS(=O)(=O)NCCc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853887289	ED	On-Demand	Anodyne	CA2	26	41
CS(=O)(=O)NCCc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853887289	ED	On-Demand	Anodyne	CA1	25	41
CS(=O)(=O)NCCc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853887289	ED	On-Demand	Anodyne	CA14	15	41
CS(=O)(=O)NCCc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853887289	ED	On-Demand	Anodyne	CA9	18	41
COC(=O)c1cn(CC(=O)OCc2nnc3n2CCOCC3)c2ccccc12	ZINC000853887345	GD	On-Demand	Anodyne	CNR1	20	43
COC(=O)c1cn(CC(=O)OCc2nnc3n2CCOCC3)c2ccccc12	ZINC000853887345	GD	On-Demand	Anodyne	CNR2	26	43
COC(=O)c1cn(CC(=O)OCc2nnc3n2CCOCC3)c2ccccc12	ZINC000853887345	GD	On-Demand	Anodyne	ADCY5	15	40
COC(=O)c1cn(CC(=O)OCc2nnc3n2CCOCC3)c2ccccc12	ZINC000853887345	GD	On-Demand	Anodyne	PTGDS	35	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NCc1ncccc1F	ZINC000853887398	FE	On-Demand	Clean	STAT6	42	31
COc1cccc(C2(NC(=O)NOCC(C)C)CCC2)c1	ZINC000853887419	CF	On-Demand	Anodyne	MTNR1A	36	41
COc1cccc(C2(NC(=O)NOCC(C)C)CCC2)c1	ZINC000853887419	CF	On-Demand	Anodyne	MTNR1B	38	41
CC(=O)N1CCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853887456	CD	On-Demand	Anodyne	SRD5A1	19	44
CC(=O)N1CCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853887456	CD	On-Demand	Anodyne	HSD17B3	44	31
CC(=O)N1CCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853887456	CD	On-Demand	Anodyne	EIF2AK3	51	30
COc1cc(NC(=O)c2ccccc2)c(C(=O)OCCOC(F)F)cc1OC	ZINC000853887476	GG	On-Demand	Anodyne	ABCB1B	25	41
COc1cc(NC(=O)c2ccccc2)c(C(=O)OCCOC(F)F)cc1OC	ZINC000853887476	GG	On-Demand	Anodyne	HDAC1	20	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)OCCOC(F)F)cc1OC	ZINC000853887476	GG	On-Demand	Anodyne	HDAC2	21	42
COc1cc(NC(=O)c2ccccc2)c(C(=O)OCCOC(F)F)cc1OC	ZINC000853887476	GG	On-Demand	Anodyne	KCNK3	55	42
COCCCOc1cccc(CNC(=O)NNc2cc(F)cc(Cl)c2)c1	ZINC000853887500	GH	On-Demand	Reactive	HRH2	27	41
COCCCOc1cccc(CNC(=O)NNc2cc(F)cc(Cl)c2)c1	ZINC000853887500	GH	On-Demand	Reactive	ROCK2	22	42
COCCCOc1cccc(CNC(=O)NNc2cc(F)cc(Cl)c2)c1	ZINC000853887500	GH	On-Demand	Reactive	PDS	70	37
O=C(NCc1ncccc1F)N1CC[C@H](N2CCOC2=O)C1	ZINC000853887509	DC	On-Demand	Anodyne	CALCRL	46	37
O=C(NCc1ncccc1F)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853887511	DC	On-Demand	Anodyne	CALCRL	46	37
NS(=O)(=O)c1cc(C(=O)OCCOC(F)F)ccc1Cl	ZINC000853887527	ED	On-Demand	Anodyne	CA2	34	49
NS(=O)(=O)c1cc(C(=O)OCCOC(F)F)ccc1Cl	ZINC000853887527	ED	On-Demand	Anodyne	CA6	25	44
NS(=O)(=O)c1cc(C(=O)OCCOC(F)F)ccc1Cl	ZINC000853887527	ED	On-Demand	Anodyne	CA1	28	49
NS(=O)(=O)c1cc(C(=O)OCCOC(F)F)ccc1Cl	ZINC000853887527	ED	On-Demand	Anodyne	CA7	29	45
NS(=O)(=O)c1cc(C(=O)OCCOC(F)F)ccc1Cl	ZINC000853887527	ED	On-Demand	Anodyne	CA13	47	45
NS(=O)(=O)c1cc(C(=O)OCCOC(F)F)ccc1Cl	ZINC000853887527	ED	On-Demand	Anodyne	CA4	30	49
CC(C)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853887624	CF	On-Demand	Anodyne	PLA2G4B	79	35
O=C(CCNC(=O)C12CC3CC(CC(C3)C1)C2)OCCOC(F)F	ZINC000853887636	EE	On-Demand	Anodyne	EPHX2	20	40
CS(=O)(=O)N1CCCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853887637	ED	On-Demand	Anodyne	SRD5A1	19	41
O=C(CSc1nc2ccccc2s1)OCCOC(F)F	ZINC000853887658	DG	On-Demand	Anodyne	PPOX	41	39
O=C(CSc1nc2ccccc2s1)OCCOC(F)F	ZINC000853887658	DG	On-Demand	Anodyne	PPXI	52	42
O=C(OCc1nnc2n1CCOCC2)c1cccc(NC(=O)C2CC2)c1	ZINC000853887664	FD	On-Demand	Anodyne	EPHX2	15	45
Cc1cc(C)c2c(N)c(C(=O)OCc3onc(C)c3[N+](=O)[O-])sc2n1	ZINC000853887669	FG	On-Demand	Clean	CHRM4	30	46
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853887672	FF	On-Demand	Anodyne	F2	25	47
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853887672	FF	On-Demand	Anodyne	TRY2_BOVIN	73	47
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853887673	FF	On-Demand	Anodyne	F2	25	47
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853887673	FF	On-Demand	Anodyne	TRY2_BOVIN	73	47
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853887674	FF	On-Demand	Anodyne	F2	25	47
O=C(CNS(=O)(=O)c1ccc2ccccc2c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853887674	FF	On-Demand	Anodyne	TRY2_BOVIN	73	47
CC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887720	DG	On-Demand	Anodyne	FKBP1A	69	37
CC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887720	DG	On-Demand	Anodyne	TRY2_BOVIN	43	45
CC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887720	DG	On-Demand	Anodyne	DPP7	46	36
CC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887720	DG	On-Demand	Anodyne	BIRC2	23	40
CC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887720	DG	On-Demand	Anodyne	SLC12A5	40	37
CC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887721	DG	On-Demand	Anodyne	FKBP1A	69	37
CC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887721	DG	On-Demand	Anodyne	TRY2_BOVIN	43	45
CC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887721	DG	On-Demand	Anodyne	DPP7	46	36
CC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887721	DG	On-Demand	Anodyne	BIRC2	23	40
CC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853887721	DG	On-Demand	Anodyne	SLC12A5	40	37
O=C(OCCOC(F)F)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000853887749	GE	On-Demand	Anodyne	FKBP1A	16	45
O=C(OCCOC(F)F)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1	ZINC000853887750	GE	On-Demand	Anodyne	FKBP1A	16	45
O=C(OCCOC(F)F)c1c[nH]c2cc([N+](=O)[O-])ccc12	ZINC000853887757	DE	On-Demand	Bother	CACNA1D	45	34
C[C@@H]1Oc2ccccc2N(CC(=O)OCCOC(F)F)C1=O	ZINC000853887767	DD	On-Demand	Anodyne	HEMY	27	43
COCCCOc1cccc(CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853887773	GD	On-Demand	Anodyne	HRH2	32	44
COCCCOc1cccc(CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853887773	GD	On-Demand	Anodyne	ROCK1	18	45
COCCCOc1cccc(CNC(=O)NCCc2nnc(S)n2C)c1	ZINC000853887773	GD	On-Demand	Anodyne	ROCK2	23	45
N#Cc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853887785	CE	On-Demand	Mild	FFAR1	30	40
COc1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853887790	CE	On-Demand	Anodyne	CA9	21	44
O=C(OCCOC(F)F)c1cc(F)c(F)cc1Cl	ZINC000853887799	CG	On-Demand	Anodyne	Q9FYV8_MAIZE	37	43
Nc1ccc([N+](=O)[O-])cc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853887833	CE	On-Demand	Bother	CACNA1C	49	42
Nc1ccc([N+](=O)[O-])cc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853887833	CE	On-Demand	Bother	CACNA1D	78	42
Nc1ccc([N+](=O)[O-])cc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853887834	CE	On-Demand	Bother	CACNA1C	49	42
Nc1ccc([N+](=O)[O-])cc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853887834	CE	On-Demand	Bother	CACNA1D	78	42
Nc1ccc([N+](=O)[O-])cc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853887835	CE	On-Demand	Bother	CACNA1C	49	42
Nc1ccc([N+](=O)[O-])cc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853887835	CE	On-Demand	Bother	CACNA1D	78	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ncccc1F	ZINC000853887998	FF	On-Demand	Anodyne	GPR119	45	43
C#CCOCCOC(=O)CNC(=O)c1ccc(OCC)cc1	ZINC000853888005	DD	On-Demand	Mild	PLA2G4B	57	36
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000853888020	FE	On-Demand	Anodyne	PSEN2	62	36
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000853888020	FE	On-Demand	Anodyne	MMP13	20	40
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000853888020	FE	On-Demand	Anodyne	MMP2	25	40
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000853888020	FE	On-Demand	Anodyne	MMP14	18	40
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000853888020	FE	On-Demand	Anodyne	PSEN1	48	36
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000853888020	FE	On-Demand	Anodyne	MMP10	42	35
C[C@@H]1CCN(C(=O)NCc2ncccc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853888024	FD	On-Demand	Anodyne	EPHX2	15	41
C#CCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853888031	EC	On-Demand	Mild	CA2	17	47
NS(=O)(=O)c1cc(C(=O)OCC2C[C@@H]3C[C@H]3C2)ccc1Cl	ZINC000853888049	EE	On-Demand	Anodyne	CA2	19	47
NS(=O)(=O)c1cc(C(=O)OCC2C[C@@H]3C[C@H]3C2)ccc1Cl	ZINC000853888049	EE	On-Demand	Anodyne	CA6	23	43
NS(=O)(=O)c1cc(C(=O)OCC2C[C@@H]3C[C@H]3C2)ccc1Cl	ZINC000853888049	EE	On-Demand	Anodyne	CA1	19	47
NS(=O)(=O)c1cc(C(=O)OCC2C[C@@H]3C[C@H]3C2)ccc1Cl	ZINC000853888049	EE	On-Demand	Anodyne	CA7	24	44
NS(=O)(=O)c1cc(C(=O)OCC2C[C@@H]3C[C@H]3C2)ccc1Cl	ZINC000853888049	EE	On-Demand	Anodyne	CA13	44	44
NS(=O)(=O)c1cc(C(=O)OCC2C[C@@H]3C[C@H]3C2)ccc1Cl	ZINC000853888049	EE	On-Demand	Anodyne	CA4	19	47
NS(=O)(=O)c1cc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888050	EE	On-Demand	Anodyne	CA2	19	47
NS(=O)(=O)c1cc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888050	EE	On-Demand	Anodyne	CA6	23	43
NS(=O)(=O)c1cc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888050	EE	On-Demand	Anodyne	CA1	19	47
NS(=O)(=O)c1cc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888050	EE	On-Demand	Anodyne	CA7	24	44
NS(=O)(=O)c1cc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888050	EE	On-Demand	Anodyne	CA13	44	44
NS(=O)(=O)c1cc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888050	EE	On-Demand	Anodyne	CA4	19	47
NS(=O)(=O)c1cc(C(=O)OCC2C[C@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888051	EE	On-Demand	Anodyne	CA2	19	47
NS(=O)(=O)c1cc(C(=O)OCC2C[C@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888051	EE	On-Demand	Anodyne	CA6	23	43
NS(=O)(=O)c1cc(C(=O)OCC2C[C@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888051	EE	On-Demand	Anodyne	CA1	19	47
NS(=O)(=O)c1cc(C(=O)OCC2C[C@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888051	EE	On-Demand	Anodyne	CA7	24	44
NS(=O)(=O)c1cc(C(=O)OCC2C[C@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888051	EE	On-Demand	Anodyne	CA13	44	44
NS(=O)(=O)c1cc(C(=O)OCC2C[C@H]3C[C@@H]3C2)ccc1Cl	ZINC000853888051	EE	On-Demand	Anodyne	CA4	19	47
O=C(OCCOC(F)F)c1ccc(NC(=O)C2CC2)cc1	ZINC000853888063	CE	On-Demand	Anodyne	ACR	59	35
NS(=O)(=O)c1ccc(NCCC(=O)OCC2C[C@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000853888105	GD	On-Demand	Bother	CA2	22	42
NS(=O)(=O)c1ccc(NCCC(=O)OCC2C[C@@H]3C[C@H]3C2)c([N+](=O)[O-])c1	ZINC000853888106	GD	On-Demand	Bother	CA2	22	42
NS(=O)(=O)c1ccc(NCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000853888107	GD	On-Demand	Bother	CA2	22	42
CCOC(=O)N1CCN(C(=O)[C@@H](C)Sc2n[nH]c(-c3ccccc3F)n2)CC1	ZINC000853888178	HE	On-Demand	Anodyne	P2RY12	115	39
CCOC(=O)N1CCN(C(=O)[C@H](C)Sc2n[nH]c(-c3ccccc3F)n2)CC1	ZINC000853888180	HE	On-Demand	Anodyne	P2RY12	115	39
CCOC(=O)Nc1ccc(C(=O)OCc2nnc3n2CCOCC3)cc1	ZINC000853888186	FD	On-Demand	Anodyne	MTOR	45	39
CCOC(=O)Nc1ccc(C(=O)OCc2nnc3n2CCOCC3)cc1	ZINC000853888186	FD	On-Demand	Anodyne	ACR	43	32
CCC(=O)N[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888190	ED	On-Demand	Anodyne	MMP13	46	38
CCC(=O)N[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888190	ED	On-Demand	Anodyne	MMP3	42	38
CCC(=O)N[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888190	ED	On-Demand	Anodyne	MMP1	48	44
CCC(=O)N[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888190	ED	On-Demand	Anodyne	PROKR1	53	31
CCC(=O)N[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888192	ED	On-Demand	Anodyne	MMP13	46	38
CCC(=O)N[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888192	ED	On-Demand	Anodyne	MMP3	42	38
CCC(=O)N[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888192	ED	On-Demand	Anodyne	MMP1	48	44
CCC(=O)N[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888192	ED	On-Demand	Anodyne	PROKR1	53	31
CCC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888193	ED	On-Demand	Anodyne	MMP13	46	38
CCC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888193	ED	On-Demand	Anodyne	MMP3	42	38
CCC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888193	ED	On-Demand	Anodyne	MMP1	48	44
CCC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888193	ED	On-Demand	Anodyne	PROKR1	53	31
CCC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888195	ED	On-Demand	Anodyne	MMP13	46	38
CCC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888195	ED	On-Demand	Anodyne	MMP3	42	38
CCC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888195	ED	On-Demand	Anodyne	MMP1	48	44
CCC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853888195	ED	On-Demand	Anodyne	PROKR1	53	31
CC(C)c1cccc(COC(=O)C2CCN(S(N)(=O)=O)CC2)c1	ZINC000853888221	ED	On-Demand	Anodyne	FKBP1A	43	37
CC(C)c1cccc(COC(=O)C2CCN(S(N)(=O)=O)CC2)c1	ZINC000853888221	ED	On-Demand	Anodyne	TRY2_BOVIN	31	41
NS(=O)(=O)c1ccc(NCC(=O)OCCOC(F)F)c([N+](=O)[O-])c1	ZINC000853888238	FC	On-Demand	Bother	CA2	59	41
NS(=O)(=O)c1ccc(NCC(=O)OCCOC(F)F)c([N+](=O)[O-])c1	ZINC000853888238	FC	On-Demand	Bother	CA1	45	39
NS(=O)(=O)c1ccc(NCC(=O)OCCOC(F)F)c([N+](=O)[O-])c1	ZINC000853888238	FC	On-Demand	Bother	CA5B	43	33
NS(=O)(=O)c1ccc(NCC(=O)OCCOC(F)F)c([N+](=O)[O-])c1	ZINC000853888238	FC	On-Demand	Bother	CA4	51	41
NS(=O)(=O)c1ccc(NCC(=O)OCCOC(F)F)c([N+](=O)[O-])c1	ZINC000853888238	FC	On-Demand	Bother	CA5A	44	33
CC(C)c1cccc(COC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)c1	ZINC000853888249	GD	On-Demand	Anodyne	INHA	19	40
CC(C)c1cccc(COC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)c1	ZINC000853888250	GD	On-Demand	Anodyne	INHA	19	40
CC(C)c1cccc(COC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c1	ZINC000853888251	GD	On-Demand	Anodyne	INHA	19	40
CC(C)c1cccc(COC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c1	ZINC000853888252	GD	On-Demand	Anodyne	INHA	19	40
Cc1ccccc1[C@@H](CC(=O)OCc1onc(C)c1[N+](=O)[O-])NC(N)=O	ZINC000853888258	FE	On-Demand	Bother	CTSA	53	35
Cc1ccccc1[C@H](CC(=O)OCc1onc(C)c1[N+](=O)[O-])NC(N)=O	ZINC000853888259	FE	On-Demand	Bother	CTSA	53	35
Cn1ncc2c(=O)n(CC(=O)OCCOC(F)F)cnc21	ZINC000853888301	DB	On-Demand	Anodyne	Q9M629_MAIZE	44	35
O=C(OCCOC(F)F)c1ccc([N+](=O)[O-])cc1	ZINC000853888305	CD	On-Demand	Bother	ACR	15	43
C#CCOCCOC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000853888316	DC	On-Demand	Mild	CA2	25	48
C#CCOCCOC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000853888316	DC	On-Demand	Mild	CA6	23	42
C#CCOCCOC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000853888316	DC	On-Demand	Mild	CA1	26	46
C#CCOCCOC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000853888316	DC	On-Demand	Mild	CA7	25	44
C#CCOCCOC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000853888316	DC	On-Demand	Mild	CA13	45	44
C#CCOCCOC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000853888316	DC	On-Demand	Mild	CA4	30	46
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000853888339	GG	On-Demand	Anodyne	PSEN2	60	36
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1	ZINC000853888339	GG	On-Demand	Anodyne	PSEN1	47	36
O=Cc1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853888343	CD	On-Demand	Anodyne	PLA2G4B	68	33
COCCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853888344	FD	On-Demand	Anodyne	CA2	30	47
COCCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853888344	FD	On-Demand	Anodyne	TBXA2R	41	35
COCCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853888344	FD	On-Demand	Anodyne	CA1	22	47
COCCNS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853888344	FD	On-Demand	Anodyne	CA4	18	47
COCCCOc1cccc(CNC(=O)NNc2cc(F)ccc2C)c1	ZINC000853888363	FG	On-Demand	Reactive	HRH2	26	40
COCCCOc1cccc(CNC(=O)NNc2cc(F)ccc2C)c1	ZINC000853888363	FG	On-Demand	Reactive	ROCK2	20	42
COCCCOc1cccc(CNC(=O)NNc2cc(F)ccc2C)c1	ZINC000853888363	FG	On-Demand	Reactive	PDS	45	38
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)OCCOC(F)F	ZINC000853888379	EE	On-Demand	Anodyne	EPHX2	15	51
O=C(CC12CC3CC(CC(C3)C1)C2)NCC(=O)OCCOC(F)F	ZINC000853888379	EE	On-Demand	Anodyne	BOTA	25	44
O=C(OCCOC(F)F)c1c[nH]c2ccc(Br)cc12	ZINC000853888430	EG	On-Demand	Anodyne	MPO	45	36
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853888457	EF	On-Demand	Anodyne	CTSB	23	44
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853888457	EF	On-Demand	Anodyne	CTSG	32	43
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853888457	EF	On-Demand	Anodyne	CTSL	18	44
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853888457	EF	On-Demand	Anodyne	CTRB1	45	46
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853888457	EF	On-Demand	Anodyne	CELA2A	30	46
CC[C@H](C)[C@H](NC(=O)c1ccccc1)C(=O)OCCOC(F)F	ZINC000853888457	EF	On-Demand	Anodyne	CTRB_BOVIN	48	34
C#CCOCCOC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000853888481	ED	On-Demand	Mild	SFRP1	60	34
O=C(CCNS(=O)(=O)c1cccnc1)OCCOC(F)F	ZINC000853888508	DC	On-Demand	Anodyne	TBXAS1	57	44
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000853888511	FD	On-Demand	Anodyne	PREP	85	43
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000853888512	FD	On-Demand	Anodyne	PREP	85	43
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2c2ncccn2)c1	ZINC000853888516	EG	On-Demand	Anodyne	FKBP1A	91	40
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2c2ncccn2)c1	ZINC000853888516	EG	On-Demand	Anodyne	GRIN2B	16	41
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2c2ncccn2)c1	ZINC000853888516	EG	On-Demand	Anodyne	PREP	42	38
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2c2ncccn2)c1	ZINC000853888516	EG	On-Demand	Anodyne	LGMN	38	40
CC(C)c1cccc(COC(=O)[C@H]2CCCN2c2ncccn2)c1	ZINC000853888517	EG	On-Demand	Anodyne	FKBP1A	91	40
CC(C)c1cccc(COC(=O)[C@H]2CCCN2c2ncccn2)c1	ZINC000853888517	EG	On-Demand	Anodyne	GRIN2B	16	41
CC(C)c1cccc(COC(=O)[C@H]2CCCN2c2ncccn2)c1	ZINC000853888517	EG	On-Demand	Anodyne	PREP	42	38
CC(C)c1cccc(COC(=O)[C@H]2CCCN2c2ncccn2)c1	ZINC000853888517	EG	On-Demand	Anodyne	LGMN	38	40
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853888527	GG	On-Demand	Anodyne	LTB4R	30	40
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853888527	GG	On-Demand	Anodyne	HDAC3	16	42
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853888527	GG	On-Demand	Anodyne	HDAC6	17	42
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853888527	GG	On-Demand	Anodyne	SLC1A1	19	42
O=C(COc1c(CO)cc(F)cc1CO)Nc1ccc(-c2ccccc2)cc1	ZINC000853888527	GG	On-Demand	Anodyne	SLC1A2	42	42
O=C(OCCOC(F)F)C1CCN(C(=O)c2ccoc2)CC1	ZINC000853888574	DD	On-Demand	Anodyne	L3MBTL3	52	34
COCCCOc1cccc(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)c1	ZINC000853888582	GF	On-Demand	Reactive	HRH2	26	41
COCCCOc1cccc(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)c1	ZINC000853888582	GF	On-Demand	Reactive	CACNA1C	49	42
COCCCOc1cccc(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)c1	ZINC000853888582	GF	On-Demand	Reactive	CACNA1D	81	42
COCCCOc1cccc(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)c1	ZINC000853888582	GF	On-Demand	Reactive	ROCK2	19	42
COCCCOc1cccc(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)c1	ZINC000853888582	GF	On-Demand	Reactive	PDS	37	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCc2ncccc2F)C1	ZINC000853888596	FE	On-Demand	Anodyne	GPR119	27	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCc2ncccc2F)C1	ZINC000853888597	FE	On-Demand	Anodyne	GPR119	27	40
C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCCOC(F)F	ZINC000853888617	GC	On-Demand	Anodyne	CA2	29	48
C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCCOC(F)F	ZINC000853888617	GC	On-Demand	Anodyne	CA1	15	48
C[C@@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCCOC(F)F	ZINC000853888618	GC	On-Demand	Anodyne	CA2	29	48
C[C@@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCCOC(F)F	ZINC000853888618	GC	On-Demand	Anodyne	CA1	15	48
C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853888638	GD	On-Demand	Anodyne	CA2	15	44
C[C@@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853888639	GD	On-Demand	Anodyne	CA2	15	44
C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853888640	GD	On-Demand	Anodyne	CA2	15	44
C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853888641	GD	On-Demand	Anodyne	CA2	15	44
Nc1ccc([N+](=O)[O-])cc1C(=O)OCCOC(F)F	ZINC000853888648	CD	On-Demand	Bother	CACNA1D	59	36
C#CCOCCOC(=O)COc1ccc(C=O)cc1	ZINC000853888650	CD	On-Demand	Mild	PLA2G4B	49	32
CCOC(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853888705	DF	On-Demand	Anodyne	ACR	67	41
COCCCOc1cccc(CNC(=O)NNc2ccc(C)c(F)c2)c1	ZINC000853888707	FG	On-Demand	Reactive	HRH2	29	41
COCCCOc1cccc(CNC(=O)NNc2ccc(C)c(F)c2)c1	ZINC000853888707	FG	On-Demand	Reactive	ROCK2	27	43
COCCCOc1cccc(CNC(=O)NNc2ccc(C)c(F)c2)c1	ZINC000853888707	FG	On-Demand	Reactive	PDS	59	36
C[C@H](Sc1n[nH]c(-c2ccccc2F)n1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853888735	HI	On-Demand	Anodyne	KCNQ2	16	42
C[C@H](Sc1n[nH]c(-c2ccccc2F)n1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853888735	HI	On-Demand	Anodyne	PRNP	45	34
COCCCOc1cccc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853888739	FG	On-Demand	Anodyne	HRH2	32	43
COCCCOc1cccc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853888739	FG	On-Demand	Anodyne	PDS	49	35
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853888740	FG	On-Demand	Anodyne	HRH2	32	43
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853888740	FG	On-Demand	Anodyne	PDS	49	35
COCCCOc1cccc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853888741	FG	On-Demand	Anodyne	HRH2	32	43
COCCCOc1cccc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853888741	FG	On-Demand	Anodyne	PDS	49	35
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853888742	FG	On-Demand	Anodyne	HRH2	32	43
COCCCOc1cccc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853888742	FG	On-Demand	Anodyne	PDS	49	35
C[C@@H](Sc1n[nH]c(-c2ccccc2F)n1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853888749	HI	On-Demand	Anodyne	KCNQ2	16	42
C[C@@H](Sc1n[nH]c(-c2ccccc2F)n1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853888749	HI	On-Demand	Anodyne	PRNP	45	34
O=C(OCCOC(F)F)c1ccc(N2CCOCC2)nc1	ZINC000853888765	DD	On-Demand	Anodyne	ADK	41	37
O=C(OCCOC(F)F)c1ccc(N2CCOCC2)nc1	ZINC000853888765	DD	On-Demand	Anodyne	HPGDS	15	45
O=C(NCc1ncccc1F)N1CCC(N2CCOC2=O)CC1	ZINC000853888794	DD	On-Demand	Anodyne	CALCRL	57	39
CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853888810	GG	On-Demand	Anodyne	AMY2	45	32
Cc1ccccc1[C@@H](CC(=O)OCCOC(F)F)NC(N)=O	ZINC000853888819	DD	On-Demand	Anodyne	CTSA	67	38
Cc1ccccc1[C@H](CC(=O)OCCOC(F)F)NC(N)=O	ZINC000853888821	DD	On-Demand	Anodyne	CTSA	67	38
CC(C)c1cccc(COC(=O)CCc2nnc(-c3ccccc3)o2)c1	ZINC000853888840	FJ	On-Demand	Anodyne	PPARG	41	36
CC(C)c1cccc(COC(=O)CCc2nnc(-c3ccccc3)o2)c1	ZINC000853888840	FJ	On-Demand	Anodyne	PPARA	42	36
CC(C)c1cccc(COC(=O)CCc2nnc(-c3ccccc3)o2)c1	ZINC000853888840	FJ	On-Demand	Anodyne	NPR	42	32
CC(C)c1cccc(COC(=O)CCc2nnc(-c3ccccc3)o2)c1	ZINC000853888840	FJ	On-Demand	Anodyne	CARM1	16	40
CC(C)c1cccc(COC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)c1	ZINC000853888861	GD	On-Demand	Anodyne	MAOB	15	44
Cc1ccccc1[C@H](CC(=O)OCc1nnc2n1CCOCC2)NC(N)=O	ZINC000853888891	FD	On-Demand	Anodyne	CTSA	55	37
Cc1ccccc1[C@@H](CC(=O)OCc1nnc2n1CCOCC2)NC(N)=O	ZINC000853888892	FD	On-Demand	Anodyne	CTSA	55	37
CCOc1ccc(-c2nc(CC(=O)OCCOC(F)F)cs2)cc1	ZINC000853888960	FH	On-Demand	Anodyne	PPARD	22	42
O=C(CCCOc1ccc(F)cc1)OCCOC(F)F	ZINC000853888961	CF	On-Demand	Anodyne	PLA2G4B	58	34
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853888972	GD	On-Demand	Anodyne	F10	15	42
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853888972	GD	On-Demand	Anodyne	MMP13	22	41
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853888972	GD	On-Demand	Anodyne	MMP1	17	42
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853888972	GD	On-Demand	Anodyne	PROKR1	46	30
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)NCC2CC2)c1	ZINC000853888981	ED	On-Demand	Anodyne	NPY5R	23	40
COc1ccc2cc(C(=O)OCCOC(F)F)[nH]c2c1	ZINC000853888984	CF	On-Demand	Anodyne	TUBB2B	38	42
NC(=O)COc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853888986	CC	On-Demand	Anodyne	PLA2G4B	22	40
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccoc3)CC2)c1	ZINC000853889003	FH	On-Demand	Anodyne	TRY2_BOVIN	26	40
COc1ccc2c(NC[C@@H]3CCO[C@H]3c3nccn3C)ccnc2c1	ZINC000853889006	EG	On-Demand	Anodyne	HRP1_PLAFA	101	39
COc1ccc2c(NC[C@@H]3CCO[C@H]3c3nccn3C)ccnc2c1	ZINC000853889006	EG	On-Demand	Anodyne	HNMT	58	33
O=C(OCCOC(F)F)c1cc2cc(Cl)ccc2[nH]1	ZINC000853889012	CG	On-Demand	Anodyne	PYGL	81	50
C#CCOCCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889016	GD	On-Demand	Mild	FKBP1A	46	53
C#CCOCCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889016	GD	On-Demand	Mild	MMP13	19	40
C#CCOCCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889016	GD	On-Demand	Mild	MMP3	15	40
C#CCOCCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889016	GD	On-Demand	Mild	MMP7	25	40
C#CCOCCOC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889016	GD	On-Demand	Mild	MMP1	22	40
C#CCOCCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889017	GD	On-Demand	Mild	FKBP1A	46	53
C#CCOCCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889017	GD	On-Demand	Mild	MMP13	19	40
C#CCOCCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889017	GD	On-Demand	Mild	MMP3	15	40
C#CCOCCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889017	GD	On-Demand	Mild	MMP7	25	40
C#CCOCCOC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000853889017	GD	On-Demand	Mild	MMP1	22	40
CCC(=O)N[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889026	CF	On-Demand	Anodyne	CTSB	41	36
CCC(=O)N[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889026	CF	On-Demand	Anodyne	CAPNS1	55	34
CCC(=O)N[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889026	CF	On-Demand	Anodyne	CAPN1	60	37
CCC(=O)N[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889026	CF	On-Demand	Anodyne	CAPN2	98	38
CCC(=O)N[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889026	CF	On-Demand	Anodyne	NPR	53	34
CCC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889027	CF	On-Demand	Anodyne	CTSB	41	36
CCC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889027	CF	On-Demand	Anodyne	CAPNS1	55	34
CCC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889027	CF	On-Demand	Anodyne	CAPN1	60	37
CCC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889027	CF	On-Demand	Anodyne	CAPN2	98	38
CCC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853889027	CF	On-Demand	Anodyne	NPR	53	34
O=C(OCCOC(F)F)c1ccc(F)c(S(=O)(=O)NC2CC2)c1	ZINC000853889061	FD	On-Demand	Anodyne	SFRP1	51	33
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000853889064	DE	On-Demand	Anodyne	ACE	43	41
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000853889064	DE	On-Demand	Anodyne	FKBP1A	95	49
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000853889064	DE	On-Demand	Anodyne	DPP4	16	47
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000853889064	DE	On-Demand	Anodyne	PREP	104	47
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000853889064	DE	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000853889065	DE	On-Demand	Anodyne	ACE	43	41
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000853889065	DE	On-Demand	Anodyne	FKBP1A	95	49
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000853889065	DE	On-Demand	Anodyne	DPP4	16	47
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000853889065	DE	On-Demand	Anodyne	PREP	104	47
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000853889065	DE	On-Demand	Anodyne	TMPRSS11D	51	33
O=C(OCCOC(F)F)[C@@H]1CCCCN1c1ncccn1	ZINC000853889085	DD	On-Demand	Anodyne	FKBP1A	56	40
O=C(OCCOC(F)F)[C@H]1CCCCN1c1ncccn1	ZINC000853889086	DD	On-Demand	Anodyne	FKBP1A	56	40
CC(C)c1cccc(COC(=O)Cn2cc([N+](=O)[O-])cn2)c1	ZINC000853889091	DF	On-Demand	Bother	CACNA1D	42	34
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000853889097	EF	On-Demand	Anodyne	FKBP1A	80	44
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1cccs1	ZINC000853889097	EF	On-Demand	Anodyne	PREP	55	34
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000853889098	EF	On-Demand	Anodyne	FKBP1A	80	44
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1cccs1	ZINC000853889098	EF	On-Demand	Anodyne	PREP	55	34
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)NC2CCCC2)c1	ZINC000853889100	FE	On-Demand	Anodyne	SFRP1	88	35
O=C(OCCOC(F)F)c1cccc(S(=O)(=O)NC2CCCC2)c1	ZINC000853889100	FE	On-Demand	Anodyne	WNT3	53	33
CC(C)c1cccc(COC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c1	ZINC000853889116	FE	On-Demand	Anodyne	MAOB	15	42
C#CCOCCOC(=O)[C@H]1CCCCN1c1ncccn1	ZINC000853889118	CD	On-Demand	Mild	FKBP1A	49	39
C#CCOCCOC(=O)[C@@H]1CCCCN1c1ncccn1	ZINC000853889119	CD	On-Demand	Mild	FKBP1A	49	39
CC(C)c1cccc(COC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)c1	ZINC000853889142	FE	On-Demand	Anodyne	MAOB	16	43
CC(C)c1cccc(COC(=O)CCNS(=O)(=O)c2cccnc2)c1	ZINC000853889145	FF	On-Demand	Anodyne	TBXA2R	26	41
CC(C)c1cccc(COC(=O)CCNS(=O)(=O)c2cccnc2)c1	ZINC000853889145	FF	On-Demand	Anodyne	TBXAS1	58	46
C#CCOCCOC(=O)CCOc1ccc(C(C)=O)cc1	ZINC000853889156	CD	On-Demand	Mild	PLA2G4B	50	34
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000853889164	EE	On-Demand	Anodyne	CA2	21	45
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000853889164	EE	On-Demand	Anodyne	CA14	15	45
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	FKBP1A	79	65
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	ITGA4	33	44
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	CAPNS1	21	42
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	CAPN1	18	48
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	MMP7	42	38
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	MMP1	34	41
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	SFRP1	41	30
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889168	ED	On-Demand	Anodyne	WNT3	47	30
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	FKBP1A	79	65
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	ITGA4	33	44
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	CAPNS1	21	42
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	CAPN1	18	48
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	MMP7	42	38
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	MMP1	34	41
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	SFRP1	41	30
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1ccccc1	ZINC000853889169	ED	On-Demand	Anodyne	WNT3	47	30
O=C(OCc1nnc2n1CCOCC2)c1cccc(Nc2ncccn2)c1	ZINC000853889194	FD	On-Demand	Anodyne	STAT6	51	31
C[C@@H](Oc1ccccc1C#N)C(=O)OCCOC(F)F	ZINC000853889212	CE	On-Demand	Mild	ADRB1	41	32
O=C(OCCOC(F)F)[C@H]1CCCN1c1ncccn1	ZINC000853889248	CD	On-Demand	Anodyne	FKBP1A	41	40
O=C(OCCOC(F)F)[C@@H]1CCCN1c1ncccn1	ZINC000853889249	CD	On-Demand	Anodyne	FKBP1A	41	40
CC(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853889268	DE	On-Demand	Anodyne	PLA2G4B	69	35
CC(C)c1cccc(COC(=O)C2CCN(c3cnccn3)CC2)c1	ZINC000853889291	EH	On-Demand	Anodyne	PDE6D	53	36
O=C(CCNC(=O)c1ccc2ccccc2c1)OCc1nnc2n1CCOCC2	ZINC000853889311	GD	On-Demand	Anodyne	DRD4	42	32
O=C(CCNC(=O)c1ccc2ccccc2c1)OCc1nnc2n1CCOCC2	ZINC000853889311	GD	On-Demand	Anodyne	NMT1	19	40
C=CCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853889341	GG	On-Demand	Mild	MMP1	15	42
C=CCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853889342	GG	On-Demand	Mild	MMP1	15	42
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889357	EH	On-Demand	Anodyne	FKBP1A	56	37
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889357	EH	On-Demand	Anodyne	TRY2_BOVIN	35	45
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889357	EH	On-Demand	Anodyne	PREP	53	40
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889357	EH	On-Demand	Anodyne	DPP7	41	36
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889358	EH	On-Demand	Anodyne	FKBP1A	56	37
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889358	EH	On-Demand	Anodyne	TRY2_BOVIN	35	45
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889358	EH	On-Demand	Anodyne	PREP	53	40
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)C3CC3)C2)c1	ZINC000853889358	EH	On-Demand	Anodyne	DPP7	41	36
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889446	EE	On-Demand	Anodyne	FKBP1A	55	43
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889446	EE	On-Demand	Anodyne	SLC6A1	74	39
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889446	EE	On-Demand	Anodyne	PREP	60	40
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889446	EE	On-Demand	Anodyne	AMY2	42	29
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889446	EE	On-Demand	Anodyne	DPP7	44	39
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889446	EE	On-Demand	Anodyne	BIRC2	15	43
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889447	EE	On-Demand	Anodyne	FKBP1A	55	43
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889447	EE	On-Demand	Anodyne	SLC6A1	74	39
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889447	EE	On-Demand	Anodyne	PREP	60	40
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889447	EE	On-Demand	Anodyne	AMY2	42	29
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889447	EE	On-Demand	Anodyne	DPP7	44	39
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC000853889447	EE	On-Demand	Anodyne	BIRC2	15	43
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000853889463	FD	On-Demand	Anodyne	FKBP1A	23	43
O=C(OCCOC(F)F)C1CCN(S(=O)(=O)c2cccnc2)CC1	ZINC000853889463	FD	On-Demand	Anodyne	NAMPT	46	44
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl	ZINC000853889490	GG	On-Demand	Anodyne	FKBP1A	54	39
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl	ZINC000853889491	GG	On-Demand	Anodyne	FKBP1A	54	39
O=C(COc1cccc(NC(=O)c2ccco2)c1)OCCOC(F)F	ZINC000853889495	FF	On-Demand	Anodyne	KISS1R	49	36
O=C(COc1cccc(NC(=O)c2ccco2)c1)OCCOC(F)F	ZINC000853889495	FF	On-Demand	Anodyne	KCNK3	28	46
O=C(OCCOC(F)F)c1ccc(OCC(F)(F)F)cc1	ZINC000853889496	DG	On-Demand	Anodyne	ACR	42	38
O=C(OCc1nnc2n1CCOCC2)c1cn(-c2ccccc2)nn1	ZINC000853889508	EC	On-Demand	Anodyne	ESRRA	23	42
O=C(/C=C/c1ccccc1OC(F)(F)F)OCCOC(F)F	ZINC000853889602	EG	On-Demand	Anodyne	AKR1B10	38	41
O=C(/C=C\c1ccccc1OC(F)(F)F)OCCOC(F)F	ZINC000853889603	EG	On-Demand	Anodyne	AKR1B10	38	41
O=C(COc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853889616	CD	On-Demand	Bother	CACNA1C	44	38
O=C(COc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853889616	CD	On-Demand	Bother	CACNA1D	74	38
O=C(COc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853889616	CD	On-Demand	Bother	ACR	19	45
CCOc1ccc(-c2nc(C)c(C(=O)OCCOC(F)F)s2)cc1	ZINC000853889627	FH	On-Demand	Anodyne	PPARG	41	33
CCOc1ccc(-c2nc(C)c(C(=O)OCCOC(F)F)s2)cc1	ZINC000853889627	FH	On-Demand	Anodyne	PPARA	19	40
CCOc1ccc(-c2nc(C)c(C(=O)OCCOC(F)F)s2)cc1	ZINC000853889627	FH	On-Demand	Anodyne	PPARD	23	40
O=C(OCCOC(F)F)c1cn(-c2ccccc2)nn1	ZINC000853889677	CD	On-Demand	Anodyne	ESRRA	26	48
O=C(COc1cccc(NC(=O)C2CC2)c1)OCc1nnc2n1CCOCC2	ZINC000853889712	GD	On-Demand	Anodyne	EPHX2	17	52
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000853889747	GG	On-Demand	Anodyne	FKBP1A	52	39
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000853889747	GG	On-Demand	Anodyne	PREP	45	41
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000853889747	GG	On-Demand	Anodyne	CACNA1I	40	37
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000853889748	GG	On-Demand	Anodyne	FKBP1A	52	39
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000853889748	GG	On-Demand	Anodyne	PREP	45	41
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1	ZINC000853889748	GG	On-Demand	Anodyne	CACNA1I	40	37
O=C(OCCOC(F)F)[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853889769	DD	On-Demand	Anodyne	INHA	19	45
O=C(OCCOC(F)F)[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853889770	DD	On-Demand	Anodyne	INHA	19	45
O=C(COc1cccc(NC(=O)C2CC2)c1)OCCOC(F)F	ZINC000853889845	EE	On-Demand	Anodyne	EPHX2	21	48
C#CCOCCOC(=O)c1cc(S(=O)(=O)NC(C)C)ccc1F	ZINC000853889866	ED	On-Demand	Mild	LEF	34	40
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1	ZINC000853889877	GG	On-Demand	Anodyne	FKBP1A	57	39
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1	ZINC000853889877	GG	On-Demand	Anodyne	PREP	37	41
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1	ZINC000853889878	GG	On-Demand	Anodyne	FKBP1A	57	39
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1	ZINC000853889878	GG	On-Demand	Anodyne	PREP	37	41
FC(F)(F)c1cnc(N2CCn3ncc(Br)c3C2)s1	ZINC000853889884	FG	On-Demand	Anodyne	MLYCD	60	38
N#Cc1ccc(N2CCn3ncc(Br)c3C2)cc1C(F)(F)F	ZINC000853889976	FH	On-Demand	Mild	AR	45	41
CCOC(=O)NCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853889978	FD	On-Demand	Anodyne	MMP1	18	44
CCOC(=O)NCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853889978	FD	On-Demand	Anodyne	PROKR1	62	33
CCOC(=O)NCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853889979	FD	On-Demand	Anodyne	MMP1	18	44
CCOC(=O)NCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853889979	FD	On-Demand	Anodyne	PROKR1	62	33
CC(C)c1cccc(COC(=O)CNC(=O)C2CC2)c1	ZINC000853889988	CE	On-Demand	Anodyne	MTNR1A	23	43
CC(C)c1cccc(COC(=O)CNC(=O)C2CC2)c1	ZINC000853889988	CE	On-Demand	Anodyne	MTNR1B	23	43
CC(C)c1cccc(COC(=O)CCCNC(=O)C2CC2)c1	ZINC000853890003	DG	On-Demand	Anodyne	MTNR1A	26	41
CC(C)c1cccc(COC(=O)CCCNC(=O)C2CC2)c1	ZINC000853890003	DG	On-Demand	Anodyne	MTNR1B	24	41
O=C(OCCOC(F)F)C1CCN(C(=O)CCc2ccccc2)CC1	ZINC000853890012	FF	On-Demand	Anodyne	FKBP1A	44	39
O=C(OCCOC(F)F)C1CCN(C(=O)CCc2ccccc2)CC1	ZINC000853890012	FF	On-Demand	Anodyne	GRIN2B	18	48
O=C(OCCOC(F)F)C1CCN(C(=O)CCc2ccccc2)CC1	ZINC000853890012	FF	On-Demand	Anodyne	C3AR1	40	40
O=C(OCCOC(F)F)C1CCN(C(=O)CCc2ccccc2)CC1	ZINC000853890012	FF	On-Demand	Anodyne	PREP	50	40
CCO[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890044	DD	On-Demand	Anodyne	MMP1	18	43
CCO[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890045	DD	On-Demand	Anodyne	MMP1	18	43
CC(C)c1cccc(COC(=O)C2CCN(C(=O)N3CCCC3)CC2)c1	ZINC000853890070	FH	On-Demand	Anodyne	FKBP1A	50	39
CC(C)c1cccc(COC(=O)C2CCN(C(=O)N3CCCC3)CC2)c1	ZINC000853890070	FH	On-Demand	Anodyne	TRY2_BOVIN	36	41
CC(C)c1cccc(COC(=O)C2CCN(C(=O)N3CCCC3)CC2)c1	ZINC000853890070	FH	On-Demand	Anodyne	LIPE	25	40
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853890087	FH	On-Demand	Anodyne	CCR5	26	41
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853890087	FH	On-Demand	Anodyne	BIRC8	47	34
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853890088	FH	On-Demand	Anodyne	CCR5	26	41
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853890088	FH	On-Demand	Anodyne	BIRC8	47	34
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853890089	FH	On-Demand	Anodyne	CCR5	26	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853890089	FH	On-Demand	Anodyne	BIRC8	47	34
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853890090	FH	On-Demand	Anodyne	CCR5	26	41
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853890090	FH	On-Demand	Anodyne	BIRC8	47	34
O=C(CCCc1ccccc1)OCc1nnc2n1CCOCC2	ZINC000853890095	DD	On-Demand	Anodyne	PREP	44	36
O=C(CCCc1ccccc1)OCc1nnc2n1CCOCC2	ZINC000853890095	DD	On-Demand	Anodyne	FAAH	43	38
O=C(CCCc1ccccc1)OCc1nnc2n1CCOCC2	ZINC000853890095	DD	On-Demand	Anodyne	CES1	47	32
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000853890096	GF	On-Demand	Anodyne	FKBP1A	71	43
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000853890096	GF	On-Demand	Anodyne	PREP	56	35
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000853890097	GF	On-Demand	Anodyne	FKBP1A	71	43
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F	ZINC000853890097	GF	On-Demand	Anodyne	PREP	56	35
O=C(NCCO)c1ccc(N2CCn3ncc(Br)c3C2)nn1	ZINC000853890110	FC	On-Demand	Anodyne	SCD1	53	45
O=C(NCCO)c1ccc(N2CCn3ncc(Br)c3C2)nn1	ZINC000853890110	FC	On-Demand	Anodyne	SCD	44	41
O=C(C[C@H](NC(=O)c1ccc(O)cc1)c1ccccc1)OCCOC(F)F	ZINC000853890126	GG	On-Demand	Anodyne	UTS2	48	36
O=C(C[C@@H](NC(=O)c1ccc(O)cc1)c1ccccc1)OCCOC(F)F	ZINC000853890128	GG	On-Demand	Anodyne	UTS2	48	36
COCCS(=O)(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890130	GC	On-Demand	Anodyne	MMP13	41	38
COCCS(=O)(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890130	GC	On-Demand	Anodyne	MMP1	36	44
COCCS(=O)(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890132	GC	On-Demand	Anodyne	MMP13	41	38
COCCS(=O)(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890132	GC	On-Demand	Anodyne	MMP1	36	44
CNc1nc(C)ccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890134	FE	On-Demand	Anodyne	PROKR1	58	32
CNc1nc(C)ccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853890136	FE	On-Demand	Anodyne	PROKR1	58	32
O=C(OCCOC(F)F)C1CCN(C(=O)COc2ccccc2)CC1	ZINC000853890168	FE	On-Demand	Anodyne	CPT1A	122	42
O=C(OCCOC(F)F)C1CCN(C(=O)COc2ccccc2)CC1	ZINC000853890168	FE	On-Demand	Anodyne	CPT2	49	40
COc1ccc2c(c1)C[C@H](C(=O)OCCOC(F)F)CO2	ZINC000853890185	DE	On-Demand	Anodyne	MTNR1A	15	49
COc1ccc2c(c1)C[C@H](C(=O)OCCOC(F)F)CO2	ZINC000853890185	DE	On-Demand	Anodyne	ROCK2	30	45
COc1ccc2c(c1)C[C@@H](C(=O)OCCOC(F)F)CO2	ZINC000853890186	DE	On-Demand	Anodyne	MTNR1A	15	49
COc1ccc2c(c1)C[C@@H](C(=O)OCCOC(F)F)CO2	ZINC000853890186	DE	On-Demand	Anodyne	ROCK2	30	45
COc1ccc2c(c1)C[C@@H](C(=O)OCc1onc(C)c1[N+](=O)[O-])CO2	ZINC000853890188	EE	On-Demand	Bother	ROCK2	22	41
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000853890204	GH	On-Demand	Anodyne	L3MBTL3	42	33
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000853890205	GH	On-Demand	Anodyne	L3MBTL3	42	33
Cc1ccc(C(=O)N2CCC[C@H](C(=O)OCCOC(F)F)C2)cc1	ZINC000853890217	EF	On-Demand	Anodyne	L3MBTL3	51	38
CCOC(=O)NCCC(=O)OCc1cccc(C(C)C)c1	ZINC000853890228	CF	On-Demand	Anodyne	CAPN2	74	35
CCOC(=O)NCCC(=O)OCc1cccc(C(C)C)c1	ZINC000853890228	CF	On-Demand	Anodyne	NPR	63	38
CCOC(=O)NCCC(=O)OCc1cccc(C(C)C)c1	ZINC000853890228	CF	On-Demand	Anodyne	PDS	28	40
O=C(OCc1nnc2n1CCOCC2)c1cccc(NC(=O)C2CCCCC2)c1	ZINC000853890260	GF	On-Demand	Anodyne	CASR	15	43
O=C(OCc1nnc2n1CCOCC2)c1cccc(NC(=O)C2CCCCC2)c1	ZINC000853890260	GF	On-Demand	Anodyne	EPHX2	16	50
CC(C)c1cccc(COC(=O)C2(O)CCCC2)c1	ZINC000853890294	CG	On-Demand	Anodyne	SLC12A5	71	38
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853890312	ED	On-Demand	Anodyne	FKBP1A	76	45
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853890312	ED	On-Demand	Anodyne	PREP	84	35
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853890314	ED	On-Demand	Anodyne	FKBP1A	76	45
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853890314	ED	On-Demand	Anodyne	PREP	84	35
O=C(CCCc1nnc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853890347	EF	On-Demand	Anodyne	CES1	15	40
CC(C)c1cccc(COC(=O)CCc2nc(-c3ccccn3)no2)c1	ZINC000853890348	FH	On-Demand	Anodyne	FAAH	22	43
CC(C)c1cccc(COC(=O)CCc2nc(-c3ccccn3)no2)c1	ZINC000853890348	FH	On-Demand	Anodyne	CES1	15	43
O=C(CCCc1ncc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853890349	EG	On-Demand	Anodyne	FAAH	64	40
O=C(CCCc1ncc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853890349	EG	On-Demand	Anodyne	CES1	35	42
O=C(CCCc1ncc(-c2ccccc2)o1)OCCOC(F)F	ZINC000853890349	EG	On-Demand	Anodyne	CES1D	54	32
O=C(OCCOC(F)F)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853890350	FF	On-Demand	Anodyne	FKBP1A	48	39
O=C(OCCOC(F)F)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853890350	FF	On-Demand	Anodyne	GRIN2B	36	48
O=C(OCCOC(F)F)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853890350	FF	On-Demand	Anodyne	PREP	37	46
O=C(OCCOC(F)F)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853890350	FF	On-Demand	Anodyne	TGM2	32	41
O=C(OCCOC(F)F)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853890350	FF	On-Demand	Anodyne	F13A1	37	41
O=C(OCCOC(F)F)C1CCN(C(=O)OCc2ccccc2)CC1	ZINC000853890350	FF	On-Demand	Anodyne	SLC12A5	45	36
CS(=O)(=O)Nc1ccc(F)cc1C(=O)OCCOC(F)F	ZINC000853890362	ED	On-Demand	Anodyne	TRPV1	61	36
COc1ccc2c(c1)C[C@@H](C(=O)OCc1nnc3n1CCOCC3)CO2	ZINC000853890399	FD	On-Demand	Anodyne	ROCK2	23	41
CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853890401	CD	On-Demand	Anodyne	FKBP1A	59	47
CC(C)(C)C(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853890402	CD	On-Demand	Anodyne	FKBP1A	59	47
O=C(OCCOC(F)F)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890437	FD	On-Demand	Anodyne	FKBP1A	38	46
O=C(OCCOC(F)F)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890437	FD	On-Demand	Anodyne	SLC6A1	79	35
O=C(OCCOC(F)F)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890437	FD	On-Demand	Anodyne	SFRP1	68	36
O=C(OCCOC(F)F)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890437	FD	On-Demand	Anodyne	WNT3	47	31
O=C(OCCOC(F)F)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890438	FD	On-Demand	Anodyne	FKBP1A	38	46
O=C(OCCOC(F)F)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890438	FD	On-Demand	Anodyne	SLC6A1	79	35
O=C(OCCOC(F)F)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890438	FD	On-Demand	Anodyne	SFRP1	68	36
O=C(OCCOC(F)F)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1	ZINC000853890438	FD	On-Demand	Anodyne	WNT3	47	31
O=C(CCOc1cccc([N+](=O)[O-])c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853890452	DF	On-Demand	Bother	CACNA1C	54	40
O=C(CCOc1cccc([N+](=O)[O-])c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853890452	DF	On-Demand	Bother	CACNA1D	88	40
O=C(CCOc1cccc([N+](=O)[O-])c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853890452	DF	On-Demand	Bother	ACR	18	43
O=C(CCOc1cccc([N+](=O)[O-])c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853890453	DF	On-Demand	Bother	CACNA1C	54	40
O=C(CCOc1cccc([N+](=O)[O-])c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853890453	DF	On-Demand	Bother	CACNA1D	88	40
O=C(CCOc1cccc([N+](=O)[O-])c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853890453	DF	On-Demand	Bother	ACR	18	43
O=C(CCOc1cccc([N+](=O)[O-])c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853890454	DF	On-Demand	Bother	CACNA1C	54	40
O=C(CCOc1cccc([N+](=O)[O-])c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853890454	DF	On-Demand	Bother	CACNA1D	88	40
O=C(CCOc1cccc([N+](=O)[O-])c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853890454	DF	On-Demand	Bother	ACR	18	43
CC(C)c1cccc(COC(=O)C2CCN(C(=O)N(C)C)CC2)c1	ZINC000853890464	EG	On-Demand	Anodyne	TRY2_BOVIN	32	41
CC(C)c1cccc(COC(=O)C2CCN(C(=O)N(C)C)CC2)c1	ZINC000853890464	EG	On-Demand	Anodyne	PDE6D	43	36
COc1ccc2[nH]cc(CC(=O)OCc3onc(C)c3[N+](=O)[O-])c2c1	ZINC000853890480	EF	On-Demand	Bother	HTR1D	27	43
C#CCOCCOC(=O)CCOc1cccc([N+](=O)[O-])c1	ZINC000853890495	CD	On-Demand	Mild	CACNA1D	59	38
C#CCOCCOC(=O)CCOc1cccc([N+](=O)[O-])c1	ZINC000853890495	CD	On-Demand	Mild	ACR	18	44
O=C(OCCOC(F)F)c1ccc(NCCO)cc1	ZINC000853890512	CD	On-Demand	Anodyne	ACR	49	33
O=C(OCCOC(F)F)[C@@H]1CCCN(c2nc3ccccc3s2)C1	ZINC000853890515	FG	On-Demand	Anodyne	SLC6A1	40	34
O=C(OCCOC(F)F)[C@H]1CCCN(c2nc3ccccc3s2)C1	ZINC000853890516	FG	On-Demand	Anodyne	SLC6A1	40	34
Cc1cc(N2CCn3ncc(Br)c3C2)nc(N)n1	ZINC000853890553	DD	On-Demand	Anodyne	HRH4	32	52
C[C@@H]1C[C@H]1C(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853890555	DF	On-Demand	Anodyne	ACR	55	36
C[C@H]1C[C@H]1C(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853890558	DF	On-Demand	Anodyne	ACR	55	36
C[C@@H]1C[C@@H]1C(=O)Nc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853890559	DF	On-Demand	Anodyne	ACR	55	36
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)o1	ZINC000853890581	CC	On-Demand	Anodyne	CA2	20	43
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)o1	ZINC000853890581	CC	On-Demand	Anodyne	CA4	16	43
Cc1noc(C)c1[C@H](C)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853890616	GH	On-Demand	Reactive	CSNK1D	30	42
Cc1noc(C)c1[C@@H](C)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853890619	GH	On-Demand	Reactive	CSNK1D	30	42
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCCOC(F)F)c(OC)c1	ZINC000853890625	FE	On-Demand	Anodyne	FKBP1A	94	51
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCCOC(F)F)c(OC)c1	ZINC000853890626	FE	On-Demand	Anodyne	FKBP1A	94	51
NS(=O)(=O)c1cc(C(=O)OCCOC(F)F)ccc1F	ZINC000853890637	DC	On-Demand	Anodyne	CA2	25	40
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853890639	FE	On-Demand	Anodyne	FKBP1A	96	44
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853890639	FE	On-Demand	Anodyne	PREP	48	36
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853890639	FE	On-Demand	Anodyne	HCN1	54	36
CCOc1ccccc1C(=O)N1CCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853890639	FE	On-Demand	Anodyne	HCN4	47	36
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853890640	FE	On-Demand	Anodyne	FKBP1A	96	44
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853890640	FE	On-Demand	Anodyne	PREP	48	36
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853890640	FE	On-Demand	Anodyne	HCN1	54	36
CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853890640	FE	On-Demand	Anodyne	HCN4	47	36
O=C(CCCc1ccccc1)OCCOC(F)F	ZINC000853890656	CF	On-Demand	Anodyne	LTA4H	15	41
O=C(CCCc1ccccc1)OCCOC(F)F	ZINC000853890656	CF	On-Demand	Anodyne	FAAH	55	38
O=C(CCCc1ccccc1)OCCOC(F)F	ZINC000853890656	CF	On-Demand	Anodyne	CES1	62	42
FC(F)(F)c1cccnc1N1CCn2ncc(Br)c2C1	ZINC000853890668	EG	On-Demand	Anodyne	TRPV1	33	50
O=[N+]([O-])c1ccc(N2CCn3ncc(Br)c3C2)c2nonc12	ZINC000853890675	FE	On-Demand	Bother	GSTM2	82	39
O=[N+]([O-])c1ccc(N2CCn3ncc(Br)c3C2)c2nonc12	ZINC000853890675	FE	On-Demand	Bother	GSTP1	44	39
COc1ccc(-n2nnc(C(=O)OCc3onc(C)c3[N+](=O)[O-])c2C)cc1	ZINC000853890683	FE	On-Demand	Bother	SLC5A1	17	40
O=C(N[C@@H](CC1CCCC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853890685	GH	On-Demand	Anodyne	CTSS	15	47
O=C(N[C@H](CC1CCCC1)c1ccccc1)N1CCC(N2CCOC2=O)CC1	ZINC000853890686	GH	On-Demand	Anodyne	CTSS	15	47
O=C(CCCOc1ccc(Cl)cc1)OCCOC(F)F	ZINC000853890746	DG	On-Demand	Anodyne	PLA2G4B	57	33
CC(C)c1cccc(COC(=O)CNC(=O)OCC(F)(F)F)c1	ZINC000853890761	EG	On-Demand	Anodyne	NPR	53	32
COc1cccc(OCC(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853890794	EC	On-Demand	Anodyne	DRD4	41	32
CCC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853890801	CE	On-Demand	Anodyne	CTRB1	20	42
CCC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853890801	CE	On-Demand	Anodyne	KCNK3	86	33
CCC(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853890801	CE	On-Demand	Anodyne	KCNK9	60	33
NC(=O)CNc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853890802	CC	On-Demand	Anodyne	ACR	58	35
COc1cccc(OCC(=O)OCCOC(F)F)c1	ZINC000853890814	CD	On-Demand	Anodyne	MTNR1A	44	49
COc1cccc(OCC(=O)OCCOC(F)F)c1	ZINC000853890814	CD	On-Demand	Anodyne	MTNR1B	43	49
COc1cccc(OCC(=O)OCCOC(F)F)c1	ZINC000853890814	CD	On-Demand	Anodyne	PLA2G4B	48	42
COc1cccc(OCC(=O)OCCOC(F)F)c1	ZINC000853890814	CD	On-Demand	Anodyne	PDS	36	40
O=C(CCc1nc(-c2ccccn2)no1)OCCOC(F)F	ZINC000853890879	DD	On-Demand	Anodyne	FAAH	19	43
O=C(CCc1nc(-c2ccccn2)no1)OCCOC(F)F	ZINC000853890879	DD	On-Demand	Anodyne	HCAR2	29	41
O=C(CCc1nc(-c2ccccn2)no1)OCCOC(F)F	ZINC000853890879	DD	On-Demand	Anodyne	LUCI_PHOPE	25	43
O=C(OCCOC(F)F)c1cccc(NC(=O)C2CCCCC2)c1	ZINC000853890892	EH	On-Demand	Anodyne	KCNK3	16	53
O=C(CCOc1cccc(Cl)c1)OCCOC(F)F	ZINC000853890901	CF	On-Demand	Anodyne	PDS	66	43
O=C(NC1CC1)c1ccc(N2CCn3ncc(Br)c3C2)nc1	ZINC000853890912	FD	On-Demand	Anodyne	HPGDS	35	48
COc1ccc2[nH]cc(CC(=O)OCc3nnc4n3CCOCC4)c2c1	ZINC000853890998	FD	On-Demand	Anodyne	HTR1D	32	41
COc1ccc2[nH]cc(CC(=O)OCc3nnc4n3CCOCC4)c2c1	ZINC000853890998	FD	On-Demand	Anodyne	HTR1B	27	41
COc1ccc2[nH]cc(CC(=O)OCc3nnc4n3CCOCC4)c2c1	ZINC000853890998	FD	On-Demand	Anodyne	MTNR1A	22	41
COc1ccc2[nH]cc(CC(=O)OCc3nnc4n3CCOCC4)c2c1	ZINC000853890998	FD	On-Demand	Anodyne	MTNR1B	19	41
C[C@@H](OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853891020	CE	On-Demand	Anodyne	CAPNS1	56	32
C[C@@H](OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853891020	CE	On-Demand	Anodyne	CAPN1	50	37
C[C@@H](OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853891020	CE	On-Demand	Anodyne	CAPN2	80	36
C[C@@H](OCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853891020	CE	On-Demand	Anodyne	NPR	60	34
CS[C@H](C)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853891030	EG	On-Demand	Reactive	CSNK1D	43	48
C#CCOCCOC(=O)/C=C\c1ccc(OC)c(O)c1	ZINC000853891043	CD	On-Demand	Mild	TUBB1	57	48
C#CCOCCOC(=O)/C=C\c1ccc(OC)c(O)c1	ZINC000853891043	CD	On-Demand	Mild	AKR1B10	41	43
C#CCOCCOC(=O)/C=C/c1ccc(OC)c(O)c1	ZINC000853891044	CD	On-Demand	Mild	TUBB1	57	48
C#CCOCCOC(=O)/C=C/c1ccc(OC)c(O)c1	ZINC000853891044	CD	On-Demand	Mild	AKR1B10	41	43
CCC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891104	GG	On-Demand	Anodyne	F10	16	41
CCC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891104	GG	On-Demand	Anodyne	TRY2_BOVIN	17	40
CCC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891104	GG	On-Demand	Anodyne	MTNR1A	24	41
CCC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891104	GG	On-Demand	Anodyne	MTNR1B	27	41
CCC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891104	GG	On-Demand	Anodyne	MCHR1	36	43
CCC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891105	GG	On-Demand	Anodyne	F10	16	41
CCC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891105	GG	On-Demand	Anodyne	TRY2_BOVIN	17	40
CCC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891105	GG	On-Demand	Anodyne	MTNR1A	24	41
CCC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891105	GG	On-Demand	Anodyne	MTNR1B	27	41
CCC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853891105	GG	On-Demand	Anodyne	MCHR1	36	43
C#CCOCCOC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891141	DD	On-Demand	Mild	FKBP1A	76	46
C#CCOCCOC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891141	DD	On-Demand	Mild	SLC6A1	50	33
C#CCOCCOC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891141	DD	On-Demand	Mild	PREP	88	36
C#CCOCCOC(=O)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891142	DD	On-Demand	Mild	FKBP1A	76	46
C#CCOCCOC(=O)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891142	DD	On-Demand	Mild	SLC6A1	50	33
C#CCOCCOC(=O)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891142	DD	On-Demand	Mild	PREP	88	36
NC(=O)c1cnc(N2CCn3ncc(Br)c3C2)c(Cl)c1	ZINC000853891164	FD	On-Demand	Anodyne	CXCR3	19	41
O=C(OCCOC(F)F)c1cn(-c2ccc(Cl)cc2)nn1	ZINC000853891175	DE	On-Demand	Anodyne	ESRRA	22	40
OCCNc1nc(N2CCn3ncc(Br)c3C2)nc2ccccc12	ZINC000853891194	GE	On-Demand	Anodyne	HRH4	18	47
O=C(OCCOC(F)F)[C@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000853891203	FG	On-Demand	Anodyne	TRPV1	26	44
O=C(OCCOC(F)F)[C@@H]1CCCN(c2ncccc2C(F)(F)F)C1	ZINC000853891204	FG	On-Demand	Anodyne	TRPV1	26	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891205	EF	On-Demand	Anodyne	FKBP1A	52	39
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891205	EF	On-Demand	Anodyne	PREP	76	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891207	EF	On-Demand	Anodyne	FKBP1A	52	39
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891207	EF	On-Demand	Anodyne	PREP	76	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891209	EF	On-Demand	Anodyne	FKBP1A	52	39
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891209	EF	On-Demand	Anodyne	PREP	76	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891211	EF	On-Demand	Anodyne	FKBP1A	52	39
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CCCN1C(=O)c1ccccc1O	ZINC000853891211	EF	On-Demand	Anodyne	PREP	76	38
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	ZINC000853891224	GF	On-Demand	Anodyne	SLC6A1	67	34
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1	ZINC000853891226	GF	On-Demand	Anodyne	SLC6A1	67	34
COc1ccc(-n2nnc(C(=O)OCCOC(F)F)c2C)cc1	ZINC000853891230	ED	On-Demand	Anodyne	SLC5A1	22	45
O=C(NC1CCCC1)c1ccc(N2CCn3ncc(Br)c3C2)nn1	ZINC000853891231	GE	On-Demand	Anodyne	SCD1	39	40
CON(C)CCNC(=O)NCCNS(=O)(=O)c1ccc(Cl)s1	ZINC000853891255	FC	On-Demand	Anodyne	CCR4	52	33
Brc1cnn2c1CN(c1nccc(N3CCCC3)n1)CC2	ZINC000853891260	EE	On-Demand	Anodyne	SORD	40	35
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1I	ZINC000853891290	GF	On-Demand	Bother	CACNA1D	45	35
O=C(CCCOc1cccc2ccccc12)OCc1nnc2n1CCOCC2	ZINC000853891300	GF	On-Demand	Anodyne	MCL1	40	41
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000853891301	FF	On-Demand	Anodyne	SLC6A1	57	34
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000853891301	FF	On-Demand	Anodyne	KCNQ2	40	37
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000853891302	FF	On-Demand	Anodyne	SLC6A1	57	34
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1	ZINC000853891302	FF	On-Demand	Anodyne	KCNQ2	40	37
NC(=O)CNc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853891352	CD	On-Demand	Anodyne	ACR	59	33
NC(=O)CNc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853891353	CD	On-Demand	Anodyne	ACR	59	33
NC(=O)CNc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853891354	CD	On-Demand	Anodyne	ACR	59	33
O=C(OCCOC(F)F)c1cc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000853891362	DE	On-Demand	Bother	CACNA1C	49	37
O=C(OCCOC(F)F)c1cc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000853891362	DE	On-Demand	Bother	CACNA1D	77	37
O=C(OCCOC(F)F)c1cc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000853891362	DE	On-Demand	Bother	TUBB2B	25	42
O=C(CCCNC(=O)OCc1ccccc1)OCc1nnc2n1CCOCC2	ZINC000853891365	GD	On-Demand	Anodyne	TGM2	19	41
O=C(CCCNC(=O)OCc1ccccc1)OCc1nnc2n1CCOCC2	ZINC000853891365	GD	On-Demand	Anodyne	NPR	57	35
Brc1cnn2c1CN(c1ncnc3[nH]ccc13)CC2	ZINC000853891371	DD	On-Demand	Anodyne	AKT2	52	51
Brc1cnn2c1CN(c1ncnc3[nH]ccc13)CC2	ZINC000853891371	DD	On-Demand	Anodyne	AKT1	21	42
Brc1cnn2c1CN(c1ncnc3[nH]ccc13)CC2	ZINC000853891371	DD	On-Demand	Anodyne	ATR	25	41
Cc1ccc(OCCOc2c(CO)cc(F)cc2CO)cc1	ZINC000853891399	DF	On-Demand	Anodyne	FFAR4	15	41
Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)OCCOC(F)F)C2)c1	ZINC000853891415	FG	On-Demand	Anodyne	CCKAR	15	44
Cc1cccc(NC(=O)N2CCC[C@@H](C(=O)OCCOC(F)F)C2)c1	ZINC000853891415	FG	On-Demand	Anodyne	CCR3	16	40
CCC(CC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853891418	DF	On-Demand	Anodyne	MMP1	23	46
CCC(CC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853891418	DF	On-Demand	Anodyne	PROKR1	53	32
Cc1cccc(NC(=O)N2CCC[C@H](C(=O)OCCOC(F)F)C2)c1	ZINC000853891419	FG	On-Demand	Anodyne	CCKAR	15	44
Cc1cccc(NC(=O)N2CCC[C@H](C(=O)OCCOC(F)F)C2)c1	ZINC000853891419	FG	On-Demand	Anodyne	CCR3	16	40
CCC(CC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853891421	DF	On-Demand	Anodyne	MMP1	23	46
CCC(CC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853891421	DF	On-Demand	Anodyne	PROKR1	53	32
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853891447	FF	On-Demand	Reactive	CCR3	41	43
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853891453	FF	On-Demand	Reactive	CCR3	41	43
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000853891480	DD	On-Demand	Bother	CACNA1D	43	34
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000853891491	DF	On-Demand	Bother	CACNA1C	31	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000853891491	DF	On-Demand	Bother	CACNA1D	48	41
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000853891494	DF	On-Demand	Bother	CACNA1C	31	41
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000853891494	DF	On-Demand	Bother	CACNA1D	48	41
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000853891496	DF	On-Demand	Bother	CACNA1C	31	41
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000853891496	DF	On-Demand	Bother	CACNA1D	48	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891511	CF	On-Demand	Bother	CACNA1C	48	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891511	CF	On-Demand	Bother	CACNA1D	73	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891511	CF	On-Demand	Bother	SLC27A4	42	31
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891513	CF	On-Demand	Bother	CACNA1C	48	41
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891513	CF	On-Demand	Bother	CACNA1D	73	41
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891513	CF	On-Demand	Bother	SLC27A4	42	31
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891516	CF	On-Demand	Bother	CACNA1C	48	41
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891516	CF	On-Demand	Bother	CACNA1D	73	41
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1F	ZINC000853891516	CF	On-Demand	Bother	SLC27A4	42	31
COc1ccc([C@H](NC(=O)N2C[C@H](C)C(O)[C@@H](C)C2)c2ccccc2OC)cc1	ZINC000853891517	GG	On-Demand	Anodyne	MMP13	18	40
COc1ccc([C@H](NC(=O)N2C[C@H](C)C(O)[C@@H](C)C2)c2ccccc2OC)cc1	ZINC000853891517	GG	On-Demand	Anodyne	MMP9	20	40
COc1ccc([C@H](NC(=O)N2C[C@H](C)C(O)[C@@H](C)C2)c2ccccc2OC)cc1	ZINC000853891517	GG	On-Demand	Anodyne	MMP1	22	40
COc1ccc([C@H](NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891520	GG	On-Demand	Anodyne	MMP13	18	40
COc1ccc([C@H](NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891520	GG	On-Demand	Anodyne	MMP9	20	40
COc1ccc([C@H](NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891520	GG	On-Demand	Anodyne	MMP1	22	40
COc1ccc([C@H](NC(=O)N2C[C@@H](C)C(O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891522	GG	On-Demand	Anodyne	MMP13	18	40
COc1ccc([C@H](NC(=O)N2C[C@@H](C)C(O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891522	GG	On-Demand	Anodyne	MMP9	20	40
COc1ccc([C@H](NC(=O)N2C[C@@H](C)C(O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891522	GG	On-Demand	Anodyne	MMP1	22	40
COc1ccc([C@@H](NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891524	GG	On-Demand	Anodyne	MMP13	18	40
COc1ccc([C@@H](NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891524	GG	On-Demand	Anodyne	MMP9	20	40
COc1ccc([C@@H](NC(=O)N2C[C@H](C)[C@@H](O)[C@H](C)C2)c2ccccc2OC)cc1	ZINC000853891524	GG	On-Demand	Anodyne	MMP1	22	40
C=CC(=O)Nc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853891536	CG	On-Demand	Anodyne	ACR	58	34
C=CC(=O)Nc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853891536	CG	On-Demand	Anodyne	TGM2	71	44
C=CC(=O)Nc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853891536	CG	On-Demand	Anodyne	F13A1	109	44
C=CC(=O)Nc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853891537	CG	On-Demand	Anodyne	ACR	58	34
C=CC(=O)Nc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853891537	CG	On-Demand	Anodyne	TGM2	71	44
C=CC(=O)Nc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853891537	CG	On-Demand	Anodyne	F13A1	109	44
C=CC(=O)Nc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853891538	CG	On-Demand	Anodyne	ACR	58	34
C=CC(=O)Nc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853891538	CG	On-Demand	Anodyne	TGM2	71	44
C=CC(=O)Nc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853891538	CG	On-Demand	Anodyne	F13A1	109	44
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853891561	GD	On-Demand	Anodyne	SIGMAR1	15	43
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853891561	GD	On-Demand	Anodyne	MMP1	32	46
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853891561	GD	On-Demand	Anodyne	PROKR1	60	32
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853891562	GD	On-Demand	Anodyne	SIGMAR1	15	43
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853891562	GD	On-Demand	Anodyne	MMP1	32	46
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853891562	GD	On-Demand	Anodyne	PROKR1	60	32
Cc1oc(-c2cccs2)nc1C(=O)OCCOC(F)F	ZINC000853891568	DG	On-Demand	Anodyne	PPARG	26	46
Cc1oc(-c2cccs2)nc1C(=O)OCCOC(F)F	ZINC000853891568	DG	On-Demand	Anodyne	PPARA	29	46
C#CCOCCOC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(C(=O)OCC)o1	ZINC000853891572	GC	On-Demand	Mild	FKBP1A	53	45
C#CCOCCOC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(C(=O)OCC)o1	ZINC000853891573	GC	On-Demand	Mild	FKBP1A	53	45
COc1ccc2[nH]cc(CC(=O)OCCOC(F)F)c2c1	ZINC000853891579	CF	On-Demand	Anodyne	HTR1A	17	55
COc1ccc2[nH]cc(CC(=O)OCCOC(F)F)c2c1	ZINC000853891579	CF	On-Demand	Anodyne	HTR1D	41	55
COc1ccc2[nH]cc(CC(=O)OCCOC(F)F)c2c1	ZINC000853891579	CF	On-Demand	Anodyne	HTR1B	37	46
COc1ccc2[nH]cc(CC(=O)OCCOC(F)F)c2c1	ZINC000853891579	CF	On-Demand	Anodyne	MPO	77	39
COc1ccc2[nH]cc(CC(=O)OCCOC(F)F)c2c1	ZINC000853891579	CF	On-Demand	Anodyne	HTR1E	24	47
COc1ccc2[nH]cc(CC(=O)OCCOC(F)F)c2c1	ZINC000853891579	CF	On-Demand	Anodyne	MTNR1A	61	55
COc1ccc2[nH]cc(CC(=O)OCCOC(F)F)c2c1	ZINC000853891579	CF	On-Demand	Anodyne	MTNR1B	43	54
O=C(OCCOC(F)F)C(F)(F)c1ccccc1	ZINC000853891580	CF	On-Demand	Anodyne	AMY2	69	40
O=C(CCOc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853891592	DE	On-Demand	Bother	CACNA1C	44	38
O=C(CCOc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853891592	DE	On-Demand	Bother	CACNA1D	74	38
O=C(CCOc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853891592	DE	On-Demand	Bother	ACR	19	45
Cn1nc(C(C)(C)C)cc1C(=O)OCCOC(F)F	ZINC000853891639	CE	On-Demand	Anodyne	CTSV	41	32
C#CCOCCOC(=O)c1ccc(NCC(N)=O)cc1	ZINC000853891670	CC	On-Demand	Mild	ACR	52	33
O=C(N[C@@H](CO)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccccc1	ZINC000853891713	DD	On-Demand	Anodyne	CTRB1	42	39
O=C(N[C@@H](CO)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccccc1	ZINC000853891713	DD	On-Demand	Anodyne	CTRB_BOVIN	44	31
O=C(N[C@H](CO)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccccc1	ZINC000853891714	DD	On-Demand	Anodyne	CTRB1	42	39
O=C(N[C@H](CO)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccccc1	ZINC000853891714	DD	On-Demand	Anodyne	CTRB_BOVIN	44	31
O=C(N[C@H](CO)C(=O)OCC1C[C@@H]2C[C@H]2C1)c1ccccc1	ZINC000853891715	DD	On-Demand	Anodyne	CTRB1	42	39
O=C(N[C@H](CO)C(=O)OCC1C[C@@H]2C[C@H]2C1)c1ccccc1	ZINC000853891715	DD	On-Demand	Anodyne	CTRB_BOVIN	44	31
O=C(N[C@H](CO)C(=O)OCC1C[C@H]2C[C@@H]2C1)c1ccccc1	ZINC000853891716	DD	On-Demand	Anodyne	CTRB1	42	39
O=C(N[C@H](CO)C(=O)OCC1C[C@H]2C[C@@H]2C1)c1ccccc1	ZINC000853891716	DD	On-Demand	Anodyne	CTRB_BOVIN	44	31
O=C(OCCOC(F)F)c1cc2cccc([N+](=O)[O-])c2[nH]1	ZINC000853891738	DE	On-Demand	Bother	CACNA1D	61	34
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1F	ZINC000853891751	CE	On-Demand	Bother	CACNA1D	55	35
CS(=O)(=O)Nc1cc(F)ccc1C(=O)OCCOC(F)F	ZINC000853891753	ED	On-Demand	Anodyne	TRPV1	40	34
O=C(OCCOC(F)F)[C@@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000853891824	FE	On-Demand	Anodyne	FKBP1A	67	49
O=C(OCCOC(F)F)[C@H]1CCCCN1S(=O)(=O)c1cccs1	ZINC000853891825	FE	On-Demand	Anodyne	FKBP1A	67	49
Cc1c(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853891836	DG	On-Demand	Bother	CACNA1C	51	42
Cc1c(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853891836	DG	On-Demand	Bother	CACNA1D	83	42
Cc1c(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853891838	DG	On-Demand	Bother	CACNA1C	51	42
Cc1c(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853891838	DG	On-Demand	Bother	CACNA1D	83	42
C#CCOCCOC(=O)CSc1cccc(OC)c1	ZINC000853891857	CD	On-Demand	Mild	MTNR1A	28	47
C#CCOCCOC(=O)CSc1cccc(OC)c1	ZINC000853891857	CD	On-Demand	Mild	MTNR1B	28	47
C#CCOCCOC(=O)c1cc(OC)c(OC(F)F)cc1N	ZINC000853891900	DD	On-Demand	Mild	HTR4	32	40
O=C(CCCCC(=O)c1ccccc1)OCc1nnc2n1CCOCC2	ZINC000853891924	FE	On-Demand	Anodyne	CYP2J2	45	31
CC[C@H]1CN(C(=O)C2CC2)CC[C@@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853891935	FF	On-Demand	Reactive	CCR3	21	42
CC[C@H]1CN(C(=O)C2CC2)CC[C@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853891936	FF	On-Demand	Reactive	CCR3	21	42
O=C(CCc1ccc(O)cc1)OCCOC(F)F	ZINC000853891957	CE	On-Demand	Anodyne	PPO2	16	41
O=C(Nc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1)NC1CC1	ZINC000853891958	FD	On-Demand	Anodyne	EPHX2	45	45
O=C(OCCOC(F)F)c1[nH]c2ccc(F)cc2c1Cl	ZINC000853891987	DG	On-Demand	Anodyne	MPO	45	36
O=C(OCCOC(F)F)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892020	GG	On-Demand	Anodyne	ACE	15	44
O=C(OCCOC(F)F)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892020	GG	On-Demand	Anodyne	OPRM1	17	40
O=C(OCCOC(F)F)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892020	GG	On-Demand	Anodyne	OPRD1	53	37
O=C(OCCOC(F)F)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892020	GG	On-Demand	Anodyne	PREP	15	40
O=C(OCCOC(F)F)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892020	GG	On-Demand	Anodyne	CFTR	77	43
O=C(OCCOC(F)F)[C@@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892020	GG	On-Demand	Anodyne	ADAM9	53	33
O=C(OCCOC(F)F)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892021	GG	On-Demand	Anodyne	ACE	15	44
O=C(OCCOC(F)F)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892021	GG	On-Demand	Anodyne	OPRM1	17	40
O=C(OCCOC(F)F)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892021	GG	On-Demand	Anodyne	OPRD1	53	37
O=C(OCCOC(F)F)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892021	GG	On-Demand	Anodyne	PREP	15	40
O=C(OCCOC(F)F)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892021	GG	On-Demand	Anodyne	CFTR	77	43
O=C(OCCOC(F)F)[C@H]1Cc2ccccc2CN1C(=O)c1ccccc1	ZINC000853892021	GG	On-Demand	Anodyne	ADAM9	53	33
COC(=O)N(C)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892025	FD	On-Demand	Anodyne	MMP1	26	47
COC(=O)N(C)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892026	FD	On-Demand	Anodyne	MMP1	26	47
C#CCOCCOC(=O)[C@H]1CCCN1S(=O)(=O)CCCC	ZINC000853892029	DC	On-Demand	Mild	FKBP1A	41	43
C#CCOCCOC(=O)[C@@H]1CCCN1S(=O)(=O)CCCC	ZINC000853892030	DC	On-Demand	Mild	FKBP1A	41	43
CCCOc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853892041	CF	On-Demand	Anodyne	PLA2G4B	46	45
CCCOc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853892041	CF	On-Demand	Anodyne	PDS	64	43
CCCCS(=O)(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853892049	ED	On-Demand	Anodyne	FKBP1A	41	43
CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853892050	ED	On-Demand	Anodyne	FKBP1A	41	43
O=C(CCn1c2ccccc2c2ccccc21)OCc1nnc2n1CCOCC2	ZINC000853892054	GG	On-Demand	Anodyne	PTGDS	42	34
CC(=O)NCCCCCC(=O)OCc1cccc(C(C)C)c1	ZINC000853892068	DH	On-Demand	Anodyne	MTNR1A	49	43
CC(=O)NCCCCCC(=O)OCc1cccc(C(C)C)c1	ZINC000853892068	DH	On-Demand	Anodyne	MTNR1B	50	43
CC(=O)NCCCCCC(=O)OCc1cccc(C(C)C)c1	ZINC000853892068	DH	On-Demand	Anodyne	GRIA1	44	33
CCC(=O)N1CCC[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892117	GD	On-Demand	Anodyne	HRH3	15	42
CCC(=O)N1CCC[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892117	GD	On-Demand	Anodyne	MMP1	19	42
CCC(=O)N1CCC[C@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892118	GD	On-Demand	Anodyne	HRH3	15	42
CCC(=O)N1CCC[C@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892118	GD	On-Demand	Anodyne	MMP1	19	42
CCC(=O)N1CCC[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892119	GD	On-Demand	Anodyne	HRH3	15	42
CCC(=O)N1CCC[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892119	GD	On-Demand	Anodyne	MMP1	19	42
CCC(=O)N1CCC[C@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892120	GD	On-Demand	Anodyne	HRH3	15	42
CCC(=O)N1CCC[C@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853892120	GD	On-Demand	Anodyne	MMP1	19	42
O=C(COc1ccc(C(F)(F)F)cc1)OCCOC(F)F	ZINC000853892192	DF	On-Demand	Anodyne	PPARD	45	46
O=C(COc1ccc(C(F)(F)F)cc1)OCCOC(F)F	ZINC000853892192	DF	On-Demand	Anodyne	PLA2G4B	77	35
O=C(COc1ccc(C(F)(F)F)cc1)OCCOC(F)F	ZINC000853892192	DF	On-Demand	Anodyne	AOC3	21	49
O=C(Cc1ccc(-n2cccn2)cc1)OCCOC(F)F	ZINC000853892228	CE	On-Demand	Anodyne	AMP1_PLAFQ	57	42
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)OCCOC(F)F	ZINC000853892244	EF	On-Demand	Anodyne	P2RX7	25	45
C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)OCCOC(F)F	ZINC000853892306	FF	On-Demand	Anodyne	ECR	18	41
CC(C)(C(=O)OCCOC(F)F)c1ccc(Cl)cc1	ZINC000853892359	CG	On-Demand	Anodyne	AMY2	54	31
N#Cc1ccccc1OCc1ccc(C(=O)OCCOC(F)F)o1	ZINC000853892381	EG	On-Demand	Mild	ADRB1	42	33
CCC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892386	DH	On-Demand	Anodyne	PLG	15	46
CCC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892386	DH	On-Demand	Anodyne	FKBP1A	55	38
CCC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892386	DH	On-Demand	Anodyne	SLC6A1	48	38
CCC(=O)N1CCC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892386	DH	On-Demand	Anodyne	TRY2_BOVIN	36	46
CCC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892387	DH	On-Demand	Anodyne	PLG	15	46
CCC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892387	DH	On-Demand	Anodyne	FKBP1A	55	38
CCC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892387	DH	On-Demand	Anodyne	SLC6A1	48	38
CCC(=O)N1CCC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853892387	DH	On-Demand	Anodyne	TRY2_BOVIN	36	46
NC(=O)c1cn(CC(=O)OCc2nnc3n2CCOCC3)c2ccccc12	ZINC000853892390	FC	On-Demand	Anodyne	CNR1	15	43
NC(=O)c1cn(CC(=O)OCc2nnc3n2CCOCC3)c2ccccc12	ZINC000853892390	FC	On-Demand	Anodyne	CNR2	20	41
NC(=O)c1cn(CC(=O)OCc2nnc3n2CCOCC3)c2ccccc12	ZINC000853892390	FC	On-Demand	Anodyne	ADCY5	15	40
O=C(OCCOC(F)F)C1CCN(C(=O)CCOc2ccccc2)CC1	ZINC000853892403	FE	On-Demand	Anodyne	CPT1A	53	35
CCC(=O)Nc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853892404	ED	On-Demand	Anodyne	CASR	16	42
C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)OCCOC(F)F	ZINC000853892407	FF	On-Demand	Anodyne	ECR	18	41
Cc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(Cl)n1	ZINC000853892436	CG	On-Demand	Anodyne	CACNA1C	40	30
Cc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(Cl)n1	ZINC000853892437	CG	On-Demand	Anodyne	CACNA1C	40	30
Cc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(Cl)n1	ZINC000853892438	CG	On-Demand	Anodyne	CACNA1C	40	30
COCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892466	DD	On-Demand	Anodyne	MMP1	17	47
COCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892467	DD	On-Demand	Anodyne	MMP1	17	47
Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)OCCOC(F)F	ZINC000853892505	FG	On-Demand	Anodyne	P2RX7	23	48
CCC(=O)N1CCCC[C@H]1C(=O)OCCOC(F)F	ZINC000853892532	CD	On-Demand	Anodyne	FKBP1A	69	44
C#CCOCCOC(=O)c1ccccc1NS(=O)(=O)CCC	ZINC000853892559	ED	On-Demand	Mild	PRTN3	33	40
O=C(OCCOC(F)F)c1ccc([N+](=O)[O-])cc1F	ZINC000853892567	CE	On-Demand	Bother	CACNA1D	54	35
C#CCOCCOC(=O)[C@@H](CO)NC(=O)c1ccccc1	ZINC000853892594	CB	On-Demand	Mild	CTRB_BOVIN	45	32
C#CCOCCOC(=O)[C@H](CO)NC(=O)c1ccccc1	ZINC000853892595	CB	On-Demand	Mild	CTRB_BOVIN	45	32
O=C(NCCC(=O)OCCOC(F)F)Nc1ccc(Br)cc1	ZINC000853892626	GF	On-Demand	Anodyne	MTCA1	18	41
O=C(NCCC(=O)OCCOC(F)F)Nc1ccc(Br)cc1	ZINC000853892626	GF	On-Demand	Anodyne	P96878_MYCTU	24	41
C#CCOCCOC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C	ZINC000853892628	DD	On-Demand	Mild	CACNA1D	42	39
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892638	GE	On-Demand	Anodyne	DRD4	42	32
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892638	GE	On-Demand	Anodyne	F10	19	45
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892638	GE	On-Demand	Anodyne	SIGMAR1	20	42
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892638	GE	On-Demand	Anodyne	TRY2_BOVIN	18	44
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892638	GE	On-Demand	Anodyne	MMP1	30	45
COC(=O)c1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892638	GE	On-Demand	Anodyne	MCHR1	24	41
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892639	GE	On-Demand	Anodyne	DRD4	42	32
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892639	GE	On-Demand	Anodyne	F10	19	45
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892639	GE	On-Demand	Anodyne	SIGMAR1	20	42
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892639	GE	On-Demand	Anodyne	TRY2_BOVIN	18	44
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892639	GE	On-Demand	Anodyne	MMP1	30	45
COC(=O)c1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892639	GE	On-Demand	Anodyne	MCHR1	24	41
COc1ccc(N2CC[C@H](NC(=O)NC3CCC(OC(C)C)CC3)C2)cc1	ZINC000853892645	GG	On-Demand	Clean	EPHX2	42	42
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000853892681	FE	On-Demand	Anodyne	FKBP1A	16	41
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC000853892682	FE	On-Demand	Anodyne	FKBP1A	16	41
O=C(Nc1cccc(C(=O)OCCOC(F)F)c1)NC1CC1	ZINC000853892719	DE	On-Demand	Anodyne	EPHX2	53	52
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	PRSS1	24	43
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	F10	16	43
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	MME	40	37
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	ANPEP	46	32
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTRA_BOVIN	15	45
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	KLK3	86	39
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTSB	70	42
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	TRY2_BOVIN	48	36
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	PAPA1_CARPA	41	41
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTSK	38	43
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTSL	52	43
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTRB1	44	38
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CAPNS1	60	35
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTSS	35	43
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CAPN1	77	40
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CAPN2	102	35
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTSV	20	41
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	CTRB_BOVIN	47	32
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	NPR	75	36
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	PSMB5	19	41
CC(C)c1cccc(COC(=O)[C@@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892722	EF	On-Demand	Anodyne	UTS2	50	35
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	PRSS1	24	43
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	F10	16	43
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	MME	40	37
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	ANPEP	46	32
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTRA_BOVIN	15	45
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	KLK3	86	39
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTSB	70	42
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	TRY2_BOVIN	48	36
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	PAPA1_CARPA	41	41
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTSK	38	43
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTSL	52	43
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTRB1	44	38
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CAPNS1	60	35
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTSS	35	43
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CAPN1	77	40
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CAPN2	102	35
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTSV	20	41
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	CTRB_BOVIN	47	32
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	NPR	75	36
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	PSMB5	19	41
CC(C)c1cccc(COC(=O)[C@H](CO)NC(=O)c2ccccc2)c1	ZINC000853892723	EF	On-Demand	Anodyne	UTS2	50	35
COC(=O)c1cccc(C(=O)OCCOC(F)F)c1	ZINC000853892747	CD	On-Demand	Anodyne	ACR	15	40
CCCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892758	EG	On-Demand	Anodyne	MMP13	23	41
CCCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892758	EG	On-Demand	Anodyne	MMP3	15	41
CCCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892758	EG	On-Demand	Anodyne	PLA2G4B	66	34
CCCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892758	EG	On-Demand	Anodyne	ATP2A1	74	33
CCCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892758	EG	On-Demand	Anodyne	MMP9	20	41
CCCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892758	EG	On-Demand	Anodyne	MMP7	19	41
CCCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892758	EG	On-Demand	Anodyne	MMP1	18	46
CCCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892759	EG	On-Demand	Anodyne	MMP13	23	41
CCCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892759	EG	On-Demand	Anodyne	MMP3	15	41
CCCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892759	EG	On-Demand	Anodyne	PLA2G4B	66	34
CCCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892759	EG	On-Demand	Anodyne	ATP2A1	74	33
CCCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892759	EG	On-Demand	Anodyne	MMP9	20	41
CCCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892759	EG	On-Demand	Anodyne	MMP7	19	41
CCCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853892759	EG	On-Demand	Anodyne	MMP1	18	46
Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853892762	GG	On-Demand	Bother	P2RX7	18	40
COc1cccc(SCC(=O)OCCOC(F)F)c1	ZINC000853892799	CF	On-Demand	Anodyne	MTNR1A	33	49
COc1cccc(SCC(=O)OCCOC(F)F)c1	ZINC000853892799	CF	On-Demand	Anodyne	MTNR1B	34	49
COc1cccc(SCC(=O)OCCOC(F)F)c1	ZINC000853892799	CF	On-Demand	Anodyne	FAS	17	44
CC(C)c1cccc(OCC(=O)OCCOC(F)F)c1	ZINC000853892803	CF	On-Demand	Anodyne	PDS	23	42
CC(C)c1cccc(COC(=O)CS(=O)(=O)C2CCCC2)c1	ZINC000853892857	DG	On-Demand	Anodyne	AMY2	46	33
Cc1c(C(=O)OCCOC(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853892858	DE	On-Demand	Bother	CACNA1D	63	37
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	PLA2G4B	46	33
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	CES2	32	40
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	CES1	23	40
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	EST1_PIG	38	40
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	PRKCA	23	49
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	LPAR3	46	45
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	FABP3	32	41
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	ENPP2	22	44
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	FBA1	24	42
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	NOD1	48	40
CCCCCCC(=O)OCCOC(F)F	ZINC000853892860	BF	On-Demand	Anodyne	CQSS	70	46
CC(C)c1cccc(COC(=O)c2nc(N3CCCC3)ncc2Cl)c1	ZINC000853892862	FI	On-Demand	Anodyne	NR1H4	51	36
CC(C)c1cccc(COC(=O)C2(O)CCC2)c1	ZINC000853892869	BF	On-Demand	Anodyne	SLC12A5	71	38
CCCc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853892908	CG	On-Demand	Anodyne	S1PR2	31	41
COCCn1cc(C(=O)OCCOC(F)F)c2ccccc21	ZINC000853892909	DF	On-Demand	Anodyne	CNR1	23	57
COCCn1cc(C(=O)OCCOC(F)F)c2ccccc21	ZINC000853892909	DF	On-Demand	Anodyne	CNR2	35	57
COCCOc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892912	GF	On-Demand	Anodyne	DRD4	44	33
COCCOc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892912	GF	On-Demand	Anodyne	KCNH2	24	40
COCCOc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892912	GF	On-Demand	Anodyne	HCRTR1	19	42
COCCOc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892912	GF	On-Demand	Anodyne	TRY2_BOVIN	17	41
COCCOc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892912	GF	On-Demand	Anodyne	HCRTR2	19	42
COCCOc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892912	GF	On-Demand	Anodyne	MCHR1	22	42
COCCOc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892913	GF	On-Demand	Anodyne	DRD4	44	33
COCCOc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892913	GF	On-Demand	Anodyne	KCNH2	24	40
COCCOc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892913	GF	On-Demand	Anodyne	HCRTR1	19	42
COCCOc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892913	GF	On-Demand	Anodyne	TRY2_BOVIN	17	41
COCCOc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892913	GF	On-Demand	Anodyne	HCRTR2	19	42
COCCOc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853892913	GF	On-Demand	Anodyne	MCHR1	22	42
COCCOc1cccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])c1	ZINC000853892962	EE	On-Demand	Bother	CACNA1C	40	35
COCCOc1cccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])c1	ZINC000853892962	EE	On-Demand	Bother	CACNA1D	68	37
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1cccs1	ZINC000853892980	EE	On-Demand	Anodyne	FKBP1A	56	40
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1cccs1	ZINC000853892980	EE	On-Demand	Anodyne	PREP	71	36
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1cccs1	ZINC000853892981	EE	On-Demand	Anodyne	FKBP1A	56	40
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1cccs1	ZINC000853892981	EE	On-Demand	Anodyne	PREP	71	36
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853892994	GD	On-Demand	Anodyne	FKBP1A	51	43
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853892994	GD	On-Demand	Anodyne	PREP	80	38
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853892995	GD	On-Demand	Anodyne	FKBP1A	51	43
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853892995	GD	On-Demand	Anodyne	PREP	80	38
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1ccco1	ZINC000853892998	DE	On-Demand	Anodyne	FKBP1A	97	48
O=C(OCCOC(F)F)[C@@H]1CCCCN1C(=O)c1ccco1	ZINC000853892998	DE	On-Demand	Anodyne	PREP	59	35
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1ccco1	ZINC000853892999	DE	On-Demand	Anodyne	FKBP1A	97	48
O=C(OCCOC(F)F)[C@H]1CCCCN1C(=O)c1ccco1	ZINC000853892999	DE	On-Demand	Anodyne	PREP	59	35
COCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853893016	FD	On-Demand	Anodyne	CNR1	23	47
COCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853893016	FD	On-Demand	Anodyne	CNR2	31	47
COCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853893016	FD	On-Demand	Anodyne	ADCY5	16	41
COCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853893016	FD	On-Demand	Anodyne	PTGDS	30	41
CO[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853893025	BF	On-Demand	Anodyne	CAPNS1	46	31
CO[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853893025	BF	On-Demand	Anodyne	CAPN2	48	33
O=C(CCCNC(=O)c1ccc(F)cc1)OCCOC(F)F	ZINC000853893060	DE	On-Demand	Anodyne	FOLH1	17	44
COc1cccc([C@@H](C)C(=O)OCCOC(F)F)c1	ZINC000853893062	CF	On-Demand	Anodyne	MTNR1A	38	40
COc1cccc([C@@H](C)C(=O)OCCOC(F)F)c1	ZINC000853893062	CF	On-Demand	Anodyne	MTNR1B	39	40
COc1cccc([C@H](C)C(=O)OCCOC(F)F)c1	ZINC000853893063	CF	On-Demand	Anodyne	MTNR1A	38	40
COc1cccc([C@H](C)C(=O)OCCOC(F)F)c1	ZINC000853893063	CF	On-Demand	Anodyne	MTNR1B	39	40
C#CCOCCOC(=O)[C@H]1CCCCN1C(=O)CCC	ZINC000853893064	CD	On-Demand	Mild	FKBP1A	61	42
C#CCOCCOC(=O)[C@@H]1CCCCN1C(=O)CCC	ZINC000853893065	CD	On-Demand	Mild	FKBP1A	61	42
Cc1c(C(=O)OCCOC(F)F)nnn1-c1cccc(Br)c1	ZINC000853893072	GF	On-Demand	Anodyne	SLC5A1	21	40
O=C(CNC(=O)c1cc(F)cc(F)c1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853893084	DE	On-Demand	Anodyne	CACNA1I	42	33
O=C(CNC(=O)c1cc(F)cc(F)c1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853893085	DE	On-Demand	Anodyne	CACNA1I	42	33
O=C(CNC(=O)c1cc(F)cc(F)c1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853893086	DE	On-Demand	Anodyne	CACNA1I	42	33
COCCOc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853893109	CE	On-Demand	Anodyne	PLA2G4B	22	40
COCCOc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853893109	CE	On-Demand	Anodyne	PDS	51	40
COCCn1cc(C(=O)OCc2onc(C)c2[N+](=O)[O-])c2ccccc21	ZINC000853893119	FF	On-Demand	Bother	CNR2	20	46
CCOc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853893124	CF	On-Demand	Anodyne	PPARA	23	40
CCOc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853893124	CF	On-Demand	Anodyne	LTA4H	27	43
CCOc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853893124	CF	On-Demand	Anodyne	S1PR4	15	43
CCOc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853893124	CF	On-Demand	Anodyne	PLA2G4B	75	39
CCOc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853893124	CF	On-Demand	Anodyne	FFAR1	40	38
CCOc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853893124	CF	On-Demand	Anodyne	PPO2	39	46
CCOc1ccc(CCC(=O)OCCOC(F)F)cc1	ZINC000853893124	CF	On-Demand	Anodyne	FFAR4	44	33
C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCCOC(F)F	ZINC000853893143	GI	On-Demand	Anodyne	NPPA	20	40
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)OCCOC(F)F)cc1	ZINC000853893159	GD	On-Demand	Anodyne	FKBP1A	43	39
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)OCCOC(F)F)cc1	ZINC000853893160	GD	On-Demand	Anodyne	FKBP1A	43	39
NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)OCCOC(F)F)cc1	ZINC000853893161	GD	On-Demand	Anodyne	FKBP1A	43	39
NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)OCCOC(F)F)cc1	ZINC000853893162	GD	On-Demand	Anodyne	FKBP1A	43	39
COCCOc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853893197	ED	On-Demand	Anodyne	DRD4	40	32
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	F2	43	43
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	ACE	51	44
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	FKBP1A	108	53
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	CELA1	25	40
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	TRY1_BOVIN	47	32
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	CPT2	40	34
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	DPP4	26	43
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	PREP	105	47
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	KLK5	23	42
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893210	EE	On-Demand	Anodyne	TMPRSS11D	53	33
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	F2	43	43
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	ACE	51	44
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	FKBP1A	108	53
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	CELA1	25	40
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	TRY1_BOVIN	47	32
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	CPT2	40	34
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	DPP4	26	43
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	PREP	105	47
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	KLK5	23	42
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000853893211	EE	On-Demand	Anodyne	TMPRSS11D	53	33
Cc1c(C(=O)OCCOC(F)F)nnn1-c1ccccc1	ZINC000853893250	CD	On-Demand	Anodyne	SLC5A1	23	50
CCOc1ccc(CCC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853893266	GG	On-Demand	Anodyne	MMP1	17	47
CCOc1ccc(CCC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853893267	GG	On-Demand	Anodyne	MMP1	17	47
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCCN1C(=O)c1ccco1	ZINC000853893278	FD	On-Demand	Anodyne	FKBP1A	42	40
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCCN1C(=O)c1ccco1	ZINC000853893279	FD	On-Demand	Anodyne	FKBP1A	42	40
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000853893305	FE	On-Demand	Anodyne	SLC6A1	51	35
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000853893305	FE	On-Demand	Anodyne	CPT1A	57	35
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000853893306	FE	On-Demand	Anodyne	SLC6A1	51	35
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1	ZINC000853893306	FE	On-Demand	Anodyne	CPT1A	57	35
CCCc1ccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853893390	DG	On-Demand	Bother	GSTM2	22	44
C#CCOCCOC(=O)c1cc(OC)c(OC)c(OC)c1N	ZINC000853893391	DD	On-Demand	Mild	HTR4	28	40
O=C(OCCOC(F)F)c1c[nH]c2cc(F)ccc12	ZINC000853893404	CF	On-Demand	Anodyne	MPO	72	40
CCCS(=O)(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853893418	FD	On-Demand	Anodyne	MMP13	43	39
CCCS(=O)(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853893418	FD	On-Demand	Anodyne	MMP1	38	44
CCCS(=O)(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853893419	FD	On-Demand	Anodyne	MMP13	43	39
CCCS(=O)(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853893419	FD	On-Demand	Anodyne	MMP1	38	44
CCO[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853893457	CF	On-Demand	Anodyne	CHRM4	18	40
COc1cccc([C@@H](C)C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853893518	ED	On-Demand	Anodyne	DRD4	40	32
COc1cccc([C@H](C)C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853893519	ED	On-Demand	Anodyne	DRD4	40	32
O=C(OCCOC(F)F)[C@@H]1CCCN(CC(F)(F)F)C1	ZINC000853893535	DE	On-Demand	Anodyne	SLC6A1	53	34
O=C(OCCOC(F)F)[C@H]1CCCN(CC(F)(F)F)C1	ZINC000853893536	DE	On-Demand	Anodyne	SLC6A1	53	34
Cc1c(C(=O)OCCOC(F)F)nnn1-c1cccc(Cl)c1	ZINC000853893573	EF	On-Demand	Anodyne	SLC5A1	21	42
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCN1C(=O)Cc1cccs1	ZINC000853893574	GD	On-Demand	Anodyne	PREP	62	33
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCN1C(=O)Cc1cccs1	ZINC000853893575	GD	On-Demand	Anodyne	PREP	62	33
CCO[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893578	GG	On-Demand	Anodyne	SLC6A3	17	49
CCO[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893578	GG	On-Demand	Anodyne	SIGMAR1	16	42
CCO[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893578	GG	On-Demand	Anodyne	CCR5	29	43
CCO[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893578	GG	On-Demand	Anodyne	MMP1	21	40
CCO[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893579	GG	On-Demand	Anodyne	SLC6A3	17	49
CCO[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893579	GG	On-Demand	Anodyne	SIGMAR1	16	42
CCO[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893579	GG	On-Demand	Anodyne	CCR5	29	43
CCO[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853893579	GG	On-Demand	Anodyne	MMP1	21	40
O=C(OCc1nnc2n1CCOCC2)c1ccc(N2CCOCC2)cc1	ZINC000853893666	FD	On-Demand	Anodyne	STAT6	51	31
CS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853893694	ED	On-Demand	Anodyne	CA7	20	45
CS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853893694	ED	On-Demand	Anodyne	LOX1.1	40	32
CS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853893694	ED	On-Demand	Anodyne	O49150_SOLTU	47	32
O=C(OCCOC(F)F)c1ccc(N2CCOCC2)cc1	ZINC000853893704	DD	On-Demand	Anodyne	STAT6	51	31
CC(C)(C(=O)OCCOC(F)F)c1ccc2c(c1)OCCO2	ZINC000853893762	DF	On-Demand	Anodyne	AMY2	55	31
C#CCOCCOC(=O)c1ccccc1NS(=O)(=O)CC	ZINC000853893834	DD	On-Demand	Mild	PRTN3	40	41
CC(C)(C)OC(=O)N1CCC(CC(=O)OCCOC(F)F)CC1	ZINC000853893835	EF	On-Demand	Anodyne	GPR119	31	40
COC(=O)N[C@H](CC(C)C)C(=O)OCCOC(F)F	ZINC000853893837	CD	On-Demand	Anodyne	CAPNS1	42	31
COC(=O)N[C@H](CC(C)C)C(=O)OCCOC(F)F	ZINC000853893837	CD	On-Demand	Anodyne	CAPN1	38	45
COC(=O)N[C@H](CC(C)C)C(=O)OCCOC(F)F	ZINC000853893837	CD	On-Demand	Anodyne	CAPN2	64	34
COC(=O)N[C@@H](CC(C)C)C(=O)OCCOC(F)F	ZINC000853893838	CD	On-Demand	Anodyne	CAPNS1	42	31
COC(=O)N[C@@H](CC(C)C)C(=O)OCCOC(F)F	ZINC000853893838	CD	On-Demand	Anodyne	CAPN1	38	45
COC(=O)N[C@@H](CC(C)C)C(=O)OCCOC(F)F	ZINC000853893838	CD	On-Demand	Anodyne	CAPN2	64	34
O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853893848	FD	On-Demand	Bother	CACNA1D	55	32
NC(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853893859	CC	On-Demand	Anodyne	PLA2G4B	84	39
C#CCOCCOC(=O)CCc1ccc(OC)c(O)c1	ZINC000853893860	CD	On-Demand	Mild	INHA	57	33
CC(C)c1cccc(COC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1	ZINC000853893883	GG	On-Demand	Bother	CACNA1C	42	41
CC(C)c1cccc(COC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1	ZINC000853893883	GG	On-Demand	Bother	CACNA1D	68	41
NS(=O)(=O)Cc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853893893	DC	On-Demand	Anodyne	CA2	17	41
CC(C)c1cccc(COC(=O)COc2ccc(C(N)=O)cc2)c1	ZINC000853893988	EG	On-Demand	Anodyne	PLA2G4B	63	39
CC(C)c1cccc(COC(=O)COc2ccc(C(N)=O)cc2)c1	ZINC000853893988	EG	On-Demand	Anodyne	ACR	40	36
CC(C)c1cccc(COC(=O)COc2ccc(C(N)=O)cc2)c1	ZINC000853893988	EG	On-Demand	Anodyne	FFAR1	33	40
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CCOC1	ZINC000853894045	DE	On-Demand	Reactive	LCK	15	41
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@H]1CCOC1	ZINC000853894046	DE	On-Demand	Reactive	LCK	15	41
O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)OCCOC(F)F	ZINC000853894058	GI	On-Demand	Anodyne	DPP8	57	35
O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)OCCOC(F)F	ZINC000853894058	GI	On-Demand	Anodyne	DPP9	56	35
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CASP3	15	42
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	KLK3	41	33
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CTSB	54	46
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	PAPA1_CARPA	47	36
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CYSP_TRYCR	47	38
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CTSK	32	46
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CTSL	40	40
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CAPNS1	61	36
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CTSS	21	46
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CAPN1	68	39
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CASP1	20	42
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	CAPN2	112	40
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	TPSAB1	29	40
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	NPR	73	39
O=C(CNC(=O)OCc1ccccc1)OCCOC(F)F	ZINC000853894068	DD	On-Demand	Anodyne	PDS	47	40
COC(=O)N[C@H](CC(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853894090	ED	On-Demand	Bother	CAPNS1	42	31
COC(=O)N[C@H](CC(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853894090	ED	On-Demand	Bother	CAPN2	41	32
COC(=O)N[C@@H](CC(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853894091	ED	On-Demand	Bother	CAPNS1	42	31
COC(=O)N[C@@H](CC(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853894091	ED	On-Demand	Bother	CAPN2	41	32
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA2	97	45
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA1	76	39
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA7	68	37
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA5B	53	32
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA4	81	45
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA5A	57	32
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA14	40	39
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA12	50	39
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CA9	53	39
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	CAH_METTE	44	36
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	NCE103	43	37
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	MTCA1	41	35
NS(=O)(=O)c1ccc(O)c(C(=O)OCCOC(F)F)c1	ZINC000853894097	DC	On-Demand	Anodyne	P96878_MYCTU	49	35
CC(C)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894136	DG	On-Demand	Anodyne	PLA2G4B	50	31
O=C(OCCOC(F)F)C(F)(F)c1ccc(F)cc1	ZINC000853894196	CF	On-Demand	Anodyne	AMY2	43	29
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)OCCOC(F)F	ZINC000853894205	DF	On-Demand	Anodyne	FKBP1A	72	46
CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)OCCOC(F)F	ZINC000853894205	DF	On-Demand	Anodyne	PREP	15	51
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853894206	DF	On-Demand	Anodyne	FKBP1A	72	46
CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853894206	DF	On-Demand	Anodyne	PREP	15	51
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1O	ZINC000853894226	CB	On-Demand	Mild	CA2	37	50
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1O	ZINC000853894226	CB	On-Demand	Mild	CA7	25	43
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1O	ZINC000853894226	CB	On-Demand	Mild	CA12	16	50
C#CCOCCOC(=O)c1cc(S(N)(=O)=O)ccc1O	ZINC000853894226	CB	On-Demand	Mild	CA9	17	50
O=C(OCCOC(F)F)C(F)(F)c1cccc(Cl)c1	ZINC000853894277	DG	On-Demand	Anodyne	AMY2	54	31
O=C(OCCOC(F)F)C(F)(F)c1cccc(Cl)c1	ZINC000853894277	DG	On-Demand	Anodyne	PDS	40	35
NS(=O)(=O)c1ccc(O)c(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853894281	DD	On-Demand	Anodyne	CA2	34	40
NS(=O)(=O)c1ccc(O)c(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853894282	DD	On-Demand	Anodyne	CA2	34	40
NS(=O)(=O)c1ccc(O)c(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853894283	DD	On-Demand	Anodyne	CA2	34	40
COCCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853894347	EE	On-Demand	Anodyne	MMP1	16	46
COCCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853894348	EE	On-Demand	Anodyne	MMP1	16	46
CC(C)(C(=O)OCCOC(F)F)c1ccccc1Cl	ZINC000853894395	CG	On-Demand	Anodyne	AMY2	58	34
CON(C)CCNC(=O)NCC(C)(C)C1CCCC1	ZINC000853894416	CD	On-Demand	Anodyne	AMY2	44	32
C#CCOCCOC(=O)C(=O)NCCCc1ccccc1	ZINC000853894421	CC	On-Demand	Mild	AMP1_PLAFQ	22	41
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)Nc2cc(Cl)ccc2F)cc1	ZINC000853894427	JJ	On-Demand	Anodyne	RORC	20	55
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)Nc2cc(Cl)ccc2F)cc1	ZINC000853894428	JJ	On-Demand	Anodyne	RORC	20	55
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA2	115	50
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA1	91	43
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA7	66	43
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA5B	69	43
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA4	82	50
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA5A	74	43
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA14	40	41
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA12	63	41
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	CA9	74	43
CC(C)c1cccc(COC(=O)Cc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894457	EF	On-Demand	Anodyne	P96878_MYCTU	31	41
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853894458	EE	On-Demand	Anodyne	HTR4	20	41
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853894459	EE	On-Demand	Anodyne	HTR4	20	41
C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853894460	EE	On-Demand	Anodyne	HTR4	20	41
C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853894461	EE	On-Demand	Anodyne	HTR4	20	41
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	CA2	54	61
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	CA1	48	49
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	CA7	48	61
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	CA4	45	46
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	CA14	26	50
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	CA12	36	61
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	CA9	34	61
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	MTCA1	25	44
C#CCOCCOC(=O)CCOc1ccc(S(N)(=O)=O)cc1	ZINC000853894513	EC	On-Demand	Mild	P96878_MYCTU	30	44
CC(C)c1cccc(COC(=O)CNC(=O)Cc2ccc(O)cc2)c1	ZINC000853894542	EF	On-Demand	Anodyne	OPRM1	22	40
CC(C)c1cccc(COC(=O)CNC(=O)Cc2ccc(O)cc2)c1	ZINC000853894542	EF	On-Demand	Anodyne	OPRD1	21	40
CC(C)c1cccc(COC(=O)CNC(=O)Cc2ccc(O)cc2)c1	ZINC000853894542	EF	On-Demand	Anodyne	GRIA1	44	38
N#Cc1ccc(C(=O)NCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853894546	CD	On-Demand	Mild	CTRB_BOVIN	48	37
N#Cc1ccc(C(=O)NCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853894547	CD	On-Demand	Mild	CTRB_BOVIN	48	37
N#Cc1ccc(C(=O)NCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853894548	CD	On-Demand	Mild	CTRB_BOVIN	48	37
O=C(OCCOC(F)F)c1cnc(-c2ccc3c(c2)OCO3)s1	ZINC000853894580	EF	On-Demand	Anodyne	CLK4	42	32
CNC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853894637	GD	On-Demand	Anodyne	F10	15	41
CNC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853894637	GD	On-Demand	Anodyne	MMP13	19	42
CNC(=O)c1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853894638	GD	On-Demand	Anodyne	F10	15	41
CNC(=O)c1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853894638	GD	On-Demand	Anodyne	MMP13	19	42
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	CA2	73	47
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	CA1	59	47
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	CA7	56	47
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	CA4	57	44
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	CA14	33	42
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	CA12	38	47
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	CA9	42	47
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	MTCA1	15	42
CC(C)c1cccc(COC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853894678	GF	On-Demand	Anodyne	P96878_MYCTU	22	42
CC(C)c1cccc(COC(=O)C(C)(C)n2cc([N+](=O)[O-])cn2)c1	ZINC000853894708	EG	On-Demand	Bother	CACNA1D	40	34
O=C(CNC(=O)c1cc(-c2ccccc2)on1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853894717	EF	On-Demand	Anodyne	HDAC10	15	47
O=C(CNC(=O)c1cc(-c2ccccc2)on1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853894718	EF	On-Demand	Anodyne	HDAC10	15	47
O=C(CNC(=O)c1cc(-c2ccccc2)on1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853894719	EF	On-Demand	Anodyne	HDAC10	15	47
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1Cl	ZINC000853894739	EE	On-Demand	Anodyne	CA2	19	44
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1Cl	ZINC000853894739	EE	On-Demand	Anodyne	CA1	18	44
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1Cl	ZINC000853894739	EE	On-Demand	Anodyne	CA7	23	44
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1Cl	ZINC000853894739	EE	On-Demand	Anodyne	CA13	40	44
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1Cl	ZINC000853894741	EE	On-Demand	Anodyne	CA2	19	44
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1Cl	ZINC000853894741	EE	On-Demand	Anodyne	CA1	18	44
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1Cl	ZINC000853894741	EE	On-Demand	Anodyne	CA7	23	44
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1Cl	ZINC000853894741	EE	On-Demand	Anodyne	CA13	40	44
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1Cl	ZINC000853894743	EE	On-Demand	Anodyne	CA2	19	44
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1Cl	ZINC000853894743	EE	On-Demand	Anodyne	CA1	18	44
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1Cl	ZINC000853894743	EE	On-Demand	Anodyne	CA7	23	44
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1Cl	ZINC000853894743	EE	On-Demand	Anodyne	CA13	40	44
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	CA2	91	55
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	CA1	78	55
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	CA7	69	55
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	CA4	66	49
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	CA14	42	38
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	CA12	57	55
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	CA9	57	55
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	NCE103	36	41
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	MTCA1	37	50
NS(=O)(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853894747	EC	On-Demand	Anodyne	P96878_MYCTU	45	50
O=C(CNC(=O)c1ccc(O)cc1)OCCOC(F)F	ZINC000853894773	CC	On-Demand	Anodyne	CA2	15	42
O=C(OCCOC(F)F)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F	ZINC000853894786	FF	On-Demand	Anodyne	SLC5A1	15	46
CC(=O)c1ccc(N2CCC(CO)(CO)C2)c([N+](=O)[O-])c1	ZINC000853894811	CC	On-Demand	Bother	TAAR1	17	44
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853894824	EE	On-Demand	Anodyne	CA2	47	48
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853894824	EE	On-Demand	Anodyne	CA1	35	48
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853894824	EE	On-Demand	Anodyne	CA7	39	45
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853894824	EE	On-Demand	Anodyne	CA13	23	48
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853894826	EE	On-Demand	Anodyne	CA2	47	48
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853894826	EE	On-Demand	Anodyne	CA1	35	48
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853894826	EE	On-Demand	Anodyne	CA7	39	45
NS(=O)(=O)c1ccc(SCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853894826	EE	On-Demand	Anodyne	CA13	23	48
C=CCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853894827	DE	On-Demand	Mild	MMP1	15	46
NS(=O)(=O)c1ccc(SCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853894828	EE	On-Demand	Anodyne	CA2	47	48
NS(=O)(=O)c1ccc(SCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853894828	EE	On-Demand	Anodyne	CA1	35	48
NS(=O)(=O)c1ccc(SCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853894828	EE	On-Demand	Anodyne	CA7	39	45
NS(=O)(=O)c1ccc(SCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853894828	EE	On-Demand	Anodyne	CA13	23	48
C=CCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853894829	DE	On-Demand	Mild	MMP1	15	46
C[C@H](NC(=O)c1ccccc1NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1	ZINC000853894852	JG	On-Demand	Anodyne	PTGER3	45	35
C[C@H](NC(=O)c1ccccc1NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1	ZINC000853894852	JG	On-Demand	Anodyne	TACR3	18	43
C[C@H](NC(=O)c1ccccc1NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1	ZINC000853894852	JG	On-Demand	Anodyne	MTTP	82	38
C[C@@H](NC(=O)c1ccccc1NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1	ZINC000853894856	JG	On-Demand	Anodyne	PTGER3	45	35
C[C@@H](NC(=O)c1ccccc1NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1	ZINC000853894856	JG	On-Demand	Anodyne	TACR3	18	43
C[C@@H](NC(=O)c1ccccc1NC(=O)COc1c(CO)cc(F)cc1CO)c1ccccc1	ZINC000853894856	JG	On-Demand	Anodyne	MTTP	82	38
CC(=O)c1ccc(N2CCC3(CCCC3=O)CC2)c([N+](=O)[O-])c1	ZINC000853894878	DG	On-Demand	Bother	TAAR1	20	47
O=C(NCCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853894919	DD	On-Demand	Anodyne	SCN2A	19	41
O=C(NCCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853894919	DD	On-Demand	Anodyne	FAAH	23	41
O=C(NCCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853894919	DD	On-Demand	Anodyne	CAPN1	19	44
O=C(NCCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853894919	DD	On-Demand	Anodyne	CAPN2	49	44
O=C(NCCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853894919	DD	On-Demand	Anodyne	AMP1_PLAFQ	31	45
O=C(NCCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853894919	DD	On-Demand	Anodyne	CRTM	44	39
Cc1c(C(=O)OCCOC(F)F)nnn1-c1ccccc1Cl	ZINC000853894956	EF	On-Demand	Anodyne	SLC5A1	21	42
CC(C)c1cccc(COC(=O)c2ccc(N3CCCC3)nn2)c1	ZINC000853894968	EH	On-Demand	Anodyne	SCD1	44	39
CC(C)c1cccc(COC(=O)c2ccc(N3CCCC3)nn2)c1	ZINC000853894968	EH	On-Demand	Anodyne	SLC12A5	42	32
CS(=O)(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853895091	FC	On-Demand	Anodyne	HTR4	41	38
CS(=O)(=O)N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853895094	FC	On-Demand	Anodyne	HTR4	41	38
CS(=O)(=O)N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853895097	FC	On-Demand	Anodyne	HTR4	41	38
CS(=O)(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853895100	FC	On-Demand	Anodyne	HTR4	41	38
COC(=O)Nc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853895104	ED	On-Demand	Anodyne	CASR	18	42
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895116	FE	On-Demand	Anodyne	PREP	26	43
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895116	FE	On-Demand	Anodyne	SLC12A5	49	34
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895116	FE	On-Demand	Anodyne	Q9NAW4_PLAFA	43	53
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895119	FE	On-Demand	Anodyne	PREP	26	43
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895119	FE	On-Demand	Anodyne	SLC12A5	49	34
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895119	FE	On-Demand	Anodyne	Q9NAW4_PLAFA	43	53
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895122	FE	On-Demand	Anodyne	PREP	26	43
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895122	FE	On-Demand	Anodyne	SLC12A5	49	34
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895122	FE	On-Demand	Anodyne	Q9NAW4_PLAFA	43	53
CC(C)c1cccc(COC(=O)CSc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853895124	GG	On-Demand	Anodyne	CA2	73	46
CC(C)c1cccc(COC(=O)CSc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853895124	GG	On-Demand	Anodyne	CA1	55	46
CC(C)c1cccc(COC(=O)CSc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853895124	GG	On-Demand	Anodyne	CA7	46	46
CC(C)c1cccc(COC(=O)CSc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853895124	GG	On-Demand	Anodyne	CA13	30	46
CC(C)c1cccc(COC(=O)CSc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853895124	GG	On-Demand	Anodyne	CA4	55	45
CC(C)c1cccc(COC(=O)CSc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853895124	GG	On-Demand	Anodyne	CA12	36	46
CC(C)c1cccc(COC(=O)CSc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853895124	GG	On-Demand	Anodyne	CA9	40	39
O=C(OCCOC(F)F)c1cccc(F)c1F	ZINC000853895151	CE	On-Demand	Anodyne	CES2	15	42
CC(C)c1cccc(COC(=O)CNC(=O)c2ccc(C#N)cc2)c1	ZINC000853895156	EG	On-Demand	Mild	CTSG	20	42
CC(C)c1cccc(COC(=O)CNC(=O)c2ccc(C#N)cc2)c1	ZINC000853895156	EG	On-Demand	Mild	CTRB1	17	42
CC(C)c1cccc(COC(=O)CNC(=O)c2ccc(C#N)cc2)c1	ZINC000853895156	EG	On-Demand	Mild	CELA2A	16	42
CC(C)c1cccc(COC(=O)CNC(=O)c2ccc(C#N)cc2)c1	ZINC000853895156	EG	On-Demand	Mild	CTRB_BOVIN	57	41
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000853895176	FD	On-Demand	Anodyne	FKBP1A	46	51
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2	ZINC000853895177	FD	On-Demand	Anodyne	FKBP1A	46	51
COC[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895194	CG	On-Demand	Anodyne	CAPNS1	53	33
COC[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895194	CG	On-Demand	Anodyne	CAPN1	50	37
COC[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895194	CG	On-Demand	Anodyne	CAPN2	78	35
COC[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895194	CG	On-Demand	Anodyne	NPR	59	32
COC[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895196	CG	On-Demand	Anodyne	CAPNS1	53	33
COC[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895196	CG	On-Demand	Anodyne	CAPN1	50	37
COC[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895196	CG	On-Demand	Anodyne	CAPN2	78	35
COC[C@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853895196	CG	On-Demand	Anodyne	NPR	59	32
CS(=O)(=O)N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853895226	FD	On-Demand	Reactive	CACNA1I	76	37
CS(=O)(=O)N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853895228	FD	On-Demand	Reactive	CACNA1I	76	37
O=C(NCCCc1ccccc1)C(=O)OCc1ncsc1Br	ZINC000853895243	GF	On-Demand	Anodyne	FAAH	41	36
O=C(NCCCc1ccccc1)C(=O)OCc1ncsc1Br	ZINC000853895243	GF	On-Demand	Anodyne	CES1	46	36
O=C(NCCCc1ccccc1)C(=O)OCc1ncsc1Br	ZINC000853895243	GF	On-Demand	Anodyne	CAPN2	34	40
O=C(NCCCc1ccccc1)C(=O)OCc1ncsc1Br	ZINC000853895243	GF	On-Demand	Anodyne	AMP1_PLAFQ	21	40
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA2	42	49
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA1	33	47
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA7	36	46
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA13	21	47
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA4	34	41
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA14	16	49
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA12	26	49
C#CCOCCOC(=O)CSc1ccc(S(N)(=O)=O)cc1	ZINC000853895290	EC	On-Demand	Mild	CA9	23	49
N#Cc1ccc(C(=O)NCC(=O)OCCOC(F)F)cc1	ZINC000853895300	CD	On-Demand	Mild	CTRB_BOVIN	53	39
COCc1cc([N+](=O)[O-])ccc1N1CCC(CO)(CO)C1	ZINC000853895304	CC	On-Demand	Bother	CACNA1D	55	34
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	CA2	47	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	CA1	38	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	CA7	42	47
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	CA4	26	45
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	CA12	44	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	CA9	40	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	MTCA1	24	43
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895308	ED	On-Demand	Anodyne	P96878_MYCTU	23	43
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1cccs1	ZINC000853895309	FD	On-Demand	Anodyne	FKBP1A	49	45
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	CA2	47	48
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	CA1	38	48
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	CA7	42	47
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	CA4	26	45
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	CA12	44	48
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	CA9	40	48
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	MTCA1	24	43
NS(=O)(=O)c1ccc(OCCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895310	ED	On-Demand	Anodyne	P96878_MYCTU	23	43
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1cccs1	ZINC000853895311	FD	On-Demand	Anodyne	FKBP1A	49	45
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	CA2	47	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	CA1	38	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	CA7	42	47
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	CA4	26	45
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	CA12	44	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	CA9	40	48
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	MTCA1	24	43
NS(=O)(=O)c1ccc(OCCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895312	ED	On-Demand	Anodyne	P96878_MYCTU	23	43
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	ZINC000853895355	DC	On-Demand	Mild	CA2	25	50
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	ZINC000853895355	DC	On-Demand	Mild	CA1	25	44
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	ZINC000853895355	DC	On-Demand	Mild	CA7	20	44
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1	ZINC000853895355	DC	On-Demand	Mild	CA13	36	44
O=C(OCCOC(F)F)c1ccc(OCc2ccccc2)nc1	ZINC000853895379	DG	On-Demand	Anodyne	FFAR1	15	46
O=C(OCCOC(F)F)C1CCN(c2nc3ccccc3s2)CC1	ZINC000853895405	FG	On-Demand	Anodyne	LTA4H	28	41
O=C(OCCOC(F)F)C1CCN(c2nc3ccccc3s2)CC1	ZINC000853895405	FG	On-Demand	Anodyne	PDE6D	60	40
COC[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895454	DD	On-Demand	Anodyne	MMP1	29	44
COC[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895454	DD	On-Demand	Anodyne	PROKR1	47	31
COC[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895457	DD	On-Demand	Anodyne	MMP1	29	44
COC[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895457	DD	On-Demand	Anodyne	PROKR1	47	31
COC[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895459	DD	On-Demand	Anodyne	MMP1	29	44
COC[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895459	DD	On-Demand	Anodyne	PROKR1	47	31
COC[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895461	DD	On-Demand	Anodyne	MMP1	29	44
COC[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895461	DD	On-Demand	Anodyne	PROKR1	47	31
CS(=O)(=O)Nc1cc(C(=O)OCCOC(F)F)ccc1F	ZINC000853895466	ED	On-Demand	Anodyne	TRPV1	59	36
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895467	EC	On-Demand	Mild	FKBP1A	41	38
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895467	EC	On-Demand	Mild	PREP	31	42
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895467	EC	On-Demand	Mild	Q9NAW4_PLAFA	43	52
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	CA2	52	61
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	CA1	46	49
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	CA7	46	61
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	CA4	42	46
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	CA14	22	50
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	PLA2G4B	44	32
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	CA12	35	61
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	CA9	34	61
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	MTCA1	25	44
C#CCOCCOC(=O)COc1ccc(S(N)(=O)=O)cc1	ZINC000853895474	DB	On-Demand	Mild	P96878_MYCTU	30	44
CC[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853895491	FF	On-Demand	Bother	ECE1	29	42
CC[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853895494	FF	On-Demand	Bother	ECE1	29	42
O=C(OCCOC(F)F)c1ccc(CNC(=O)C2CCCC2)cc1	ZINC000853895500	EF	On-Demand	Anodyne	PROC	42	32
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895518	JK	On-Demand	Anodyne	CYSLTR1	20	41
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895518	JK	On-Demand	Anodyne	RORC	27	50
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895519	JK	On-Demand	Anodyne	CYSLTR1	20	41
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895519	JK	On-Demand	Anodyne	RORC	27	50
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895520	JK	On-Demand	Anodyne	CYSLTR1	20	41
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895520	JK	On-Demand	Anodyne	RORC	27	50
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895521	JK	On-Demand	Anodyne	CYSLTR1	20	41
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc3ccccc3c2)cc1	ZINC000853895521	JK	On-Demand	Anodyne	RORC	27	50
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA2	127	49
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA6	25	44
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA1	106	47
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA7	75	46
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA13	26	44
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA5B	61	45
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA4	89	49
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA5A	64	45
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA14	47	45
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA12	79	47
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA9	86	47
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CAH_METTE	30	44
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CYNT	31	45
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	NCE103	28	46
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	CA15	17	44
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	MTCA1	37	40
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	P96878_MYCTU	45	41
NS(=O)(=O)c1ccc(CC(=O)OCCOC(F)F)cc1	ZINC000853895543	DC	On-Demand	Anodyne	A6YCJ1_9METZ	24	44
O=C(OCc1nnc2n1CCOCC2)c1ccc(CNC(=O)C2CCCC2)cc1	ZINC000853895562	GE	On-Demand	Anodyne	TMPRSS11D	49	36
CC(C)c1cccc(COC(=O)C2(C(F)(F)F)CC2)c1	ZINC000853895572	CI	On-Demand	Anodyne	SLC12A5	67	38
O=C(OCCOC(F)F)c1nnn(-c2ccccc2F)c1C(F)(F)F	ZINC000853895573	FF	On-Demand	Anodyne	SLC5A1	15	41
O=[N+]([O-])c1ccc(N2CCC(CO)(CO)C2)c2nonc12	ZINC000853895584	CC	On-Demand	Bother	GSTM2	121	42
O=[N+]([O-])c1ccc(N2CCC(CO)(CO)C2)c2nonc12	ZINC000853895584	CC	On-Demand	Bother	GSTP1	73	41
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)NNc1cc(F)cc(Cl)c1	ZINC000853895594	GG	On-Demand	Reactive	CCR3	17	40
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)NNc1cc(F)cc(Cl)c1	ZINC000853895595	GG	On-Demand	Reactive	CCR3	17	40
C#CCOCCOC(=O)CNC(=O)c1ccc(C#N)cc1	ZINC000853895609	CC	On-Demand	Mild	CTRB_BOVIN	48	36
O=C(OCCOC(F)F)[C@@H](OC1CCCC1)c1ccccc1	ZINC000853895629	DG	On-Demand	Anodyne	AMY2	49	34
O=C(OCCOC(F)F)[C@H](OC1CCCC1)c1ccccc1	ZINC000853895630	DG	On-Demand	Anodyne	AMY2	49	34
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895643	FD	On-Demand	Anodyne	FKBP1A	42	37
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895643	FD	On-Demand	Anodyne	PREP	27	41
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1	ZINC000853895643	FD	On-Demand	Anodyne	Q9NAW4_PLAFA	46	56
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	CA2	56	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	CA1	43	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	CA7	47	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	CA4	29	41
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	CA14	51	34
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	CA12	52	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	CA9	49	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	MTCA1	26	40
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853895652	ED	On-Demand	Anodyne	P96878_MYCTU	29	40
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	CA2	56	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	CA1	43	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	CA7	47	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	CA4	29	41
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	CA14	51	34
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	CA12	52	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	CA9	49	44
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	MTCA1	26	40
NS(=O)(=O)c1ccc(OCC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853895653	ED	On-Demand	Anodyne	P96878_MYCTU	29	40
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	CA2	56	44
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	CA1	43	44
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	CA7	47	44
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	CA4	29	41
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	CA14	51	34
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	CA12	52	44
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	CA9	49	44
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	MTCA1	26	40
NS(=O)(=O)c1ccc(OCC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853895654	ED	On-Demand	Anodyne	P96878_MYCTU	29	40
CC(C)c1cccc(COC(=O)C2(S(C)(=O)=O)CCCC2)c1	ZINC000853895670	DG	On-Demand	Anodyne	SLC12A5	68	39
O=C(OCCOC(F)F)c1ccc(N2CCCC2)nn1	ZINC000853895671	CD	On-Demand	Anodyne	SCD1	53	41
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	LTA4H	24	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	SIGMAR1	19	45
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	MMP2	18	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	MMP3	33	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	MMP9	31	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	MMP7	32	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	MMP1	38	48
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895761	ED	On-Demand	Anodyne	PROKR1	53	31
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	LTA4H	24	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	SIGMAR1	19	45
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	MMP2	18	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	MMP3	33	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	MMP9	31	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	MMP7	32	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	MMP1	38	48
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895762	ED	On-Demand	Anodyne	PROKR1	53	31
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	LTA4H	24	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	SIGMAR1	19	45
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	MMP2	18	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	MMP3	33	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	MMP9	31	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	MMP7	32	40
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	MMP1	38	48
COC(=O)[C@@H]1C[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895763	ED	On-Demand	Anodyne	PROKR1	53	31
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	LTA4H	24	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	SIGMAR1	19	45
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	MMP2	18	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	MMP3	33	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	MMP9	31	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	MMP7	32	40
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	MMP1	38	48
COC(=O)[C@@H]1C[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853895764	ED	On-Demand	Anodyne	PROKR1	53	31
CC(C)(C)CC(=O)N1CCC[C@H]1C(=O)OCCOC(F)F	ZINC000853895776	DE	On-Demand	Anodyne	FKBP1A	52	43
CC(C)(C)CC(=O)N1CCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853895778	DE	On-Demand	Anodyne	FKBP1A	52	43
CC(C)c1cccc(COC(=O)C2(O)CCOCC2)c1	ZINC000853895826	CE	On-Demand	Anodyne	SLC12A5	61	34
Cc1ccc(C(C)(C)C(=O)OCCOC(F)F)cc1	ZINC000853895827	CG	On-Demand	Anodyne	AMY2	58	33
C[Si](C)(C)c1ccc(CNC(=O)NC[C@@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853895836	GD	On-Demand	Anodyne	NAMPT	65	39
C[Si](C)(C)c1ccc(CNC(=O)NC[C@H]2CCN(S(C)(=O)=O)C2)cc1	ZINC000853895837	GD	On-Demand	Anodyne	NAMPT	65	39
CC(C)c1cccc(COC(=O)C2(C(=O)NC3CC3)CC2)c1	ZINC000853895857	DF	On-Demand	Anodyne	SLC12A5	58	34
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA2	93	52
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA6	20	40
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA1	82	49
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA7	64	49
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA13	20	40
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA5B	57	42
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA4	68	49
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA5A	60	42
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA14	38	52
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA12	62	52
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA9	67	52
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CAH_METTE	24	40
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CYNT	25	41
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	NCE103	21	43
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	CA15	16	40
C#CCOCCOC(=O)Cc1ccc(S(N)(=O)=O)cc1	ZINC000853895858	CC	On-Demand	Mild	A6YCJ1_9METZ	22	40
Nc1nc(Cl)cc(N2CCC3(CCCC3=O)CC2)n1	ZINC000853895864	CE	On-Demand	Anodyne	HRH4	30	40
COC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853895867	GF	On-Demand	Anodyne	F10	19	42
COC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853895867	GF	On-Demand	Anodyne	TRY2_BOVIN	17	41
COC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853895867	GF	On-Demand	Anodyne	CCR3	36	40
COC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853895867	GF	On-Demand	Anodyne	MMP1	16	42
COC(=O)Nc1cccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853895867	GF	On-Demand	Anodyne	MCHR1	31	44
C#CCNC(=O)c1ccc(N2CCC(CO)(CO)C2)nc1	ZINC000853895869	CB	On-Demand	Mild	HDAC1	17	42
C[C@@H](Oc1ccccc1C(F)(F)F)C(=O)OCc1nnc2n1CCOCC2	ZINC000853895873	GE	On-Demand	Anodyne	PLK1	41	34
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1Cl	ZINC000853895884	ED	On-Demand	Anodyne	CA2	40	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1Cl	ZINC000853895884	ED	On-Demand	Anodyne	CA1	30	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1Cl	ZINC000853895884	ED	On-Demand	Anodyne	CA7	33	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1Cl	ZINC000853895884	ED	On-Demand	Anodyne	CA13	41	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1Cl	ZINC000853895884	ED	On-Demand	Anodyne	CA4	32	40
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853895920	FG	On-Demand	Reactive	CCR3	15	41
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853895921	FG	On-Demand	Reactive	CCR3	15	41
CC(C)(C(=O)OCCOC(F)F)c1cccc(Br)c1	ZINC000853895935	EH	On-Demand	Anodyne	AMY2	59	36
CC(C)(C(=O)OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853895948	EH	On-Demand	Anodyne	AMY2	59	34
CC(C)(C(=O)OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853895948	EH	On-Demand	Anodyne	PDS	41	38
NS(=O)(=O)c1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853895971	ED	On-Demand	Anodyne	CA2	74	50
NS(=O)(=O)c1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853895971	ED	On-Demand	Anodyne	CA1	59	50
NS(=O)(=O)c1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853895971	ED	On-Demand	Anodyne	CA7	57	47
NS(=O)(=O)c1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853895971	ED	On-Demand	Anodyne	CA13	30	50
NS(=O)(=O)c1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853895971	ED	On-Demand	Anodyne	CA4	54	42
NS(=O)(=O)c1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853895971	ED	On-Demand	Anodyne	CA12	43	47
NS(=O)(=O)c1ccc(SCC(=O)OCCOC(F)F)cc1	ZINC000853895971	ED	On-Demand	Anodyne	CA9	41	40
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	ZINC000853895990	GF	On-Demand	Anodyne	FKBP1A	63	42
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc(Br)cc1	ZINC000853895990	GF	On-Demand	Anodyne	PREP	40	44
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	ZINC000853895991	GF	On-Demand	Anodyne	FKBP1A	63	42
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1	ZINC000853895991	GF	On-Demand	Anodyne	PREP	40	44
CC(C)c1cccc(COC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1	ZINC000853895997	EF	On-Demand	Bother	CACNA1D	45	34
O=C(OCCOC(F)F)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000853896004	DE	On-Demand	Bother	GABRA1	15	50
O=C(OCCOC(F)F)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000853896004	DE	On-Demand	Bother	CACNA1D	45	34
O=C(OCCOC(F)F)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000853896004	DE	On-Demand	Bother	GABRA2	15	48
COC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853896006	GF	On-Demand	Anodyne	F10	19	42
COC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853896006	GF	On-Demand	Anodyne	TRY2_BOVIN	17	41
COC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853896006	GF	On-Demand	Anodyne	CCR3	36	40
COC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853896006	GF	On-Demand	Anodyne	MMP1	16	42
COC(=O)Nc1cccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853896006	GF	On-Demand	Anodyne	MCHR1	31	44
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	CA2	73	47
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	CA1	59	47
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	CA7	56	47
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	CA4	54	45
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	CA14	33	40
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	CA12	40	47
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	ADAMTS4	26	40
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	CA9	44	47
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	MTCA1	19	40
CC(C)c1cccc(COC(=O)COc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853896048	FF	On-Demand	Anodyne	P96878_MYCTU	24	40
CCc1ccc([C@H](C)C(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853896065	DG	On-Demand	Bother	GSTM2	22	41
O=C(NCCCc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853896085	DE	On-Demand	Anodyne	AMP1_PLAFQ	22	42
O=C(NCCCc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853896087	DE	On-Demand	Anodyne	AMP1_PLAFQ	22	42
O=C(NCCCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853896090	DE	On-Demand	Anodyne	AMP1_PLAFQ	22	42
Cc1oc(-c2ccco2)nc1CC(=O)OCCOC(F)F	ZINC000853896092	DF	On-Demand	Anodyne	PPARG	70	48
Cc1oc(-c2ccco2)nc1CC(=O)OCCOC(F)F	ZINC000853896092	DF	On-Demand	Anodyne	PPARA	72	48
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA2	102	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA1	87	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA7	67	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA13	23	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA5B	53	42
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA4	64	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA5A	56	42
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA14	62	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA12	79	41
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA9	81	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CAH_METTE	24	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CYNT	30	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	NCE103	21	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	CA15	15	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	P96878_MYCTU	44	34
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853896116	DD	On-Demand	Anodyne	A6YCJ1_9METZ	22	40
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA2	102	43
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA1	87	43
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA7	67	43
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA13	23	40
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA5B	53	42
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA4	64	43
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA5A	56	42
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA14	62	40
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA12	79	41
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA9	81	43
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CAH_METTE	24	40
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CYNT	30	43
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	NCE103	21	43
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	CA15	15	40
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	P96878_MYCTU	44	34
NS(=O)(=O)c1ccc(CC(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853896118	DD	On-Demand	Anodyne	A6YCJ1_9METZ	22	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA2	102	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA1	87	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA7	67	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA13	23	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA5B	53	42
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA4	64	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA5A	56	42
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA14	62	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA12	79	41
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA9	81	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CAH_METTE	24	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CYNT	30	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	NCE103	21	43
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	CA15	15	40
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	P96878_MYCTU	44	34
NS(=O)(=O)c1ccc(CC(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853896120	DD	On-Demand	Anodyne	A6YCJ1_9METZ	22	40
CC(C)(C(=O)OCCOC(F)F)c1ccc(F)cc1	ZINC000853896124	CF	On-Demand	Anodyne	AMY2	55	31
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853896194	FG	On-Demand	Reactive	CCR3	36	43
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853896195	FG	On-Demand	Reactive	CCR3	36	43
O=C(OCCOC(F)F)c1ccc([N+](=O)[O-])cc1I	ZINC000853896238	GF	On-Demand	Bother	CACNA1D	47	35
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	CA2	87	55
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	CA1	75	55
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	CA7	65	55
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	CA4	63	49
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	PLA2G4B	71	33
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	CA12	54	55
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	CA9	55	55
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	MTCA1	37	50
NS(=O)(=O)c1ccc(OCC(=O)OCCOC(F)F)cc1	ZINC000853896256	EC	On-Demand	Anodyne	P96878_MYCTU	45	50
CC(C)c1cccc(COC(=O)C2(C)CCOCC2)c1	ZINC000853896267	CH	On-Demand	Anodyne	SLC12A5	60	33
CC(C)(C(=O)OCCOC(F)F)c1ccccc1F	ZINC000853896285	CF	On-Demand	Anodyne	AMY2	58	33
COCCS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853896298	ED	On-Demand	Anodyne	CA2	27	42
COCCS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853896298	ED	On-Demand	Anodyne	CA1	16	42
COCCS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853896298	ED	On-Demand	Anodyne	CA4	16	42
CC(C)c1cccc(COC(=O)C(C)(C)O)c1	ZINC000853896316	BF	On-Demand	Anodyne	AMY2	52	30
CCN(Cc1ccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])cc1)C(C)C	ZINC000853896322	FG	On-Demand	Bother	GSTM2	21	41
O=C(OCCOC(F)F)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1	ZINC000853896344	FG	On-Demand	Anodyne	AMY2	42	29
O=C(OCCOC(F)F)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccccc1	ZINC000853896346	FG	On-Demand	Anodyne	AMY2	42	29
O=C(OCCOC(F)F)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1	ZINC000853896348	FG	On-Demand	Anodyne	AMY2	42	29
O=C(OCCOC(F)F)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccccc1	ZINC000853896350	FG	On-Demand	Anodyne	AMY2	42	29
O=C(CCc1ccc(Cl)c(Cl)c1)OCCOC(F)F	ZINC000853896369	DH	On-Demand	Anodyne	TPSAB1	42	33
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)Nc2ccccc2S(C)(=O)=O)cc1	ZINC000853896482	JG	On-Demand	Anodyne	RORC	18	43
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)Nc2ccccc2S(C)(=O)=O)cc1	ZINC000853896483	JG	On-Demand	Anodyne	RORC	18	43
O=C(CNC(=O)c1cc(-c2ccccc2)on1)OCCOC(F)F	ZINC000853896513	ED	On-Demand	Anodyne	HDAC10	15	47
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1Br	ZINC000853896526	EF	On-Demand	Bother	CACNA1D	45	35
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1Br	ZINC000853896526	EF	On-Demand	Bother	SNCA	45	33
CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)OCCOC(F)F)nn2)CC1	ZINC000853896548	GE	On-Demand	Anodyne	GPR119	40	37
COc1ccc2[nH]cc(C(=O)OCCOC(F)F)c2c1	ZINC000853896570	CF	On-Demand	Anodyne	HTR1D	22	47
COc1ccc2[nH]cc(C(=O)OCCOC(F)F)c2c1	ZINC000853896570	CF	On-Demand	Anodyne	HTR1E	21	41
COc1ccc2[nH]cc(C(=O)OCCOC(F)F)c2c1	ZINC000853896570	CF	On-Demand	Anodyne	MTNR1A	46	46
COc1ccc2[nH]cc(C(=O)OCCOC(F)F)c2c1	ZINC000853896570	CF	On-Demand	Anodyne	MTNR1B	31	46
O=C(OCCOC(F)F)c1cc(-c2ccc(C(F)(F)F)cc2)no1	ZINC000853896598	FH	On-Demand	Anodyne	PPARD	25	40
COC(=O)c1nccnc1N1CCC(CO[Si](C)(C)C(C)(C)C)CC1	ZINC000853896601	FH	On-Demand	Reactive	SIRT3	58	36
COC(=O)c1nccnc1N1CCC(CO[Si](C)(C)C(C)(C)C)CC1	ZINC000853896601	FH	On-Demand	Reactive	SIRT2	48	34
COC(=O)c1nccnc1N1CCC(CO[Si](C)(C)C(C)(C)C)CC1	ZINC000853896601	FH	On-Demand	Reactive	SIRT1	46	34
Cn1ncc2c(N3CCC[C@@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853896609	EG	On-Demand	Reactive	PDE3B	40	32
Cn1ncc2c(N3CCC[C@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853896610	EG	On-Demand	Reactive	PDE3B	40	32
CON(C)CCNC(=O)NCC[C@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000853896625	EE	On-Demand	Anodyne	ACHE	17	41
CON(C)CCNC(=O)NCC[C@@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000853896626	EE	On-Demand	Anodyne	ACHE	17	41
CON(C)CCNC(=O)NCC[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000853896627	EE	On-Demand	Anodyne	ACHE	17	41
CON(C)CCNC(=O)NCC[C@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000853896628	EE	On-Demand	Anodyne	ACHE	17	41
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)cc1	ZINC000853896673	JH	On-Demand	Anodyne	RORC	20	48
Cc1noc(C)c1COc1ccc(CC(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)cc1	ZINC000853896674	JH	On-Demand	Anodyne	RORC	20	48
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)cc1	ZINC000853896675	JH	On-Demand	Anodyne	RORC	20	48
Cc1noc(C)c1COc1ccc(CC(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)cc1	ZINC000853896676	JH	On-Demand	Anodyne	RORC	20	48
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)OCc1nnc2n1CCOCC2	ZINC000853896687	GG	On-Demand	Anodyne	MC4R	48	38
O=C(Cc1ccccc1Br)OCCOC(F)F	ZINC000853896713	DF	On-Demand	Anodyne	CA9	17	40
Cn1nnc2c(N3CCC(CO[Si](C)(C)C(C)(C)C)CC3)ncnc21	ZINC000853896745	FF	On-Demand	Reactive	SIRT3	47	35
CC(C)c1cccc(COC(=O)Cc2cccc(NS(C)(=O)=O)c2)c1	ZINC000853896762	FG	On-Demand	Anodyne	ADRB3	15	42
Cc1nc(CCC(=O)OCCOC(F)F)oc1-c1ccccc1	ZINC000853896778	EG	On-Demand	Anodyne	PPARG	40	36
Cc1nc(CCC(=O)OCCOC(F)F)oc1-c1ccccc1	ZINC000853896778	EG	On-Demand	Anodyne	PPARA	40	37
COC(=O)c1cncnc1N1CCC(CO[Si](C)(C)C(C)(C)C)CC1	ZINC000853896827	FH	On-Demand	Reactive	SIRT3	65	36
COC(=O)c1cncnc1N1CCC(CO[Si](C)(C)C(C)(C)C)CC1	ZINC000853896827	FH	On-Demand	Reactive	SIRT2	55	36
COC(=O)c1cncnc1N1CCC(CO[Si](C)(C)C(C)(C)C)CC1	ZINC000853896827	FH	On-Demand	Reactive	SIRT1	53	34
O=C(OCCOC(F)F)[C@H](c1ccccc1)N1CCC(O)CC1	ZINC000853896838	ED	On-Demand	Anodyne	NPY2R	19	40
O=C(OCCOC(F)F)[C@@H](c1ccccc1)N1CCC(O)CC1	ZINC000853896839	ED	On-Demand	Anodyne	NPY2R	19	40
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)Cc2ccc(OCc3c(C)noc3C)cc2)CC1	ZINC000853896910	JF	On-Demand	Anodyne	RORC	18	45
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)Cc2ccc(OCc3c(C)noc3C)cc2)CC1	ZINC000853896911	JF	On-Demand	Anodyne	RORC	18	45
O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)OCCOC(F)F	ZINC000853896927	FI	On-Demand	Anodyne	AKR1B1	15	42
Cn1cnc2c(N3CCC(CO[Si](C)(C)C(C)(C)C)CC3)ncnc21	ZINC000853896945	FH	On-Demand	Reactive	SIRT3	43	34
Cn1ncc2c(N3CCC(CO[Si](C)(C)C(C)(C)C)CC3)ncnc21	ZINC000853896967	FH	On-Demand	Reactive	SIRT3	42	34
O=C(OCCOC(F)F)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000853896998	GE	On-Demand	Anodyne	FKBP1A	49	49
O=C(OCCOC(F)F)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000853896998	GE	On-Demand	Anodyne	SLC6A1	54	36
O=C(OCCOC(F)F)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000853896999	GE	On-Demand	Anodyne	FKBP1A	49	49
O=C(OCCOC(F)F)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1	ZINC000853896999	GE	On-Demand	Anodyne	SLC6A1	54	36
C#CCOCCOC(=O)c1c[nH]c2ccc(OC)cc12	ZINC000853897014	CD	On-Demand	Mild	HTR1D	21	46
C#CCOCCOC(=O)c1c[nH]c2ccc(OC)cc12	ZINC000853897014	CD	On-Demand	Mild	HTR1E	21	40
C#CCOCCOC(=O)c1c[nH]c2ccc(OC)cc12	ZINC000853897014	CD	On-Demand	Mild	MTNR1A	41	46
C#CCOCCOC(=O)c1c[nH]c2ccc(OC)cc12	ZINC000853897014	CD	On-Demand	Mild	MTNR1B	27	46
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000853897053	CG	On-Demand	Bother	CACNA1D	47	38
O=C(OCC1C[C@@H]2C[C@H]2C1)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000853897054	CG	On-Demand	Bother	CACNA1D	47	38
O=C(OCC1C[C@H]2C[C@@H]2C1)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000853897055	CG	On-Demand	Bother	CACNA1D	47	38
CO[C@@](C)(C(=O)OCCOC(F)F)c1ccccc1	ZINC000853897059	CE	On-Demand	Anodyne	AMY2	70	41
COC(=O)c1nccc(N2CCC(CO[Si](C)(C)C(C)(C)C)CC2)n1	ZINC000853897070	FH	On-Demand	Reactive	SIRT3	41	33
COC(=O)c1nccc(N2CCC(CO[Si](C)(C)C(C)(C)C)CC2)n1	ZINC000853897070	FH	On-Demand	Reactive	SIRT1	40	33
CCn1cnc2c(N3CCC(CO[Si](C)(C)C(C)(C)C)CC3)ncnc21	ZINC000853897085	GI	On-Demand	Reactive	SIRT3	51	35
CCn1cnc2c(N3CCC(CO[Si](C)(C)C(C)(C)C)CC3)ncnc21	ZINC000853897085	GI	On-Demand	Reactive	SIRT2	40	33
CCn1cnc2c(N3CCC(CO[Si](C)(C)C(C)(C)C)CC3)ncnc21	ZINC000853897085	GI	On-Demand	Reactive	SIRT1	40	31
COCCN(CCF)C(=O)NCC[C@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000853897141	FF	On-Demand	Anodyne	ACHE	16	41
COCCN(CCF)C(=O)NCC[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000853897142	FF	On-Demand	Anodyne	ACHE	16	41
COCCN(CCF)C(=O)NCC[C@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000853897143	FF	On-Demand	Anodyne	ACHE	16	41
COCCN(CCF)C(=O)NCC[C@@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000853897144	FF	On-Demand	Anodyne	ACHE	16	41
CC(C)c1cccc(COC(=O)C2(C(=O)NC3CC3)CCC2)c1	ZINC000853897186	DG	On-Demand	Anodyne	SLC12A5	63	35
Cc1c(C(=O)OCCOC(F)F)nnn1-c1ccc(OC(C)C)cc1	ZINC000853897215	FF	On-Demand	Anodyne	SLC5A1	22	44
CC(C)(C)OC(=O)N1CCC(n2cccc2C(=O)OCCOC(F)F)CC1	ZINC000853897237	GG	On-Demand	Anodyne	GPR119	40	39
COCc1cc(N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)ncn1	ZINC000853897240	DG	On-Demand	Reactive	PDE3B	42	33
COCc1cc(N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)ncn1	ZINC000853897241	DG	On-Demand	Reactive	PDE3B	42	33
C#CCOCCOC(=O)CNC(=O)c1c(F)cccc1Cl	ZINC000853897246	DD	On-Demand	Mild	PPIA	23	41
O=C(OCc1nnc2n1CCOCC2)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	ZINC000853897247	GC	On-Demand	Bother	CACNA1D	45	33
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccccn2)C1	ZINC000853897263	CC	On-Demand	Anodyne	DRD4	26	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccccn2)C1	ZINC000853897264	CC	On-Demand	Anodyne	DRD4	26	41
COC(=O)c1sc(N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)nc1Cl	ZINC000853897305	GI	On-Demand	Reactive	PARE	90	36
COC(=O)c1sc(N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)nc1Cl	ZINC000853897306	GI	On-Demand	Reactive	PARE	90	36
C[C@H]1CCCCN1CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853897330	FG	On-Demand	Anodyne	HTR4	15	48
C[C@H]1CCCCN1CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853897330	FG	On-Demand	Anodyne	HRH3	46	37
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853897331	FG	On-Demand	Anodyne	HTR4	15	48
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)OCCOC(F)F	ZINC000853897331	FG	On-Demand	Anodyne	HRH3	46	37
O=C(OCCOC(F)F)c1cccc(OC2CCCC2)c1	ZINC000853897343	DG	On-Demand	Anodyne	KCNH2	43	40
O=C(OCc1nnc2n1CCOCC2)c1cccc(OC2CCCC2)c1	ZINC000853897351	FF	On-Demand	Anodyne	KCNH2	42	39
Cc1c(C(=O)OCCOC(F)F)nnn1-c1ccc(F)c(Cl)c1	ZINC000853897372	EF	On-Demand	Anodyne	SLC5A1	21	43
COCCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853897399	GF	On-Demand	Anodyne	HRH3	26	42
COCCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853897399	GF	On-Demand	Anodyne	MMP1	21	43
COCCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853897400	GF	On-Demand	Anodyne	HRH3	26	42
COCCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853897400	GF	On-Demand	Anodyne	MMP1	21	43
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)OCC(=O)NC1CCN(C2CC2)CC1	ZINC000853897402	JE	On-Demand	Anodyne	CCR8	59	37
CC(C)c1cccc(COC(=O)CCCS(C)(=O)=O)c1	ZINC000853897441	CF	On-Demand	Anodyne	FFAR1	18	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)N[C@@H]2CCN(c3ccccn3)C2)C1	ZINC000853897500	GE	On-Demand	Anodyne	GPR119	19	56
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)N[C@H]2CCN(c3ccccn3)C2)C1	ZINC000853897501	GE	On-Demand	Anodyne	GPR119	19	56
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)N[C@@H]2CCN(c3ccccn3)C2)C1	ZINC000853897502	GE	On-Demand	Anodyne	GPR119	19	56
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)N[C@H]2CCN(c3ccccn3)C2)C1	ZINC000853897503	GE	On-Demand	Anodyne	GPR119	19	56
CC(C)c1cccc(COC(=O)C2(C(N)=O)CC2)c1	ZINC000853897525	CE	On-Demand	Anodyne	SLC12A5	67	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CC[C@@H](O)CC1	ZINC000853897537	ED	On-Demand	Clean	EPHX2	27	50
CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)OCC(=O)NCC(=O)N1CCCC1	ZINC000853897542	JD	On-Demand	Anodyne	CCR8	42	33
COCCOc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853897597	CE	On-Demand	Anodyne	PLA2G4B	56	36
COCCOc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853897597	CE	On-Demand	Anodyne	ACR	41	40
Cn1ncc2c(N3CC[C@@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853897600	EF	On-Demand	Reactive	PDE3A	41	38
Cn1ncc2c(N3CC[C@@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853897600	EF	On-Demand	Reactive	PDE3B	47	37
Cn1ncc2c(N3CC[C@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853897601	EF	On-Demand	Reactive	PDE3A	41	38
Cn1ncc2c(N3CC[C@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853897601	EF	On-Demand	Reactive	PDE3B	47	37
O=C(OCCOC(F)F)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	ZINC000853897668	ED	On-Demand	Bother	CACNA1C	44	38
O=C(OCCOC(F)F)c1cn(-c2cccc([N+](=O)[O-])c2)nn1	ZINC000853897668	ED	On-Demand	Bother	CACNA1D	71	38
Cc1cc(N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)ncn1	ZINC000853897679	CG	On-Demand	Reactive	PDE3B	42	34
Cc1cc(N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)ncn1	ZINC000853897680	CG	On-Demand	Reactive	PDE3B	42	34
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCN1Cc1ccccc1	ZINC000853897698	FD	On-Demand	Anodyne	PREP	53	35
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCN1Cc1ccccc1	ZINC000853897699	FD	On-Demand	Anodyne	PREP	53	35
C[Si](C)(C)c1ccc(CNC(=O)N[C@@H]2CC[C@@H](O)CC2)cc1	ZINC000853897726	DE	On-Demand	Anodyne	EPHX2	23	42
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897781	EE	On-Demand	Anodyne	FKBP1A	36	40
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897781	EE	On-Demand	Anodyne	SLC6A1	108	40
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897781	EE	On-Demand	Anodyne	PREP	42	42
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897781	EE	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897781	EE	On-Demand	Anodyne	L3MBTL3	55	36
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897782	EE	On-Demand	Anodyne	FKBP1A	36	40
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897782	EE	On-Demand	Anodyne	SLC6A1	108	40
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897782	EE	On-Demand	Anodyne	PREP	42	42
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897782	EE	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853897782	EE	On-Demand	Anodyne	L3MBTL3	55	36
Cn1cnc2c(N3CC[C@@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853897830	EF	On-Demand	Reactive	PDE3B	42	34
Cn1cnc2c(N3CC[C@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853897831	EF	On-Demand	Reactive	PDE3B	42	34
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CC[C@@H](O)CC1	ZINC000853897832	EF	On-Demand	Reactive	LCK	20	49
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CC[C@@H](O)CC1	ZINC000853897832	EF	On-Demand	Reactive	CSNK1D	29	40
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CC[C@@H](O)CC1	ZINC000853897832	EF	On-Demand	Reactive	ITK	20	49
CCc1ncnc(N2CC[C@@H](O[Si](C)(C)C(C)(C)C)C2)c1F	ZINC000853897895	EH	On-Demand	Reactive	PDE3B	43	35
CCc1ncnc(N2CC[C@H](O[Si](C)(C)C(C)(C)C)C2)c1F	ZINC000853897896	EH	On-Demand	Reactive	PDE3B	43	35
COC(=O)c1cncnc1N1CC[C@@H](O[Si](C)(C)C(C)(C)C)C1	ZINC000853897981	EF	On-Demand	Reactive	PDE3B	41	33
COC(=O)c1cncnc1N1CC[C@H](O[Si](C)(C)C(C)(C)C)C1	ZINC000853897982	EF	On-Demand	Reactive	PDE3B	41	33
O=C(OCCOC(F)F)[C@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000853897990	DH	On-Demand	Anodyne	SLC6A3	23	43
O=C(OCCOC(F)F)[C@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000853897991	DH	On-Demand	Anodyne	SLC6A3	23	43
O=C(OCCOC(F)F)[C@@H]1C[C@@H]1c1ccc2ccccc2c1	ZINC000853897992	DH	On-Demand	Anodyne	SLC6A3	23	43
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000853897993	DH	On-Demand	Anodyne	SLC6A3	23	43
Cn1nnc2c(N3CC[C@@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853898010	EE	On-Demand	Reactive	PDE3B	44	36
Cn1nnc2c(N3CC[C@H](O[Si](C)(C)C(C)(C)C)C3)ncnc21	ZINC000853898011	EE	On-Demand	Reactive	PDE3B	44	36
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853898022	GD	On-Demand	Anodyne	SLC6A1	42	34
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC000853898023	GD	On-Demand	Anodyne	SLC6A1	42	34
Cc1c(C(=O)OCCOC(F)F)nnn1-c1ccc(OC(F)F)cc1	ZINC000853898024	FF	On-Demand	Anodyne	SLC5A1	21	43
CC(C)c1cccc(COC(=O)Cc2ccc(OCC#N)cc2)c1	ZINC000853898039	DH	On-Demand	Mild	MAOB	18	42
CC(C)c1cccc(COC(=O)Cc2ccc(OCC#N)cc2)c1	ZINC000853898039	DH	On-Demand	Mild	FFAR1	36	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)N[C@@H]2CC[C@@H](O)CC2)C1	ZINC000853898050	ED	On-Demand	Anodyne	EPHX2	17	48
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)N[C@@H]2CC[C@@H](O)CC2)C1	ZINC000853898051	ED	On-Demand	Anodyne	EPHX2	17	48
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853898057	GE	On-Demand	Bother	FURIN	45	33
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853898057	GE	On-Demand	Bother	CAPN2	62	37
O=C(CNC(=O)c1c(F)cccc1Cl)OCCOC(F)F	ZINC000853898058	ED	On-Demand	Anodyne	PPIA	23	40
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898087	DF	On-Demand	Anodyne	FKBP1A	53	42
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898087	DF	On-Demand	Anodyne	DRD4	24	40
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898087	DF	On-Demand	Anodyne	SLC6A1	171	45
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898087	DF	On-Demand	Anodyne	SLC6A3	35	40
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898087	DF	On-Demand	Anodyne	SIGMAR1	48	45
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898087	DF	On-Demand	Anodyne	S1PR5	23	40
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898088	DF	On-Demand	Anodyne	FKBP1A	53	42
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898088	DF	On-Demand	Anodyne	DRD4	24	40
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898088	DF	On-Demand	Anodyne	SLC6A1	171	45
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898088	DF	On-Demand	Anodyne	SLC6A3	35	40
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898088	DF	On-Demand	Anodyne	SIGMAR1	48	45
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898088	DF	On-Demand	Anodyne	S1PR5	23	40
O=C(CNc1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853898111	DF	On-Demand	Anodyne	PDS	41	41
O=C(C[C@@H]1CCc2ccccc2C1)OCCOC(F)F	ZINC000853898158	CF	On-Demand	Anodyne	PREP	27	42
O=C(C[C@H]1CCc2ccccc2C1)OCCOC(F)F	ZINC000853898159	CF	On-Demand	Anodyne	PREP	27	42
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCCOC(F)F	ZINC000853898163	FF	On-Demand	Anodyne	ACE	27	56
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCCOC(F)F	ZINC000853898163	FF	On-Demand	Anodyne	OPRM1	23	45
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCCOC(F)F	ZINC000853898163	FF	On-Demand	Anodyne	OPRD1	75	41
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCCOC(F)F	ZINC000853898163	FF	On-Demand	Anodyne	CFTR	56	37
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@H]1C(=O)OCCOC(F)F	ZINC000853898163	FF	On-Demand	Anodyne	ADAM9	60	34
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853898164	FF	On-Demand	Anodyne	ACE	27	56
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853898164	FF	On-Demand	Anodyne	OPRM1	23	45
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853898164	FF	On-Demand	Anodyne	OPRD1	75	41
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853898164	FF	On-Demand	Anodyne	CFTR	56	37
CC[C@@H](C)C(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853898164	FF	On-Demand	Anodyne	ADAM9	60	34
CC[C@H](Nc1ccccc1)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898197	GG	On-Demand	Anodyne	SIGMAR1	18	43
CC[C@H](Nc1ccccc1)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898197	GG	On-Demand	Anodyne	MMP1	36	42
CC[C@@H](Nc1ccccc1)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898198	GG	On-Demand	Anodyne	SIGMAR1	18	43
CC[C@@H](Nc1ccccc1)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898198	GG	On-Demand	Anodyne	MMP1	36	42
CC[C@H](Nc1ccccc1)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898199	GG	On-Demand	Anodyne	SIGMAR1	18	43
CC[C@H](Nc1ccccc1)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898199	GG	On-Demand	Anodyne	MMP1	36	42
CC[C@@H](Nc1ccccc1)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898200	GG	On-Demand	Anodyne	SIGMAR1	18	43
CC[C@@H](Nc1ccccc1)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853898200	GG	On-Demand	Anodyne	MMP1	36	42
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	ACE	33	41
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	MME	105	41
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	ANPEP	87	37
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CTSB	43	39
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	PAPA1_CARPA	54	39
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CYSP_TRYCR	44	38
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CPA1	54	41
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CTRB1	24	40
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CAPNS1	65	34
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	HLA-DRB1	45	33
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CAPN1	78	40
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CAPN2	92	36
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	ACE2	65	41
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	LAP3	55	37
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	FPR1	46	37
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	CTRB_BOVIN	45	32
C[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853898230	CF	On-Demand	Anodyne	NPR	54	36
C[C@H](CC(=O)OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853898270	EH	On-Demand	Anodyne	PDS	40	38
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853898279	EG	On-Demand	Anodyne	PAPA1_CARPA	36	40
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853898279	EG	On-Demand	Anodyne	CTSK	23	49
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853898279	EG	On-Demand	Anodyne	FPR1	44	38
C#CCOCCOC(=O)C[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853898350	DD	On-Demand	Mild	DRD4	25	52
C#CCOCCOC(=O)C[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853898350	DD	On-Demand	Mild	SIGMAR1	26	40
C#CCOCCOC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853898352	DD	On-Demand	Mild	DRD4	25	52
C#CCOCCOC(=O)C[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853898352	DD	On-Demand	Mild	SIGMAR1	26	40
C#CCN1CCC(C(=O)OCc2cccc(C(C)C)c2)CC1	ZINC000853898361	CG	On-Demand	Mild	TRY2_BOVIN	26	40
COc1ccc(-c2csc3ncnc(N4CC[C@H](O)C4(C)C)c23)cc1	ZINC000853898403	FH	On-Demand	Anodyne	ADRB3	15	50
COc1ccc(-c2csc3ncnc(N4CC[C@@H](O)C4(C)C)c23)cc1	ZINC000853898405	FH	On-Demand	Anodyne	ADRB3	15	50
O=C(OCCOC(F)F)c1csc(Nc2ccccn2)n1	ZINC000853898462	DF	On-Demand	Anodyne	KCNN1	26	44
O=C(CNC(=O)c1ccccn1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853898465	CD	On-Demand	Anodyne	GRM4	52	38
O=C(CNC(=O)c1ccccn1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853898466	CD	On-Demand	Anodyne	GRM4	52	38
O=C(CNC(=O)c1ccccn1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853898467	CD	On-Demand	Anodyne	GRM4	52	38
Cc1c(C(=O)OCCOC(F)F)nnn1-c1cccc([N+](=O)[O-])c1	ZINC000853898495	ED	On-Demand	Bother	CACNA1C	66	43
Cc1c(C(=O)OCCOC(F)F)nnn1-c1cccc([N+](=O)[O-])c1	ZINC000853898495	ED	On-Demand	Bother	CACNA1D	99	43
Cc1c(C(=O)OCCOC(F)F)nnn1-c1cccc([N+](=O)[O-])c1	ZINC000853898495	ED	On-Demand	Bother	SLC5A1	21	58
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853898496	EF	On-Demand	Anodyne	DRD4	28	52
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853898496	EF	On-Demand	Anodyne	SIGMAR1	36	40
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853898498	EF	On-Demand	Anodyne	DRD4	28	52
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853898498	EF	On-Demand	Anodyne	SIGMAR1	36	40
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853898500	EF	On-Demand	Anodyne	DRD4	28	52
O=C(C[C@@H]1CN(Cc2ccccc2)CCO1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853898500	EF	On-Demand	Anodyne	SIGMAR1	36	40
O=C(C[C@H]1CN(Cc2ccccc2)CCO1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853898501	EF	On-Demand	Anodyne	DRD4	28	52
O=C(C[C@H]1CN(Cc2ccccc2)CCO1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853898501	EF	On-Demand	Anodyne	SIGMAR1	36	40
CC(C)c1ccc2ncnc(N3CC[C@H](O)C3(C)C)c2c1	ZINC000853898571	CG	On-Demand	Anodyne	PDE3A	40	40
CC(C)c1ccc2ncnc(N3CC[C@H](O)C3(C)C)c2c1	ZINC000853898571	CG	On-Demand	Anodyne	PDE3B	43	40
CC(C)c1ccc2ncnc(N3CC[C@@H](O)C3(C)C)c2c1	ZINC000853898573	CG	On-Demand	Anodyne	PDE3A	40	40
CC(C)c1ccc2ncnc(N3CC[C@@H](O)C3(C)C)c2c1	ZINC000853898573	CG	On-Demand	Anodyne	PDE3B	43	40
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853898592	GD	On-Demand	Anodyne	P2RY12	74	35
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853898592	GD	On-Demand	Anodyne	FURIN	44	37
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853898592	GD	On-Demand	Anodyne	CAPN1	20	40
CCC[C@H](NC(=O)Cc1ccccc1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853898592	GD	On-Demand	Anodyne	CAPN2	27	40
C#CCN1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853898605	FD	On-Demand	Mild	SIGMAR1	15	43
C#CCN1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853898605	FD	On-Demand	Mild	MMP13	16	42
C#CCN1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853898608	FD	On-Demand	Mild	SIGMAR1	15	43
C#CCN1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853898608	FD	On-Demand	Mild	MMP13	16	42
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898612	GD	On-Demand	Bother	FKBP1A	46	63
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898612	GD	On-Demand	Bother	CASP3	30	42
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898612	GD	On-Demand	Bother	CACNA1D	44	32
O=C(OCCOC(F)F)[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898612	GD	On-Demand	Bother	CASP7	43	42
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898614	GD	On-Demand	Bother	FKBP1A	46	63
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898614	GD	On-Demand	Bother	CASP3	30	42
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898614	GD	On-Demand	Bother	CACNA1D	44	32
O=C(OCCOC(F)F)[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000853898614	GD	On-Demand	Bother	CASP7	43	42
O=C(OCCOC(F)F)c1ccccc1OC1CCC1	ZINC000853898625	CG	On-Demand	Anodyne	AMY2	44	31
CN(C)C(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853898629	DE	On-Demand	Anodyne	KCNK3	71	35
CN(C)C(=O)Nc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853898629	DE	On-Demand	Anodyne	KCNK9	46	33
COc1c(C)ncnc1NCc1ncccn1	ZINC000853898635	BD	On-Demand	Anodyne	CLK4	43	39
CCN(CC(=O)OCCOC(F)F)c1ccccc1	ZINC000853898647	CE	On-Demand	Anodyne	AMY2	57	34
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000853898724	ED	On-Demand	Bother	FKBP1A	53	39
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000853898724	ED	On-Demand	Bother	LGMN	40	31
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000853898725	ED	On-Demand	Bother	FKBP1A	53	39
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])o1	ZINC000853898725	ED	On-Demand	Bother	LGMN	40	31
C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)CN1c1cc(Cl)nc(N)n1	ZINC000853898737	EF	On-Demand	Anodyne	PDPK1	24	49
C[C@H]1CC[C@H](C(=O)OC(C)(C)C)CN1c1cc(Cl)nc(N)n1	ZINC000853898738	EF	On-Demand	Anodyne	PDPK1	24	49
C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)CN1c1cc(Cl)nc(N)n1	ZINC000853898739	EF	On-Demand	Anodyne	PDPK1	24	49
O=C(OCCOC(F)F)c1ccc(N2CCCS2(=O)=O)cc1Cl	ZINC000853898770	FE	On-Demand	Anodyne	CDK1	16	40
CCc1ccc([C@H](C)CC(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853898790	EH	On-Demand	Bother	GSTM2	21	40
CN1C(=O)CC[C@H](C(=O)OCCOC(F)F)[C@H]1c1ccccc1	ZINC000853898791	EE	On-Demand	Anodyne	SLC6A3	17	40
CN1C(=O)CC[C@H](C(=O)OCCOC(F)F)[C@@H]1c1ccccc1	ZINC000853898793	EE	On-Demand	Anodyne	SLC6A3	17	40
CN1C(=O)CC[C@@H](C(=O)OCCOC(F)F)[C@@H]1c1ccccc1	ZINC000853898794	EE	On-Demand	Anodyne	SLC6A3	17	40
CN1C(=O)CC[C@@H](C(=O)OCCOC(F)F)[C@H]1c1ccccc1	ZINC000853898796	EE	On-Demand	Anodyne	SLC6A3	17	40
O=C(OCCOC(F)F)c1cn(-c2cccc(C(F)(F)F)c2)nn1	ZINC000853898797	FF	On-Demand	Anodyne	ESRRA	22	44
Cc1ccc(S(=O)(=O)N2CCN(CC(=O)OCCOC(F)F)CC2)cc1	ZINC000853898815	GD	On-Demand	Anodyne	F13A1	44	38
C#CCOCCOC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898835	DE	On-Demand	Mild	FKBP1A	47	42
C#CCOCCOC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898835	DE	On-Demand	Mild	SLC6A1	165	46
C#CCOCCOC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898835	DE	On-Demand	Mild	SIGMAR1	42	42
C#CCOCCOC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898835	DE	On-Demand	Mild	PREP	47	34
C#CCOCCOC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000853898835	DE	On-Demand	Mild	MBTPS1	22	40
C#CCOCCOC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898837	DE	On-Demand	Mild	FKBP1A	47	42
C#CCOCCOC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898837	DE	On-Demand	Mild	SLC6A1	165	46
C#CCOCCOC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898837	DE	On-Demand	Mild	SIGMAR1	42	42
C#CCOCCOC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898837	DE	On-Demand	Mild	PREP	47	34
C#CCOCCOC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000853898837	DE	On-Demand	Mild	MBTPS1	22	40
C#CCOCCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853898845	EE	On-Demand	Mild	PAPA1_CARPA	40	41
C#CCOCCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853898845	EE	On-Demand	Mild	CTSK	15	47
C#CCOCCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853898845	EE	On-Demand	Mild	FPR1	43	38
CC(C)(C)C(=O)Nc1ccccc1C(=O)OCCOC(F)F	ZINC000853898852	DG	On-Demand	Anodyne	PRTN3	27	40
O=C(C[C@H]1CCc2ccccc2C1)OCc1nnc2n1CCOCC2	ZINC000853898877	EE	On-Demand	Anodyne	PREP	26	40
O=C(C[C@@H]1CCc2ccccc2C1)OCc1nnc2n1CCOCC2	ZINC000853898879	EE	On-Demand	Anodyne	PREP	26	40
CCc1ccc(N)c(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853898937	FF	On-Demand	Anodyne	PROKR1	54	35
CCc1ccc(N)c(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853898938	FF	On-Demand	Anodyne	PROKR1	54	35
C#CCOCCOC(=O)[C@@](C)(O)c1ccccc1C(F)(F)F	ZINC000853898964	DE	On-Demand	Mild	AMY2	54	35
C#CCOCCOC(=O)[C@](C)(O)c1ccccc1C(F)(F)F	ZINC000853898965	DE	On-Demand	Mild	AMY2	54	35
CCC1(CNC(=O)NCCN(C)OC)CCN(Cc2ccccc2)CC1	ZINC000853899001	FE	On-Demand	Anodyne	ACHE	24	40
CCC1(CNC(=O)NCCN(C)OC)CCN(Cc2ccccc2)CC1	ZINC000853899001	FE	On-Demand	Anodyne	HRH2	25	40
CCC1(CNC(=O)NCCN(C)OC)CCN(Cc2ccccc2)CC1	ZINC000853899001	FE	On-Demand	Anodyne	SIGMAR1	54	38
CCC1(CNC(=O)NCCN(C)OC)CCN(Cc2ccccc2)CC1	ZINC000853899001	FE	On-Demand	Anodyne	NPFFR2	41	48
CCC1(CNC(=O)NCCN(C)OC)CCN(Cc2ccccc2)CC1	ZINC000853899001	FE	On-Demand	Anodyne	NPFFR1	55	48
NS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853899047	FE	On-Demand	Anodyne	CA2	26	42
NS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853899047	FE	On-Demand	Anodyne	CA1	20	42
NS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853899047	FE	On-Demand	Anodyne	CA7	16	42
NS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853899047	FE	On-Demand	Anodyne	CA4	24	42
NS(=O)(=O)c1cc(Cl)c(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853899047	FE	On-Demand	Anodyne	A6YCJ1_9METZ	15	42
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](O)C3(C)C)c([N+](=O)[O-])c2)cc1	ZINC000853899109	FH	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3CC[C@@H](O)C3(C)C)c([N+](=O)[O-])c2)cc1	ZINC000853899109	FH	On-Demand	Bother	TAAR1	39	49
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](O)C3(C)C)c([N+](=O)[O-])c2)cc1	ZINC000853899112	FH	On-Demand	Bother	PRNP	43	33
Cc1ccc(NC(=O)c2ccc(N3CC[C@H](O)C3(C)C)c([N+](=O)[O-])c2)cc1	ZINC000853899112	FH	On-Demand	Bother	TAAR1	39	49
C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)OCCOC(F)F	ZINC000853899113	EH	On-Demand	Anodyne	PPARA	17	42
C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)OCCOC(F)F	ZINC000853899113	EH	On-Demand	Anodyne	PPARD	27	40
C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)OCCOC(F)F	ZINC000853899113	EH	On-Demand	Anodyne	ACE2	15	41
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899191	FE	On-Demand	Anodyne	FKBP1A	42	38
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899191	FE	On-Demand	Anodyne	SLC6A1	53	34
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899191	FE	On-Demand	Anodyne	CPT1A	122	43
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899191	FE	On-Demand	Anodyne	CPT2	49	39
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899193	FE	On-Demand	Anodyne	FKBP1A	42	38
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899193	FE	On-Demand	Anodyne	SLC6A1	53	34
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899193	FE	On-Demand	Anodyne	CPT1A	122	43
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)COc2ccccc2)C1	ZINC000853899193	FE	On-Demand	Anodyne	CPT2	49	39
CC(C)(C(=O)OCCOC(F)F)c1cccc(Cl)c1	ZINC000853899199	CG	On-Demand	Anodyne	AMY2	58	33
CC(C)(C(=O)OCCOC(F)F)c1cccc(Cl)c1	ZINC000853899199	CG	On-Demand	Anodyne	PDS	47	35
C#CCOCCOC(=O)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853899209	DD	On-Demand	Mild	DRD4	23	45
C#CCOCCOC(=O)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853899211	DD	On-Demand	Mild	DRD4	23	45
C#CCOCCOC(=O)[C@@H](O)CCc1ccccc1	ZINC000853899226	CD	On-Demand	Mild	ANPEP	43	39
C#CCOCCOC(=O)[C@@H](O)CCc1ccccc1	ZINC000853899226	CD	On-Demand	Mild	LAP3	46	39
CCN(CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853899227	GF	On-Demand	Anodyne	SIGMAR1	18	42
CCN(CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853899227	GF	On-Demand	Anodyne	MMP1	15	42
C#CCOCCOC(=O)[C@H](O)CCc1ccccc1	ZINC000853899228	CD	On-Demand	Mild	ANPEP	43	39
C#CCOCCOC(=O)[C@H](O)CCc1ccccc1	ZINC000853899228	CD	On-Demand	Mild	LAP3	46	39
CCN(CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853899230	GF	On-Demand	Anodyne	SIGMAR1	18	42
CCN(CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccccc1	ZINC000853899230	GF	On-Demand	Anodyne	MMP1	15	42
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	ZINC000853899282	FE	On-Demand	Bother	FKBP1A	42	39
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])s1	ZINC000853899283	FE	On-Demand	Bother	FKBP1A	42	39
C#CCOCCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853899298	EE	On-Demand	Mild	PAPA1_CARPA	40	41
C#CCOCCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853899298	EE	On-Demand	Mild	CTSK	15	47
C#CCOCCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853899298	EE	On-Demand	Mild	FPR1	43	38
O=C(OCCOC(F)F)c1cnn2ccccc12	ZINC000853899327	CD	On-Demand	Anodyne	EPHB3	33	43
CCCNC(=O)c1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853899378	FD	On-Demand	Anodyne	DRD4	44	35
O=C(OCCOC(F)F)c1ccc([N+](=O)[O-])cc1Br	ZINC000853899379	EF	On-Demand	Bother	CACNA1D	45	35
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853899381	DE	On-Demand	Anodyne	DRD4	30	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853899383	DE	On-Demand	Anodyne	DRD4	30	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853899385	DE	On-Demand	Anodyne	DRD4	30	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853899387	DE	On-Demand	Anodyne	DRD4	30	44
C#CCOCCOC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899465	DE	On-Demand	Mild	SLC6A1	134	45
C#CCOCCOC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899467	DE	On-Demand	Mild	SLC6A1	134	45
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](O)CCc1ccccc1	ZINC000853899477	CF	On-Demand	Anodyne	ANPEP	42	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](O)CCc1ccccc1	ZINC000853899477	CF	On-Demand	Anodyne	LAP3	45	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](O)CCc1ccccc1	ZINC000853899478	CF	On-Demand	Anodyne	ANPEP	42	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](O)CCc1ccccc1	ZINC000853899478	CF	On-Demand	Anodyne	LAP3	45	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](O)CCc1ccccc1	ZINC000853899480	CF	On-Demand	Anodyne	ANPEP	42	38
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](O)CCc1ccccc1	ZINC000853899480	CF	On-Demand	Anodyne	LAP3	45	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](O)CCc1ccccc1	ZINC000853899481	CF	On-Demand	Anodyne	ANPEP	42	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](O)CCc1ccccc1	ZINC000853899481	CF	On-Demand	Anodyne	LAP3	45	38
CC(C)c1cccc(COC(=O)C2(C#N)CCC2)c1	ZINC000853899485	CH	On-Demand	Mild	SLC12A5	68	40
O=C(OCc1nnc2n1CCOCC2)[C@@H]1CCCCN1Cc1ccccc1	ZINC000853899487	FD	On-Demand	Anodyne	FKBP1A	45	40
O=C(OCc1nnc2n1CCOCC2)[C@H]1CCCCN1Cc1ccccc1	ZINC000853899489	FD	On-Demand	Anodyne	FKBP1A	45	40
COCC(=O)N[C@H](C(=O)OCc1cccc(C(C)C)c1)C(C)C	ZINC000853899491	DF	On-Demand	Anodyne	PAPA1_CARPA	40	41
Cc1cc(N2CC[C@@H](O)C2(C)C)nc(-c2cccnc2)n1	ZINC000853899500	CE	On-Demand	Anodyne	ROS1	44	39
Cc1cc(N2CC[C@H](O)C2(C)C)nc(-c2cccnc2)n1	ZINC000853899502	CE	On-Demand	Anodyne	ROS1	44	39
Cc1oc(-c2ccccc2F)nc1C(=O)OCCOC(F)F	ZINC000853899519	DG	On-Demand	Anodyne	PPARG	18	42
Cc1oc(-c2ccccc2F)nc1C(=O)OCCOC(F)F	ZINC000853899519	DG	On-Demand	Anodyne	PPARA	18	42
C[C@]1(C(=O)OCc2nnc3n2CCOCC3)CCCN1C(=O)c1ccccc1	ZINC000853899603	GD	On-Demand	Anodyne	SLC12A5	71	38
O=C(CCNC(=O)N1CCc2ccccc2C1)OCCOC(F)F	ZINC000853899614	ED	On-Demand	Anodyne	DPP8	21	42
C#CCCN(CCOC)C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1	ZINC000853899625	GG	On-Demand	Mild	NPFFR2	31	43
C#CCCN(CCOC)C(=O)NCC1(CC)CCN(Cc2ccccc2)CC1	ZINC000853899625	GG	On-Demand	Mild	NPFFR1	44	43
O=C(C[C@H]1CCc2ccccc21)OCCOC(F)F	ZINC000853899631	CF	On-Demand	Anodyne	PPARD	41	38
O=C(C[C@@H]1CCc2ccccc21)OCCOC(F)F	ZINC000853899632	CF	On-Demand	Anodyne	PPARD	41	38
C[C@]1(C(=O)OCCOC(F)F)CCCN1C(=O)c1ccccc1	ZINC000853899640	EE	On-Demand	Anodyne	SLC12A5	71	38
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	CHRM2	22	42
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	CHRM1	15	42
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	DRD2	23	45
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	FKBP1A	43	39
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	DRD4	52	45
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	ACHE	50	43
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	SLC6A4	16	45
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	SLC6A3	48	45
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	CHRM5	19	42
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	CHRM3	23	42
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	LTA4H	27	41
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	HRH3	19	45
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	SIGMAR1	79	50
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	PDE6D	48	42
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	SLC18A3	23	40
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	MCHR1	18	40
O=C(OCCOC(F)F)C1CCN(Cc2ccccc2)CC1	ZINC000853899713	DF	On-Demand	Anodyne	CACNA1G	44	44
O=C(CNC(=O)c1ccccn1)OCCOC(F)F	ZINC000853899735	CC	On-Demand	Anodyne	GRM4	51	45
C#CCOCCOC(=O)CNC(=O)c1ccccn1	ZINC000853899771	CC	On-Demand	Mild	GRM4	41	35
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)OCCOC(F)F	ZINC000853899785	EH	On-Demand	Anodyne	TACR1	17	40
C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)OCCOC(F)F	ZINC000853899785	EH	On-Demand	Anodyne	PDS	44	41
CCC[C@@H](O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853899838	ED	On-Demand	Anodyne	MMP1	31	49
CCC[C@@H](O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853899841	ED	On-Demand	Anodyne	MMP1	31	49
O=C(OCc1nnc2n1CCOCC2)c1csc(Nc2ccccn2)n1	ZINC000853899916	FD	On-Demand	Anodyne	TRPC6	47	33
O=C(OCc1nnc2n1CCOCC2)c1csc(Nc2ccccn2)n1	ZINC000853899916	FD	On-Demand	Anodyne	TRPC3	46	33
CCCN(CCNC(=O)N[C@@H](c1ccccc1)[C@H](C)O)C(=O)OC(C)(C)C	ZINC000853899917	GG	On-Demand	Anodyne	FPR1	41	35
CCCN(CCNC(=O)N[C@@H](c1ccccc1)[C@@H](C)O)C(=O)OC(C)(C)C	ZINC000853899918	GG	On-Demand	Anodyne	FPR1	41	35
CCCN(CCNC(=O)N[C@H](c1ccccc1)[C@H](C)O)C(=O)OC(C)(C)C	ZINC000853899919	GG	On-Demand	Anodyne	FPR1	41	35
CCCN(CCNC(=O)N[C@H](c1ccccc1)[C@@H](C)O)C(=O)OC(C)(C)C	ZINC000853899920	GG	On-Demand	Anodyne	FPR1	41	35
CC(C)c1cccc(COC(=O)CNC(=O)c2ccccn2)c1	ZINC000853899929	DF	On-Demand	Anodyne	GRM4	54	38
CC(C)c1cccc(COC(=O)CNC(=O)c2ccccn2)c1	ZINC000853899929	DF	On-Demand	Anodyne	PLM1_PLAFA	54	37
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccccc1	ZINC000853899957	DF	On-Demand	Anodyne	FKBP1A	93	48
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccccc1	ZINC000853899957	DF	On-Demand	Anodyne	SLC6A3	30	52
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccccc1	ZINC000853899957	DF	On-Demand	Anodyne	SIGMAR1	25	44
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccccc1	ZINC000853899957	DF	On-Demand	Anodyne	PREP	64	38
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccccc1	ZINC000853899957	DF	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccccc1	ZINC000853899958	DF	On-Demand	Anodyne	FKBP1A	93	48
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccccc1	ZINC000853899958	DF	On-Demand	Anodyne	SLC6A3	30	52
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccccc1	ZINC000853899958	DF	On-Demand	Anodyne	SIGMAR1	25	44
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccccc1	ZINC000853899958	DF	On-Demand	Anodyne	PREP	64	38
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccccc1	ZINC000853899958	DF	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899993	EF	On-Demand	Anodyne	SLC6A1	135	47
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899993	EF	On-Demand	Anodyne	SLC6A3	15	42
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899993	EF	On-Demand	Anodyne	MLNR	24	40
O=C(OCCOC(F)F)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899993	EF	On-Demand	Anodyne	CACNA1G	23	40
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899994	EF	On-Demand	Anodyne	SLC6A1	135	47
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899994	EF	On-Demand	Anodyne	SLC6A3	15	42
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899994	EF	On-Demand	Anodyne	MLNR	24	40
O=C(OCCOC(F)F)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000853899994	EF	On-Demand	Anodyne	CACNA1G	23	40
Cc1ccc(N2CCCC2)c(C(=O)OCCOC(F)F)c1	ZINC000853900028	CF	On-Demand	Anodyne	KCNQ2	40	36
Cc1c(C(=O)OCCOC(F)F)cc(S(N)(=O)=O)cc1[N+](=O)[O-]	ZINC000853900043	FC	On-Demand	Bother	CA2	20	40
O=S(=O)(c1ccc(NCc2ncccn2)nc1)N1CCCC1	ZINC000853900145	DD	On-Demand	Anodyne	NAMPT	45	46
CC[C@@H](C)[C@H](NC(=O)N1CCCC1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853900204	DF	On-Demand	Anodyne	CACNA1H	23	40
CCN1CCCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853900216	CD	On-Demand	Anodyne	FKBP1A	46	38
CCN1CCCC[C@H]1C(=O)OCCOC(F)F	ZINC000853900218	CD	On-Demand	Anodyne	FKBP1A	46	38
O=C(OCCOC(F)F)c1cc(-n2cccn2)ccn1	ZINC000853900243	CD	On-Demand	Anodyne	AMP1_PLAFQ	49	36
COc1ccc(Cl)cc1NCCC(=O)OCCOC(F)F	ZINC000853900244	DF	On-Demand	Anodyne	CPT1A	43	30
C#CCOCCOC(=O)COc1ccc(O)cc1	ZINC000853900385	CC	On-Demand	Mild	PLA2G4B	67	34
O=C(OCCOC(F)F)c1ccccc1N1CCCCC1	ZINC000853900400	CG	On-Demand	Anodyne	KCNQ2	75	39
CCCNC(=O)c1cccc(C(=O)OCCOC(F)F)c1	ZINC000853900516	DE	On-Demand	Anodyne	DRD4	41	31
C#CCOCCOC(=O)[C@@](C)(O)c1cccc(C(F)(F)F)c1	ZINC000853900518	DE	On-Demand	Mild	AMY2	54	35
C#CCOCCOC(=O)[C@](C)(O)c1cccc(C(F)(F)F)c1	ZINC000853900519	DE	On-Demand	Mild	AMY2	54	35
C[C@@](O)(C(=O)OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853900529	EF	On-Demand	Anodyne	AMY2	58	33
C[C@@](O)(C(=O)OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853900529	EF	On-Demand	Anodyne	PDS	41	37
CN(C)C(=O)Nc1cccc(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853900542	FD	On-Demand	Anodyne	CASR	31	47
O=C(OCCOC(F)F)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853900552	DD	On-Demand	Anodyne	DRD4	26	46
O=C(OCCOC(F)F)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000853900552	DD	On-Demand	Anodyne	SIGMAR1	35	40
O=C(OCCOC(F)F)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853900553	DD	On-Demand	Anodyne	DRD4	26	46
O=C(OCCOC(F)F)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000853900553	DD	On-Demand	Anodyne	SIGMAR1	35	40
CC(C)(C(=O)OCCOC(F)F)c1cccc(F)c1	ZINC000853900568	CF	On-Demand	Anodyne	AMY2	59	34
CCN1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900596	FE	On-Demand	Anodyne	FKBP1A	40	43
CCN1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900596	FE	On-Demand	Anodyne	AVPR1B	40	34
CCN1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900596	FE	On-Demand	Anodyne	MMP13	30	41
CCN1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900596	FE	On-Demand	Anodyne	MMP3	26	41
CCN1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900596	FE	On-Demand	Anodyne	MMP7	29	41
CCN1CCCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900596	FE	On-Demand	Anodyne	MMP1	31	41
CCN1CCCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900597	FE	On-Demand	Anodyne	FKBP1A	40	43
CCN1CCCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900597	FE	On-Demand	Anodyne	AVPR1B	40	34
CCN1CCCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900597	FE	On-Demand	Anodyne	MMP13	30	41
CCN1CCCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900597	FE	On-Demand	Anodyne	MMP3	26	41
CCN1CCCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900597	FE	On-Demand	Anodyne	MMP7	29	41
CCN1CCCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900597	FE	On-Demand	Anodyne	MMP1	31	41
CCN1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900598	FE	On-Demand	Anodyne	FKBP1A	40	43
CCN1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900598	FE	On-Demand	Anodyne	AVPR1B	40	34
CCN1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900598	FE	On-Demand	Anodyne	MMP13	30	41
CCN1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900598	FE	On-Demand	Anodyne	MMP3	26	41
CCN1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900598	FE	On-Demand	Anodyne	MMP7	29	41
CCN1CCCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900598	FE	On-Demand	Anodyne	MMP1	31	41
CCN1CCCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900600	FE	On-Demand	Anodyne	FKBP1A	40	43
CCN1CCCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900600	FE	On-Demand	Anodyne	AVPR1B	40	34
CCN1CCCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900600	FE	On-Demand	Anodyne	MMP13	30	41
CCN1CCCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900600	FE	On-Demand	Anodyne	MMP3	26	41
CCN1CCCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900600	FE	On-Demand	Anodyne	MMP7	29	41
CCN1CCCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853900600	FE	On-Demand	Anodyne	MMP1	31	41
O=C(OCCOC(F)F)[C@H](O)CCc1ccccc1	ZINC000853900616	CD	On-Demand	Anodyne	ANPEP	53	41
O=C(OCCOC(F)F)[C@H](O)CCc1ccccc1	ZINC000853900616	CD	On-Demand	Anodyne	LAP3	57	41
O=C(OCCOC(F)F)[C@@H](O)CCc1ccccc1	ZINC000853900617	CD	On-Demand	Anodyne	ANPEP	53	41
O=C(OCCOC(F)F)[C@@H](O)CCc1ccccc1	ZINC000853900617	CD	On-Demand	Anodyne	LAP3	57	41
CN1CCCC[C@@H]1C(=O)OCCOC(F)F	ZINC000853900643	BD	On-Demand	Anodyne	FKBP1A	53	41
CN1CCCC[C@H]1C(=O)OCCOC(F)F	ZINC000853900645	BD	On-Demand	Anodyne	FKBP1A	53	41
O=C(CN1CCN(c2ccccn2)CC1)OCCOC(F)F	ZINC000853900691	DC	On-Demand	Anodyne	HTR1A	15	49
O=C(CN1CCN(c2ccccn2)CC1)OCCOC(F)F	ZINC000853900691	DC	On-Demand	Anodyne	DRD4	36	48
O=C(CN1CCN(c2ccccn2)CC1)OCCOC(F)F	ZINC000853900691	DC	On-Demand	Anodyne	SLC27A1	40	43
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000853900693	GH	On-Demand	Bother	FKBP1A	88	41
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000853900693	GH	On-Demand	Bother	PREP	41	37
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000853900693	GH	On-Demand	Bother	LGMN	66	42
CC(C)c1cccc(COC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000853900695	GH	On-Demand	Bother	FKBP1A	88	41
CC(C)c1cccc(COC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000853900695	GH	On-Demand	Bother	PREP	41	37
CC(C)c1cccc(COC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])o2)c1	ZINC000853900695	GH	On-Demand	Bother	LGMN	66	42
Cc1ccc(OCc2cccc(C(=O)OCCOC(F)F)c2)cn1	ZINC000853900725	EG	On-Demand	Anodyne	FFAR1	60	45
O=C(CNC(=O)N1CCc2ccccc2C1)OCCOC(F)F	ZINC000853900743	ED	On-Demand	Anodyne	DPP8	21	43
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H]3C2)cc1	ZINC000853900759	BE	On-Demand	Bother	CHRNA3	18	45
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@H]3C2)cc1	ZINC000853900760	BE	On-Demand	Bother	CHRNA3	18	45
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@@H]3C2)cc1	ZINC000853900761	BE	On-Demand	Bother	CHRNA3	18	45
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H]3C2)cc1	ZINC000853900762	BE	On-Demand	Bother	CHRNA3	18	45
C#CCOCCOC(=O)c1csc(Nc2ccc(OC)cc2)n1	ZINC000853900788	EF	On-Demand	Mild	TRPC6	50	48
C#CCOCCOC(=O)c1csc(Nc2ccc(OC)cc2)n1	ZINC000853900788	EF	On-Demand	Mild	TRPC3	47	48
O=C(Cc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853900796	CD	On-Demand	Bother	CACNA1C	57	40
O=C(Cc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853900796	CD	On-Demand	Bother	CACNA1D	94	39
O=C(Cc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853900796	CD	On-Demand	Bother	ACR	17	40
C[C@@](O)(Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853900805	CD	On-Demand	Anodyne	AMY2	64	38
c1cnc(CNc2ccnc(N3CCOCC3)n2)nc1	ZINC000853900818	CC	On-Demand	Anodyne	PIK3CA	32	47
C#CCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853900821	GF	On-Demand	Mild	MMP13	23	41
C#CCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853900821	GF	On-Demand	Mild	MMP1	21	41
C#CCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853900821	GF	On-Demand	Mild	PROKR1	47	31
C#CCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853900822	GF	On-Demand	Mild	MMP13	23	41
C#CCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853900822	GF	On-Demand	Mild	MMP1	21	41
C#CCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853900822	GF	On-Demand	Mild	PROKR1	47	31
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H]3C2)c(Cl)c1	ZINC000853900864	CG	On-Demand	Bother	WDR5	32	40
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@@H]3C2)c(Cl)c1	ZINC000853900865	CG	On-Demand	Bother	WDR5	32	40
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@H]3C2)c(Cl)c1	ZINC000853900866	CG	On-Demand	Bother	WDR5	32	40
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H]3C2)c(Cl)c1	ZINC000853900867	CG	On-Demand	Bother	WDR5	32	40
c1cnc(CNc2nccc(N3CCCC3)n2)nc1	ZINC000853900895	CD	On-Demand	Anodyne	SORD	75	48
O=C(NC1CCCC1)c1ccc(NCc2ncccn2)nn1	ZINC000853900929	CD	On-Demand	Anodyne	CNR1	17	40
O=C(NC1CCCC1)c1ccc(NCc2ncccn2)nn1	ZINC000853900929	CD	On-Demand	Anodyne	CNR2	25	40
c1cncc(-c2nc(N3CC[C@H]4C[C@@H]4C3)c3ccccc3n2)c1	ZINC000853900932	DH	On-Demand	Anodyne	MTOR	16	43
c1cncc(-c2nc(N3CC[C@@H]4C[C@H]4C3)c3ccccc3n2)c1	ZINC000853900933	DH	On-Demand	Anodyne	MTOR	16	43
c1cncc(-c2nc(N3CC[C@@H]4C[C@@H]4C3)c3ccccc3n2)c1	ZINC000853900934	DH	On-Demand	Anodyne	MTOR	16	43
c1cncc(-c2nc(N3CC[C@H]4C[C@H]4C3)c3ccccc3n2)c1	ZINC000853900935	DH	On-Demand	Anodyne	MTOR	16	43
O=C(NC1CC1)c1ccc(NCc2ncccn2)c([N+](=O)[O-])c1	ZINC000853900975	DD	On-Demand	Bother	TAAR1	19	43
c1cnc(CNc2nccc(N3CCOCC3)n2)nc1	ZINC000853900989	CC	On-Demand	Anodyne	PIK3CA	25	46
c1cnc(CNc2nccc(N3CCOCC3)n2)nc1	ZINC000853900989	CC	On-Demand	Anodyne	SORD	57	44
c1cnc(CNc2nccc(N3CCOCC3)n2)nc1	ZINC000853900989	CC	On-Demand	Anodyne	EPHB4	70	36
c1cnc(CNc2nccc(N3CCOCC3)n2)nc1	ZINC000853900989	CC	On-Demand	Anodyne	STAT6	51	35
c1cnc(CNc2nccc(N3CCOCC3)n2)nc1	ZINC000853900989	CC	On-Demand	Anodyne	SMG1	33	42
CN(CCCC(=O)OCCOC(F)F)C1=NS(=O)(=O)c2ccccc21	ZINC000853901026	GD	On-Demand	Anodyne	KCNA3	20	42
CN(C)CCCNS(=O)(=O)c1ccc(NCc2ncccn2)c([N+](=O)[O-])c1	ZINC000853901046	GD	On-Demand	Bother	BCL2L1	52	38
O=S(=O)(c1cccnc1NCc1ncccn1)N1CCCCC1	ZINC000853901053	ED	On-Demand	Anodyne	NAMPT	19	40
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H]3C2)c2nonc12	ZINC000853901063	CD	On-Demand	Bother	GSTM2	105	42
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@@H]3C2)c2nonc12	ZINC000853901063	CD	On-Demand	Bother	GSTP1	62	42
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@@H]3C2)c2nonc12	ZINC000853901064	CD	On-Demand	Bother	GSTM2	105	42
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@@H]3C2)c2nonc12	ZINC000853901064	CD	On-Demand	Bother	GSTP1	62	42
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H]3C2)c2nonc12	ZINC000853901065	CD	On-Demand	Bother	GSTM2	105	42
O=[N+]([O-])c1ccc(N2CC[C@@H]3C[C@H]3C2)c2nonc12	ZINC000853901065	CD	On-Demand	Bother	GSTP1	62	42
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@H]3C2)c2nonc12	ZINC000853901066	CD	On-Demand	Bother	GSTM2	105	42
O=[N+]([O-])c1ccc(N2CC[C@H]3C[C@H]3C2)c2nonc12	ZINC000853901066	CD	On-Demand	Bother	GSTP1	62	42
O=C(OCc1nnc2n1CCOCC2)C1(Cc2cccc(Cl)c2)CCCC1	ZINC000853901092	GG	On-Demand	Anodyne	SLC12A5	45	34
c1cnc(CNc2ncc(C3CC3)c(NCc3ncccn3)n2)nc1	ZINC000853901093	EE	On-Demand	Anodyne	TBK1	54	36
C[C@@H](CNC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2)S(C)(=O)=O	ZINC000853901098	GD	On-Demand	Anodyne	GPR119	23	41
c1cnc(CNc2nc3ccccc3nc2N2CCOCC2)nc1	ZINC000853901109	DD	On-Demand	Anodyne	METAP1	15	46
c1cnc(CNc2nc3ccccc3nc2N2CCOCC2)nc1	ZINC000853901109	DD	On-Demand	Anodyne	PIK3CA	36	47
c1cnc(CNc2nc3ccccc3nc2N2CCOCC2)nc1	ZINC000853901109	DD	On-Demand	Anodyne	PIK3CD	27	40
c1cnc(CNc2nc3ccccc3nc2N2CCOCC2)nc1	ZINC000853901109	DD	On-Demand	Anodyne	MTOR	24	40
c1cnc(CNc2nc3ccccc3nc2N2CCOCC2)nc1	ZINC000853901109	DD	On-Demand	Anodyne	PIK3CG	15	40
c1cnc(CNc2nc3ccccc3nc2N2CCOCC2)nc1	ZINC000853901109	DD	On-Demand	Anodyne	PDE10A	16	41
c1cnc(CNc2nc3ccccc3nc2N2CCOCC2)nc1	ZINC000853901109	DD	On-Demand	Anodyne	STAT6	56	37
O=S(=O)(NCC1CC1)c1ccc(NCc2ncccn2)nc1	ZINC000853901114	DD	On-Demand	Anodyne	NPY5R	23	42
CC(C)(C)NC(=O)Nc1ccc(Cl)c(C(=O)OCCOC(F)F)c1	ZINC000853901122	FH	On-Demand	Anodyne	IMDH_CRYPV	60	44
COCCCOc1cccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])c1	ZINC000853901147	FF	On-Demand	Bother	CACNA1D	58	38
CC(C)c1cccc(COC(=O)[C@@H]2CCC[C@@H]2O)c1	ZINC000853901148	CG	On-Demand	Anodyne	AMY2	42	29
CC(C)c1cccc(COC(=O)[C@H]2CCC[C@@H]2O)c1	ZINC000853901149	CG	On-Demand	Anodyne	AMY2	42	29
CC(C)c1cccc(COC(=O)[C@@H]2CCC[C@H]2O)c1	ZINC000853901150	CG	On-Demand	Anodyne	AMY2	42	29
CC(C)c1cccc(COC(=O)[C@H]2CCC[C@H]2O)c1	ZINC000853901151	CG	On-Demand	Anodyne	AMY2	42	29
c1cnc(CNc2cc(C3CC3)nc(NCc3ncccn3)n2)nc1	ZINC000853901160	EE	On-Demand	Anodyne	PKNB	23	40
O=C(OCCOC(F)F)C1CCN(C(=O)c2ccccc2)CC1	ZINC000853901169	EE	On-Demand	Anodyne	L3MBTL3	86	39
Cc1ncc(Cl)c(C(=O)OCc2cccc(C(C)C)c2)n1	ZINC000853901200	DH	On-Demand	Anodyne	FFAR1	32	40
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	FKBP1A	51	39
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	SLC6A3	21	41
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	GRIN2B	51	38
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	TRY2_BOVIN	66	43
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	PDE6D	47	37
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	PREP	37	41
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	PARP1	17	49
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	PTR1	48	35
CC(C)c1cccc(COC(=O)C2CCN(C(=O)c3ccccc3)CC2)c1	ZINC000853901207	FI	On-Demand	Anodyne	L3MBTL3	73	39
COc1ccc(Nc2nc(C(=O)OCCOC(F)F)cs2)cc1	ZINC000853901222	EG	On-Demand	Anodyne	TRPC6	60	49
COc1ccc(Nc2nc(C(=O)OCCOC(F)F)cs2)cc1	ZINC000853901222	EG	On-Demand	Anodyne	TRPC3	53	49
c1cnc(CNc2nc3ccccc3nc2N2CCCCC2)nc1	ZINC000853901228	DG	On-Demand	Anodyne	HNMT	61	36
O=S(=O)(c1ccc(NCc2ncccn2)nc1)N1CCCCC1	ZINC000853901237	ED	On-Demand	Anodyne	NAMPT	42	47
O=S(=O)(c1ccnc(NCc2ncccn2)c1)N1CCCC1	ZINC000853901266	DD	On-Demand	Anodyne	NAMPT	25	40
COC(=O)[C@@H](C)NC(=O)c1ccc(NCc2ncccn2)c([N+](=O)[O-])c1	ZINC000853901287	FD	On-Demand	Bother	TAAR1	21	47
O=C(NC1CC1)c1ccc(NCc2ncccn2)nc1	ZINC000853901292	CD	On-Demand	Anodyne	MAPK11	20	40
O=C(NC1CC1)c1ccc(NCc2ncccn2)nc1	ZINC000853901292	CD	On-Demand	Anodyne	MAPK14	35	41
O=C(NC1CC1)c1ccc(NCc2ncccn2)nc1	ZINC000853901292	CD	On-Demand	Anodyne	SSTR5	34	43
O=C(NC1CC1)c1ccc(NCc2ncccn2)nc1	ZINC000853901292	CD	On-Demand	Anodyne	HPGDS	37	41
CN1CCN(c2nc3ccccc3nc2NCc2ncccn2)CC1	ZINC000853901302	ED	On-Demand	Anodyne	HTR3A	40	55
CN1CCN(c2nc3ccccc3nc2NCc2ncccn2)CC1	ZINC000853901302	ED	On-Demand	Anodyne	HRH4	62	55
Cc1ccc([N+](=O)[O-])c(C(=O)OCCOC(F)F)c1	ZINC000853901307	CE	On-Demand	Bother	CACNA1D	46	35
c1cnc(CNc2ncnc3c2ncn3C2CC2)nc1	ZINC000853901314	CD	On-Demand	Anodyne	ADORA1	60	42
c1cnc(CNc2ncnc3c2ncn3C2CC2)nc1	ZINC000853901314	CD	On-Demand	Anodyne	ADORA3	72	44
C[C@]1(C(=O)OCc2nnc3n2CCOCC3)CCCN(C(=O)c2ccccc2)C1	ZINC000853901318	GD	On-Demand	Anodyne	SLC12A5	46	33
C[C@]1(C(=O)OCCOC(F)F)CCCN(C(=O)c2ccccc2)C1	ZINC000853901342	EF	On-Demand	Anodyne	SLC12A5	41	32
CCCCCCCCNC(=O)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853901396	FD	On-Demand	Mild	ASAH1	99	41
CCCCCCCCNC(=O)NC[C@H](O)CC	ZINC000853901408	BE	On-Demand	Mild	EPHX2	24	51
CCCCCCCCNC(=O)NC[C@H](O)CC	ZINC000853901408	BE	On-Demand	Mild	ASAH1	98	38
CCCCCCCCNC(=O)NC[C@H](O)CC	ZINC000853901408	BE	On-Demand	Mild	CQSS	61	39
CCCCCCCCNC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1	ZINC000853901413	FG	On-Demand	Mild	ASAH1	88	36
CCCCCCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853901414	DG	On-Demand	Mild	CPT1A	70	36
CCCCCCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853901414	DG	On-Demand	Mild	ASAH1	102	39
CCCCCCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853901415	DG	On-Demand	Mild	CPT1A	70	36
CCCCCCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853901415	DG	On-Demand	Mild	ASAH1	102	39
CCCCCCCCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853901420	EG	On-Demand	Mild	ASAH1	83	43
CCCCCCCCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853901420	EG	On-Demand	Mild	L3MBTL3	46	37
CCCCCCCCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853901421	EG	On-Demand	Mild	ASAH1	83	43
CCCCCCCCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853901421	EG	On-Demand	Mild	L3MBTL3	46	37
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(=O)C2	ZINC000853901452	CG	On-Demand	Mild	EPHX2	15	42
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(=O)C2	ZINC000853901452	CG	On-Demand	Mild	ASAH1	115	45
CCCCCCCCNC(=O)N1[C@H]2CC[C@H]1CC(=O)C2	ZINC000853901452	CG	On-Demand	Mild	LASR	48	36
CCCCCCCCNC(=O)NCCc1nnc(S)n1C	ZINC000853901453	DE	On-Demand	Mild	ASAH1	80	38
CCCCCCCCNC(=O)N1CCC[C@@H]1[C@H](C)O	ZINC000853901475	CF	On-Demand	Mild	TPP2	35	52
CCCCCCCCNC(=O)N1CCC[C@@H]1[C@H](C)O	ZINC000853901475	CF	On-Demand	Mild	ASAH1	105	43
CCCCCCCCNC(=O)N1CCC[C@@H]1[C@H](C)O	ZINC000853901475	CF	On-Demand	Mild	CQSS	42	32
CCCCCCCCNC(=O)N1CCC[C@@H]1[C@@H](C)O	ZINC000853901476	CF	On-Demand	Mild	TPP2	35	52
CCCCCCCCNC(=O)N1CCC[C@@H]1[C@@H](C)O	ZINC000853901476	CF	On-Demand	Mild	ASAH1	105	43
CCCCCCCCNC(=O)N1CCC[C@@H]1[C@@H](C)O	ZINC000853901476	CF	On-Demand	Mild	CQSS	42	32
CCCCCCCCNC(=O)N1CCN(S(=O)(=O)NC(C)C)CC1	ZINC000853901514	FD	On-Demand	Mild	ASAH1	100	39
CCCCCCCCNC(=O)N1C[C@@H](COC)[C@H](c2cnn(C)c2)C1	ZINC000853901529	FG	On-Demand	Mild	ASAH1	98	37
CCCCCCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853901543	CF	On-Demand	Mild	EPHX2	15	40
CCCCCCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853901543	CF	On-Demand	Mild	ASAH1	99	38
CCCCCCCCNC(=O)N1CC(S(=O)(=O)CC)C1	ZINC000853901613	DE	On-Demand	Mild	EPHX2	15	44
CCCCCCCCNC(=O)N1CC(S(=O)(=O)CC)C1	ZINC000853901613	DE	On-Demand	Mild	ASAH1	101	39
CCCCCCCCNC(=O)N(CC)[C@H]1CCN(C)C1	ZINC000853901629	CG	On-Demand	Mild	ASAH1	62	36
CCCCCCCCNC(=O)N(CC)[C@@H]1CCN(C)C1	ZINC000853901630	CG	On-Demand	Mild	ASAH1	62	36
CCCCCCCCNC(=O)NC1CC(CO)C1	ZINC000853901635	CE	On-Demand	Mild	EPHX2	40	63
CCCCCCCCNC(=O)NC1CC(CO)C1	ZINC000853901635	CE	On-Demand	Mild	ASAH1	68	34
CCCCCCCCNC(=O)N1CCC(c2nnc(O)n2CC)CC1	ZINC000853901647	FG	On-Demand	Mild	ASAH1	97	40
CCCCCCCCNC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853901659	FJ	On-Demand	Mild	ASAH1	100	40
CCCCCCCCNC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853901660	FJ	On-Demand	Mild	ASAH1	100	40
CCCCCCCCNC(=O)N1CCC[C@](CO)(OC)C1	ZINC000853901661	DF	On-Demand	Mild	ASAH1	90	34
CCCCCCCCNC(=O)N1CCC[C@@](CO)(OC)C1	ZINC000853901662	DF	On-Demand	Mild	ASAH1	90	34
CCCCCCCCNC(=O)N1CC(S(C)(=O)=O)C1	ZINC000853901676	CD	On-Demand	Mild	EPHX2	17	41
CCCCCCCCNC(=O)N1CC(S(C)(=O)=O)C1	ZINC000853901676	CD	On-Demand	Mild	ASAH1	102	39
CCCCCCCCNC(=O)N[C@H]1C[C@H](O)C1	ZINC000853901717	BE	On-Demand	Mild	GLB1	32	40
CCCCCCCCNC(=O)N[C@H]1C[C@H](O)C1	ZINC000853901717	BE	On-Demand	Mild	GBA	22	41
CCCCCCCCNC(=O)N[C@H]1C[C@H](O)C1	ZINC000853901717	BE	On-Demand	Mild	FUCA1	15	40
CCCCCCCCNC(=O)N[C@H]1C[C@H](O)C1	ZINC000853901717	BE	On-Demand	Mild	EPHX2	45	67
CCCCCCCCNC(=O)N[C@H]1C[C@H](O)C1	ZINC000853901717	BE	On-Demand	Mild	ASAH1	79	34
CC(C)c1cccc(COC(=O)c2cn(CC(N)=O)nn2)c1	ZINC000853901730	DD	On-Demand	Anodyne	ESRRA	16	40
CCCCCCCCNC(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853901742	EG	On-Demand	Mild	ASAH1	83	35
CCCCCCCCNC(=O)NC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853901742	EG	On-Demand	Mild	LASR	45	33
CCCCCCCCNC(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853901743	EG	On-Demand	Mild	ASAH1	83	35
CCCCCCCCNC(=O)NC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000853901743	EG	On-Demand	Mild	LASR	45	33
CCCCCCCCNC(=O)NC[C@@H]1CCC(=O)N1	ZINC000853901744	CD	On-Demand	Mild	EPHX2	24	47
CCCCCCCCNC(=O)NC[C@@H]1CCC(=O)N1	ZINC000853901744	CD	On-Demand	Mild	ASAH1	90	36
CCCCCCCCNC(=O)NC[C@@H]1CCC(=O)N1	ZINC000853901744	CD	On-Demand	Mild	LASR	45	32
CCCCCCCCNC(=O)N1CCC(CO)(CO)C1	ZINC000853901748	CD	On-Demand	Mild	ASAH1	98	38
C#CCOCCOC(=O)/C=C/c1cc(OC)c(O)c(OC)c1	ZINC000853901758	DD	On-Demand	Mild	AKR1B10	40	42
C#CCOCCOC(=O)/C=C\c1cc(OC)c(O)c(OC)c1	ZINC000853901759	DD	On-Demand	Mild	AKR1B10	40	42
CCCCCCCCNC(=O)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853901760	EF	On-Demand	Mild	ASAH1	92	37
CCCCCCCCNC(=O)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853901761	EF	On-Demand	Mild	ASAH1	92	37
CCCCCCCCNC(=O)N1CC[C@H](Cn2ccnn2)C1	ZINC000853901763	DF	On-Demand	Mild	ASAH1	88	40
CCCCCCCCNC(=O)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853901764	DF	On-Demand	Mild	ASAH1	88	40
CCCCCCCCNC(=O)N1C[C@@H](C)O[C@@H](c2nnc(C)o2)C1	ZINC000853901816	EG	On-Demand	Mild	ASAH1	87	34
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCCOC(F)F	ZINC000853901826	DD	On-Demand	Anodyne	CCKAR	18	51
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCCOC(F)F	ZINC000853901826	DD	On-Demand	Anodyne	PYGL	66	41
Brc1cnc(Br)c(N2CC[C@@H]3C[C@@H]3C2)c1	ZINC000853901838	EG	On-Demand	Anodyne	CHRNA3	32	41
Brc1cnc(Br)c(N2CC[C@@H]3C[C@@H]3C2)c1	ZINC000853901838	EG	On-Demand	Anodyne	CHRNA4	19	41
Brc1cnc(Br)c(N2CC[C@H]3C[C@@H]3C2)c1	ZINC000853901839	EG	On-Demand	Anodyne	CHRNA3	32	41
Brc1cnc(Br)c(N2CC[C@H]3C[C@@H]3C2)c1	ZINC000853901839	EG	On-Demand	Anodyne	CHRNA4	19	41
Brc1cnc(Br)c(N2CC[C@@H]3C[C@H]3C2)c1	ZINC000853901840	EG	On-Demand	Anodyne	CHRNA3	32	41
Brc1cnc(Br)c(N2CC[C@@H]3C[C@H]3C2)c1	ZINC000853901840	EG	On-Demand	Anodyne	CHRNA4	19	41
Brc1cnc(Br)c(N2CC[C@H]3C[C@H]3C2)c1	ZINC000853901841	EG	On-Demand	Anodyne	CHRNA3	32	41
Brc1cnc(Br)c(N2CC[C@H]3C[C@H]3C2)c1	ZINC000853901841	EG	On-Demand	Anodyne	CHRNA4	19	41
CCCCCCCCNC(=O)N1CCC[C@H](c2nnc(S)n2C2CC2)C1	ZINC000853901866	GI	On-Demand	Mild	ASAH1	86	35
CCCCCCCCNC(=O)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1	ZINC000853901867	GI	On-Demand	Mild	ASAH1	86	35
CCCCCCCCNC(=O)N1CCC(n2cnnc2O)CC1	ZINC000853901874	DF	On-Demand	Mild	ASAH1	101	40
C#CCOCCOC(=O)Cn1cnc2c(N)ncnc21	ZINC000853901903	CB	On-Demand	Mild	AHCY	83	48
C#CCOCCOC(=O)Cn1cnc2c(N)ncnc21	ZINC000853901903	CB	On-Demand	Mild	OXGR1	93	34
Nc1ncnc2c1ncn2CC(=O)OCCOC(F)F	ZINC000853901904	CC	On-Demand	Anodyne	AHCY	88	49
Nc1ncnc2c1ncn2CC(=O)OCCOC(F)F	ZINC000853901904	CC	On-Demand	Anodyne	OXGR1	98	35
COC(=O)c1sc(N2CC[C@@H](c3cc(C)c(Cl)cc3O)C2)nc1Cl	ZINC000853901931	GI	On-Demand	Anodyne	PARE	97	35
COC(=O)c1sc(N2CC[C@H](c3cc(C)c(Cl)cc3O)C2)nc1Cl	ZINC000853901932	GI	On-Demand	Anodyne	PARE	97	35
CC(C)c1cccc(COC(=O)Cn2cnc3c(N)ncnc32)c1	ZINC000853901963	EE	On-Demand	Anodyne	ADA	35	40
CC(C)c1cccc(COC(=O)Cn2cnc3c(N)ncnc32)c1	ZINC000853901963	EE	On-Demand	Anodyne	AHCY	69	43
CC(C)c1cccc(COC(=O)Cn2cnc3c(N)ncnc32)c1	ZINC000853901963	EE	On-Demand	Anodyne	OXGR1	76	34
CC(C)c1cccc(COC(=O)Cc2nn(CCO)c(=O)c3ccccc23)c1	ZINC000853901965	GF	On-Demand	Anodyne	AKR1B1	46	41
O=C(OCCOC(F)F)c1cc(N2CCNC2=O)ccc1Cl	ZINC000853901966	EE	On-Demand	Anodyne	Q9FYV8_MAIZE	42	43
CCCCCCCCNC(=O)N1C[C@H](C)[C@@H](O)[C@H](C)C1	ZINC000853901999	CG	On-Demand	Mild	GLB1	33	42
CCCCCCCCNC(=O)N1C[C@H](C)[C@@H](O)[C@H](C)C1	ZINC000853901999	CG	On-Demand	Mild	FUCA1	19	42
CCCCCCCCNC(=O)N1C[C@H](C)[C@@H](O)[C@H](C)C1	ZINC000853901999	CG	On-Demand	Mild	ASAH1	103	40
CCCCCCCCNC(=O)N1C[C@H](C)C(O)[C@@H](C)C1	ZINC000853902000	CG	On-Demand	Mild	GLB1	33	42
CCCCCCCCNC(=O)N1C[C@H](C)C(O)[C@@H](C)C1	ZINC000853902000	CG	On-Demand	Mild	FUCA1	19	42
CCCCCCCCNC(=O)N1C[C@H](C)C(O)[C@@H](C)C1	ZINC000853902000	CG	On-Demand	Mild	ASAH1	103	40
CCCCCCCCNC(=O)N1C[C@@H](C)C(O)[C@H](C)C1	ZINC000853902001	CG	On-Demand	Mild	GLB1	33	42
CCCCCCCCNC(=O)N1C[C@@H](C)C(O)[C@H](C)C1	ZINC000853902001	CG	On-Demand	Mild	FUCA1	19	42
CCCCCCCCNC(=O)N1C[C@@H](C)C(O)[C@H](C)C1	ZINC000853902001	CG	On-Demand	Mild	ASAH1	103	40
CCCCCCCCNC(=O)N1C[C@@H](C)[C@@](C)(CO)C1	ZINC000853902004	CG	On-Demand	Mild	ASAH1	93	36
CCCCCCCCNC(=O)N1C[C@H](C)[C@@](C)(CO)C1	ZINC000853902005	CG	On-Demand	Mild	ASAH1	93	36
CCCCCCCCNC(=O)N1C[C@H](C)[C@](C)(CO)C1	ZINC000853902006	CG	On-Demand	Mild	ASAH1	93	36
CCCCCCCCNC(=O)N1C[C@@H](C)[C@](C)(CO)C1	ZINC000853902007	CG	On-Demand	Mild	ASAH1	93	36
COc1ccc2c(N3CC[C@@H]4C[C@H]4C3)ccnc2c1	ZINC000853902027	CG	On-Demand	Anodyne	PDE3A	42	41
COc1ccc2c(N3CC[C@@H]4C[C@H]4C3)ccnc2c1	ZINC000853902027	CG	On-Demand	Anodyne	PDE3B	47	41
COc1ccc2c(N3CC[C@H]4C[C@@H]4C3)ccnc2c1	ZINC000853902028	CG	On-Demand	Anodyne	PDE3A	42	41
COc1ccc2c(N3CC[C@H]4C[C@@H]4C3)ccnc2c1	ZINC000853902028	CG	On-Demand	Anodyne	PDE3B	47	41
COc1ccc2c(N3CC[C@H]4C[C@H]4C3)ccnc2c1	ZINC000853902029	CG	On-Demand	Anodyne	PDE3A	42	41
COc1ccc2c(N3CC[C@H]4C[C@H]4C3)ccnc2c1	ZINC000853902029	CG	On-Demand	Anodyne	PDE3B	47	41
COc1ccc2c(N3CC[C@@H]4C[C@@H]4C3)ccnc2c1	ZINC000853902030	CG	On-Demand	Anodyne	PDE3A	42	41
COc1ccc2c(N3CC[C@@H]4C[C@@H]4C3)ccnc2c1	ZINC000853902030	CG	On-Demand	Anodyne	PDE3B	47	41
O=C(Cc1cc(F)ccc1F)OCc1nnc2n1CCOCC2	ZINC000853902041	DD	On-Demand	Anodyne	DPP4	15	42
CCCCCCCCNC(=O)NC/C=C/CO	ZINC000853902063	BE	On-Demand	Mild	EPHX2	23	54
CCCCCCCCNC(=O)NC/C=C/CO	ZINC000853902063	BE	On-Demand	Mild	ASAH1	77	34
CCCCCCCCNC(=O)NC/C=C\CO	ZINC000853902064	BE	On-Demand	Mild	EPHX2	23	54
CCCCCCCCNC(=O)NC/C=C\CO	ZINC000853902064	BE	On-Demand	Mild	ASAH1	77	34
CCCCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1cn(C)nc1C	ZINC000853902065	EG	On-Demand	Mild	ASAH1	80	35
CCCCCCCCNC(=O)N[C@H]1CC[C@H](C)S(=O)(=O)C1	ZINC000853902087	DF	On-Demand	Mild	EPHX2	25	60
CCCCCCCCNC(=O)N[C@H]1CC[C@@H](C)S(=O)(=O)C1	ZINC000853902088	DF	On-Demand	Mild	EPHX2	25	60
CCCCCCCCNC(=O)N[C@@H]1CC[C@H](C)S(=O)(=O)C1	ZINC000853902089	DF	On-Demand	Mild	EPHX2	25	60
CC(C)c1cccc(COC(=O)[C@H](NC(=O)C2CC2)[C@H](C)O)c1	ZINC000853902150	DE	On-Demand	Anodyne	CCR5	15	40
CC(C)c1cccc(COC(=O)[C@H](NC(=O)C2CC2)[C@H](C)O)c1	ZINC000853902150	DE	On-Demand	Anodyne	F11	35	41
CC(C)c1cccc(COC(=O)[C@@H](NC(=O)C2CC2)[C@H](C)O)c1	ZINC000853902151	DE	On-Demand	Anodyne	CCR5	15	40
CC(C)c1cccc(COC(=O)[C@@H](NC(=O)C2CC2)[C@H](C)O)c1	ZINC000853902151	DE	On-Demand	Anodyne	F11	35	41
CC(C)c1cccc(COC(=O)[C@H](NC(=O)C2CC2)[C@@H](C)O)c1	ZINC000853902152	DE	On-Demand	Anodyne	CCR5	15	40
CC(C)c1cccc(COC(=O)[C@H](NC(=O)C2CC2)[C@@H](C)O)c1	ZINC000853902152	DE	On-Demand	Anodyne	F11	35	41
CC(C)c1cccc(COC(=O)[C@@H](NC(=O)C2CC2)[C@@H](C)O)c1	ZINC000853902153	DE	On-Demand	Anodyne	CCR5	15	40
CC(C)c1cccc(COC(=O)[C@@H](NC(=O)C2CC2)[C@@H](C)O)c1	ZINC000853902153	DE	On-Demand	Anodyne	F11	35	41
C#CCOCCOC(=O)[C@@](C)(O)[C@@H](C)c1ccccc1	ZINC000853902163	CD	On-Demand	Mild	AMY2	59	35
C#CCOCCOC(=O)[C@@](C)(O)[C@H](C)c1ccccc1	ZINC000853902164	CD	On-Demand	Mild	AMY2	59	35
C#CCOCCOC(=O)[C@](C)(O)[C@H](C)c1ccccc1	ZINC000853902165	CD	On-Demand	Mild	AMY2	59	35
C#CCOCCOC(=O)[C@](C)(O)[C@@H](C)c1ccccc1	ZINC000853902166	CD	On-Demand	Mild	AMY2	59	35
CCCCCCCCNC(=O)N[C@@H]1CC[C@@H](C)S(=O)(=O)C1	ZINC000853902190	DF	On-Demand	Mild	EPHX2	25	60
CC(C)(C)C(=O)Nc1ccc(F)c(C(=O)OCc2nnc3n2CCOCC3)c1	ZINC000853902195	GE	On-Demand	Anodyne	STAT6	45	34
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853902221	DE	On-Demand	Anodyne	PYGL	70	39
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853902221	DE	On-Demand	Anodyne	AKR1C3	17	42
O=C(CNC(=O)c1cc2ccccc2[nH]1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853902222	DE	On-Demand	Anodyne	PYGL	70	39
O=C(CNC(=O)c1cc2ccccc2[nH]1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853902222	DE	On-Demand	Anodyne	AKR1C3	17	42
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853902223	DE	On-Demand	Anodyne	PYGL	70	39
O=C(CNC(=O)c1cc2ccccc2[nH]1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853902223	DE	On-Demand	Anodyne	AKR1C3	17	42
CCCCCCCCNC(=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853902224	CG	On-Demand	Mild	ASAH1	87	38
CCCCCCCCNC(=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853902226	CG	On-Demand	Mild	ASAH1	87	38
COC(=O)c1cnc(N2CC[C@@H]3C[C@H]3C2)cc1C(F)(F)F	ZINC000853902245	DF	On-Demand	Anodyne	RBP4	40	36
COC(=O)c1cnc(N2CC[C@H]3C[C@@H]3C2)cc1C(F)(F)F	ZINC000853902247	DF	On-Demand	Anodyne	RBP4	40	36
COC(=O)c1cnc(N2CC[C@H]3C[C@H]3C2)cc1C(F)(F)F	ZINC000853902249	DF	On-Demand	Anodyne	RBP4	40	36
COC(=O)c1cnc(N2CC[C@@H]3C[C@@H]3C2)cc1C(F)(F)F	ZINC000853902251	DF	On-Demand	Anodyne	RBP4	40	36
O=S(=O)(c1cc(F)ccc1N1CC[C@@H]2C[C@H]2C1)C(F)(F)F	ZINC000853902272	DF	On-Demand	Anodyne	LIPG	41	37
O=S(=O)(c1cc(F)ccc1N1CC[C@H]2C[C@@H]2C1)C(F)(F)F	ZINC000853902274	DF	On-Demand	Anodyne	LIPG	41	37
O=S(=O)(c1cc(F)ccc1N1CC[C@H]2C[C@H]2C1)C(F)(F)F	ZINC000853902277	DF	On-Demand	Anodyne	LIPG	41	37
O=S(=O)(c1cc(F)ccc1N1CC[C@@H]2C[C@@H]2C1)C(F)(F)F	ZINC000853902279	DF	On-Demand	Anodyne	LIPG	41	37
CCCCCCCCNC(=O)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853902334	CF	On-Demand	Mild	EPHX2	42	50
CCCCCCCCNC(=O)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853902334	CF	On-Demand	Mild	ASAH1	74	33
CCCCCCCCNC(=O)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853902336	CF	On-Demand	Mild	EPHX2	42	50
CCCCCCCCNC(=O)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853902336	CF	On-Demand	Mild	ASAH1	74	33
O=C(OCc1nnc2n1CCOCC2)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000853902338	GE	On-Demand	Anodyne	CPT1A	31	42
O=C(OCc1nnc2n1CCOCC2)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000853902338	GE	On-Demand	Anodyne	GRM5	19	41
O=C(OCc1nnc2n1CCOCC2)c1cccc(-c2noc(C3CC3)n2)c1	ZINC000853902338	GE	On-Demand	Anodyne	ETHR	50	42
O=C(OCc1nnc2n1CCOCC2)c1ccc(OC2CCC2)cc1	ZINC000853902340	EE	On-Demand	Anodyne	PRSS2	40	30
C#CCOCCOC(=O)CNC(=O)c1cc2ccccc2[nH]1	ZINC000853902353	DD	On-Demand	Mild	CCKAR	15	46
C#CCOCCOC(=O)CNC(=O)c1cc2ccccc2[nH]1	ZINC000853902353	DD	On-Demand	Mild	PYGL	64	45
CCOc1cccnc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853902401	FE	On-Demand	Anodyne	SSTR5	53	35
CCOc1cccnc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853902402	FE	On-Demand	Anodyne	SSTR5	53	35
Cc1cc([C@@H]2CCN(c3cc(Cl)nc(N)n3)C2)c(O)cc1Cl	ZINC000853902418	EG	On-Demand	Anodyne	HRH4	50	38
CCCCCCCCNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1	ZINC000853902429	FH	On-Demand	Mild	CPT1A	49	34
CCCCCCCCNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1	ZINC000853902429	FH	On-Demand	Mild	ASAH1	90	37
CCCCCCCCNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1	ZINC000853902432	FH	On-Demand	Mild	CPT1A	49	34
CCCCCCCCNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1	ZINC000853902432	FH	On-Demand	Mild	ASAH1	90	37
CCCCCCCCNC(=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853902454	CF	On-Demand	Mild	ASAH1	96	40
CCCCCCCCNC(=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853902456	CF	On-Demand	Mild	ASAH1	96	40
C[C@H](CCOc1ccccc1)C(=O)OCCOC(F)F	ZINC000853902463	CF	On-Demand	Anodyne	PPARA	19	40
C[C@H](CCOc1ccccc1)C(=O)OCCOC(F)F	ZINC000853902463	CF	On-Demand	Anodyne	PLA2G4B	47	33
C[C@@H](CCOc1ccccc1)C(=O)OCCOC(F)F	ZINC000853902465	CF	On-Demand	Anodyne	PPARA	19	40
C[C@@H](CCOc1ccccc1)C(=O)OCCOC(F)F	ZINC000853902465	CF	On-Demand	Anodyne	PLA2G4B	47	33
C#CCNC(=O)c1ccc(N2CC[C@H]3C[C@H]3C2)nc1	ZINC000853902492	CD	On-Demand	Mild	HPGDS	16	42
C#CCNC(=O)c1ccc(N2CC[C@@H]3C[C@@H]3C2)nc1	ZINC000853902494	CD	On-Demand	Mild	HPGDS	16	42
C#CCNC(=O)c1ccc(N2CC[C@H]3C[C@@H]3C2)nc1	ZINC000853902496	CD	On-Demand	Mild	HPGDS	16	42
C#CCNC(=O)c1ccc(N2CC[C@@H]3C[C@H]3C2)nc1	ZINC000853902497	CD	On-Demand	Mild	HPGDS	16	42
O=C(OCCOC(F)F)c1ccccc1Cn1cncn1	ZINC000853902529	CD	On-Demand	Anodyne	HIS3	46	34
CCCCCCCCNC(=O)N1CCC(O)(CO)CC1	ZINC000853902530	CD	On-Demand	Mild	ASAH1	100	38
C[C@H](CC(=O)OCCOC(F)F)NC(=O)OC(C)(C)C	ZINC000853902531	CE	On-Demand	Anodyne	CTSK	16	42
CCCCCCCCNC(=O)N1CC2CC1(C)C2	ZINC000853902570	CH	On-Demand	Mild	EPHX2	27	50
CCCCCCCCNC(=O)N1CC2CC1(C)C2	ZINC000853902570	CH	On-Demand	Mild	ASAH1	100	38
CCCCCCCCNC(=O)N1CC(CCOC)C1	ZINC000853902579	CG	On-Demand	Mild	ASAH1	98	39
O=C(Nc1ccc(C(=O)OCCOC(F)F)cc1)OCC(F)(F)F	ZINC000853902581	FG	On-Demand	Anodyne	ACR	64	43
O=C(CCc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853902633	CE	On-Demand	Bother	CACNA1C	57	39
O=C(CCc1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853902633	CE	On-Demand	Bother	CACNA1D	91	39
O=C(OCCOC(F)F)c1cc(S(=O)(=O)N2CCC2)ccc1Cl	ZINC000853902646	FE	On-Demand	Anodyne	Q9FYV8_MAIZE	41	38
O=C(Cc1nn(CCO)c(=O)c2ccccc12)OCCOC(F)F	ZINC000853902665	EC	On-Demand	Anodyne	AKR1B1	47	38
O=C(CCc1cccc([N+](=O)[O-])c1)OCc1nnc2n1CCOCC2	ZINC000853902712	ED	On-Demand	Bother	CACNA1C	41	35
O=C(CCc1cccc([N+](=O)[O-])c1)OCc1nnc2n1CCOCC2	ZINC000853902712	ED	On-Demand	Bother	CACNA1D	65	35
Nc1ncnc2c1ncn2CC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853902730	CC	On-Demand	Anodyne	AHCY	90	46
Nc1ncnc2c1ncn2CC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853902730	CC	On-Demand	Anodyne	ADCY5	27	42
Nc1ncnc2c1ncn2CC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853902730	CC	On-Demand	Anodyne	OXGR1	108	36
Nc1ncnc2c1ncn2CC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853902730	CC	On-Demand	Anodyne	DOT1L	40	34
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853902732	CC	On-Demand	Anodyne	AHCY	90	46
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853902732	CC	On-Demand	Anodyne	ADCY5	27	42
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853902732	CC	On-Demand	Anodyne	OXGR1	108	36
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853902732	CC	On-Demand	Anodyne	DOT1L	40	34
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853902734	CC	On-Demand	Anodyne	AHCY	90	46
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853902734	CC	On-Demand	Anodyne	ADCY5	27	42
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853902734	CC	On-Demand	Anodyne	OXGR1	108	36
Nc1ncnc2c1ncn2CC(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853902734	CC	On-Demand	Anodyne	DOT1L	40	34
NC(=O)c1cc(N2CC[C@@H]3C[C@H]3C2)ccn1	ZINC000853902807	BD	On-Demand	Anodyne	CHRNA3	44	37
NC(=O)c1cc(N2CC[C@H]3C[C@@H]3C2)ccn1	ZINC000853902808	BD	On-Demand	Anodyne	CHRNA3	44	37
NC(=O)c1cc(N2CC[C@H]3C[C@H]3C2)ccn1	ZINC000853902809	BD	On-Demand	Anodyne	CHRNA3	44	37
NC(=O)c1cc(N2CC[C@@H]3C[C@@H]3C2)ccn1	ZINC000853902810	BD	On-Demand	Anodyne	CHRNA3	44	37
CCCCCCCCNC(=O)N1CCC[C@H](c2nnc(S)n2CC)C1	ZINC000853902811	FH	On-Demand	Mild	ASAH1	93	39
CCCCCCCCNC(=O)N1CCC[C@@H](c2nnc(S)n2CC)C1	ZINC000853902812	FH	On-Demand	Mild	ASAH1	93	39
CCCCCCCCNC(=O)N1CCC(=O)N(C)CC1	ZINC000853902828	CE	On-Demand	Mild	ASAH1	110	45
CCCCCCCCNC(=O)NC[C@H]1CC(=O)N(C)C1	ZINC000853902837	CE	On-Demand	Mild	EPHX2	21	42
CCCCCCCCNC(=O)NC[C@H]1CC(=O)N(C)C1	ZINC000853902837	CE	On-Demand	Mild	ASAH1	94	38
CCCCCCCCNC(=O)NC[C@H]1CC(=O)N(C)C1	ZINC000853902837	CE	On-Demand	Mild	LASR	45	33
CCCCCCCCNC(=O)NC[C@@H]1CC(=O)N(C)C1	ZINC000853902838	CE	On-Demand	Mild	EPHX2	21	42
CCCCCCCCNC(=O)NC[C@@H]1CC(=O)N(C)C1	ZINC000853902838	CE	On-Demand	Mild	ASAH1	94	38
CCCCCCCCNC(=O)NC[C@@H]1CC(=O)N(C)C1	ZINC000853902838	CE	On-Demand	Mild	LASR	45	33
O=C(CCCOc1cccnc1)OCCOC(F)F	ZINC000853902841	CE	On-Demand	Anodyne	TBXAS1	29	40
c1cc(N2CCCC2)nc(N2CC[C@@H]3C[C@H]3C2)n1	ZINC000853902850	BD	On-Demand	Anodyne	SORD	52	36
c1cc(N2CCCC2)nc(N2CC[C@H]3C[C@@H]3C2)n1	ZINC000853902851	BD	On-Demand	Anodyne	SORD	52	36
c1cc(N2CCCC2)nc(N2CC[C@H]3C[C@H]3C2)n1	ZINC000853902852	BD	On-Demand	Anodyne	SORD	52	36
c1cc(N2CCCC2)nc(N2CC[C@@H]3C[C@@H]3C2)n1	ZINC000853902853	BD	On-Demand	Anodyne	SORD	52	36
CCCCCCCCNC(=O)N1CC[C@@H](CN2CCCC2=O)C1	ZINC000853902860	DG	On-Demand	Mild	ASAH1	102	44
CCCCCCCCNC(=O)N1CC[C@H](CN2CCCC2=O)C1	ZINC000853902861	DG	On-Demand	Mild	ASAH1	102	44
CCCCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1cnn(C(C)C)c1	ZINC000853902887	FH	On-Demand	Mild	ASAH1	85	35
CCCCCCCCNC(=O)N[C@@H]1CCO[C@H]1c1cnn(C(C)C)c1	ZINC000853902887	FH	On-Demand	Mild	LASR	43	30
CCc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1N	ZINC000853902918	FF	On-Demand	Anodyne	TRY2_BOVIN	20	41
CCc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1N	ZINC000853902918	FF	On-Demand	Anodyne	PROKR1	53	34
O=C(Cc1nn(CCO)c(=O)c2ccccc12)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853902954	ED	On-Demand	Anodyne	AKR1B1	42	38
O=C(Cc1nn(CCO)c(=O)c2ccccc12)OCC1C[C@H]2C[C@@H]2C1	ZINC000853902955	ED	On-Demand	Anodyne	AKR1B1	42	38
O=C(Cc1nn(CCO)c(=O)c2ccccc12)OCC1C[C@@H]2C[C@H]2C1	ZINC000853902956	ED	On-Demand	Anodyne	AKR1B1	42	38
CCc1ccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853902958	EF	On-Demand	Bother	GSTM2	21	40
CCc1ccc(C(=O)OCc2onc(C)c2[N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000853902958	EF	On-Demand	Bother	GSTP1	15	40
CC(C)c1cccc(COC(=O)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853902969	FI	On-Demand	Anodyne	LOX1.1	19	40
CC(C)c1cccc(COC(=O)[C@@H](C)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853902969	FI	On-Demand	Anodyne	O49150_SOLTU	26	40
CC(C)c1cccc(COC(=O)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853902971	FI	On-Demand	Anodyne	LOX1.1	19	40
CC(C)c1cccc(COC(=O)[C@H](C)c2ccc(S(C)(=O)=O)cc2)c1	ZINC000853902971	FI	On-Demand	Anodyne	O49150_SOLTU	26	40
O=C(OCCOC(F)F)[C@H]1CCCN1Cc1ccc(F)cc1	ZINC000853903010	DF	On-Demand	Anodyne	FKBP1A	42	45
O=C(OCCOC(F)F)[C@@H]1CCCN1Cc1ccc(F)cc1	ZINC000853903012	DF	On-Demand	Anodyne	FKBP1A	42	45
Cc1ccc(C(=O)OCCOC(F)F)cc1S(=O)(=O)NC1CCCC1	ZINC000853903036	GF	On-Demand	Anodyne	CCR8	62	37
Cc1ccc(C(=O)OCCOC(F)F)cc1S(=O)(=O)NC1CCCC1	ZINC000853903036	GF	On-Demand	Anodyne	BRD4	18	45
CC[C@@H](C(=O)OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853903046	EH	On-Demand	Anodyne	KCNQ2	16	46
CC[C@@H](C(=O)OCCOC(F)F)c1cccc(C(F)(F)F)c1	ZINC000853903046	EH	On-Demand	Anodyne	PDS	46	37
O=C(CCSc1ccnc2cc(Cl)ccc12)OCCOC(F)F	ZINC000853903060	FI	On-Demand	Anodyne	HRP1_PLAFA	54	33
CCCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1N	ZINC000853903102	GG	On-Demand	Anodyne	HTR4	15	40
CCCCCCCCNC(=O)N1CCc2nnc(N3CCCC3)cc2C1	ZINC000853903130	FH	On-Demand	Mild	ASAH1	90	37
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H]2C[C@@H]2C1	ZINC000853903137	CD	On-Demand	Bother	WDR5	35	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H]2C[C@H]2C1	ZINC000853903138	CD	On-Demand	Bother	WDR5	35	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H]2C[C@@H]2C1	ZINC000853903139	CD	On-Demand	Bother	WDR5	35	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H]2C[C@H]2C1	ZINC000853903140	CD	On-Demand	Bother	WDR5	35	40
CCC(CC)(C(=O)OCCOC(F)F)c1ccccc1	ZINC000853903154	CH	On-Demand	Anodyne	CHRM4	16	43
CCC(CC)(C(=O)OCCOC(F)F)c1ccccc1	ZINC000853903154	CH	On-Demand	Anodyne	AMY2	71	43
CCC(CC)(C(=O)OCCOC(F)F)c1ccccc1	ZINC000853903154	CH	On-Demand	Anodyne	AOX1	18	40
CCCCCCCCNC(=O)N1CC[C@H](C(=O)OC)[C@H](C)C1	ZINC000853903159	DG	On-Demand	Mild	ASAH1	97	38
CCCCCCCCNC(=O)N1CCn2c(O)nnc2C1	ZINC000853903172	CD	On-Demand	Mild	ASAH1	99	39
O=C(OCCOC(F)F)c1cc(OCc2ccccc2)ccn1	ZINC000853903179	DG	On-Demand	Anodyne	PDS	43	35
CC[C@H](C)[C@H](O)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853903222	ED	On-Demand	Anodyne	MMP1	19	43
CC[C@H](C)[C@H](O)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853903224	ED	On-Demand	Anodyne	MMP1	19	43
CCCCCCCCNC(=O)NCC1CCC(O)CC1	ZINC000853903269	CG	On-Demand	Mild	EPHX2	37	51
CCCCCCCCNC(=O)NCC1CCC(O)CC1	ZINC000853903269	CG	On-Demand	Mild	ASAH1	69	42
CCCCCCCCNC(=O)NCc1ccc2c(=O)cc[nH]c2c1	ZINC000853903271	EH	On-Demand	Mild	S1PR2	42	33
CCCCCCCCNC(=O)NCc1ccc2c(=O)cc[nH]c2c1	ZINC000853903271	EH	On-Demand	Mild	ASAH1	87	36
CCCCCCCCNC(=O)N1CCC2(COC2)C1	ZINC000853903273	CF	On-Demand	Mild	ASAH1	99	41
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCCOC(F)F	ZINC000853903275	FE	On-Demand	Anodyne	MPO	75	38
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCCOC(F)F	ZINC000853903275	FE	On-Demand	Anodyne	MC5R	47	37
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCCOC(F)F	ZINC000853903275	FE	On-Demand	Anodyne	GRPR	57	34
CC(=O)N[C@@H](Cc1c[nH]c2cc(F)ccc12)C(=O)OCCOC(F)F	ZINC000853903275	FE	On-Demand	Anodyne	MMP11	49	34
CCCCCCCCNC(=O)N1CCN(S(=O)(=O)NC)CC1	ZINC000853903287	ED	On-Demand	Mild	ASAH1	99	39
CCCCCCCCNC(=O)N1CCC[C@H](c2nnc(S)n2C)C1	ZINC000853903308	FG	On-Demand	Mild	ASAH1	99	41
CCCCCCCCNC(=O)N1CCC[C@@H](c2nnc(S)n2C)C1	ZINC000853903311	FG	On-Demand	Mild	ASAH1	99	41
Cc1cc([C@@H]2CCN(c3nccc(N4CCCC4)n3)C2)c(O)cc1Cl	ZINC000853903335	FH	On-Demand	Anodyne	SORD	55	37
COC(=O)C[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853903425	ED	On-Demand	Anodyne	MMP1	37	47
COC(=O)C[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853903425	ED	On-Demand	Anodyne	PROKR1	59	32
COC(=O)C[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853903427	ED	On-Demand	Anodyne	MMP1	37	47
COC(=O)C[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853903427	ED	On-Demand	Anodyne	PROKR1	59	32
O=C(OCc1nnc2n1CCOCC2)C1(Cc2ccccc2)CCC1	ZINC000853903443	EE	On-Demand	Anodyne	SLC12A5	75	39
COc1cccc(C(=O)OCCOC(F)F)n1	ZINC000853903464	BD	On-Demand	Anodyne	ALS	76	36
Nc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(I)c1	ZINC000853903480	FG	On-Demand	Anodyne	HTR4	20	43
Cc1ccc(-c2cncc(C(=O)OCCOC(F)F)c2)cc1	ZINC000853903513	DG	On-Demand	Anodyne	SCN10A	36	42
O=C(Cn1cc(-c2ccccc2)nn1)OCCOC(F)F	ZINC000853903533	CD	On-Demand	Anodyne	FIMH	18	42
CC(C)c1cccc(COC(=O)[C@@H](C)NS(=O)(=O)c2cnn(C)c2)c1	ZINC000853903537	FD	On-Demand	Anodyne	TRY2_BOVIN	86	35
CC(C)c1cccc(COC(=O)[C@@H](C)NS(=O)(=O)c2cnn(C)c2)c1	ZINC000853903537	FD	On-Demand	Anodyne	ST14	40	34
CC(C)c1cccc(COC(=O)[C@H](C)NS(=O)(=O)c2cnn(C)c2)c1	ZINC000853903538	FD	On-Demand	Anodyne	TRY2_BOVIN	86	35
CC(C)c1cccc(COC(=O)[C@H](C)NS(=O)(=O)c2cnn(C)c2)c1	ZINC000853903538	FD	On-Demand	Anodyne	ST14	40	34
CC(C)c1cccc(COC(=O)c2ccc([N+](=O)[O-])cn2)c1	ZINC000853903542	DG	On-Demand	Bother	CACNA1C	60	42
CC(C)c1cccc(COC(=O)c2ccc([N+](=O)[O-])cn2)c1	ZINC000853903542	DG	On-Demand	Bother	CACNA1D	94	42
CC(C)c1cccc(COC(=O)c2ccc([N+](=O)[O-])cn2)c1	ZINC000853903542	DG	On-Demand	Bother	ACR	18	41
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccc(F)cc1	ZINC000853903562	EF	On-Demand	Anodyne	FKBP1A	61	49
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccc(F)cc1	ZINC000853903562	EF	On-Demand	Anodyne	SLC6A3	26	41
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccc(F)cc1	ZINC000853903563	EF	On-Demand	Anodyne	FKBP1A	61	49
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccc(F)cc1	ZINC000853903563	EF	On-Demand	Anodyne	SLC6A3	26	41
CC(=O)N1CC[C@](C)(C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853903565	DG	On-Demand	Anodyne	SLC12A5	73	39
C#CCOCCOC(=O)Cc1nn(CCO)c(=O)c2ccccc12	ZINC000853903634	EC	On-Demand	Mild	AKR1B1	41	37
Nc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(I)c1	ZINC000853903647	FG	On-Demand	Anodyne	HTR4	20	43
Nc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(I)c1	ZINC000853903648	FG	On-Demand	Anodyne	HTR4	20	43
O=C(OCCOC(F)F)C1(Cc2ccccc2)CC1	ZINC000853903665	CF	On-Demand	Anodyne	SLC12A5	64	36
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)OCCOC(F)F	ZINC000853903681	FD	On-Demand	Anodyne	GRIN2B	20	41
O=C(CN1CCN(C(=O)OCc2ccccc2)CC1)OCCOC(F)F	ZINC000853903681	FD	On-Demand	Anodyne	SLC12A5	44	33
O=C(OCc1nnc2n1CCOCC2)c1cncc(-c2ccc(Cl)cc2)c1	ZINC000853903751	GF	On-Demand	Anodyne	SCN10A	40	46
O=C(OCCOC(F)F)c1cc(C(F)(F)F)ccc1F	ZINC000853903816	DG	On-Demand	Anodyne	LIPG	40	35
COc1ccc(-c2cncc(C(=O)OCCOC(F)F)c2)cc1	ZINC000853903871	DG	On-Demand	Anodyne	CYP11B2	25	55
COc1ccc(-c2cncc(C(=O)OCCOC(F)F)c2)cc1	ZINC000853903871	DG	On-Demand	Anodyne	SCN10A	31	40
O=C(OCc1nnc2n1CCOCC2)C1(Cc2ccccc2)CC1	ZINC000853903907	ED	On-Demand	Anodyne	SLC12A5	71	38
Cc1cc(N2CC[C@@H](c3cc(C)c(Cl)cc3O)C2)nc(N)n1	ZINC000853904005	DG	On-Demand	Anodyne	HRH4	50	38
Cc1cc(N2CC[C@H](c3cc(C)c(Cl)cc3O)C2)nc(N)n1	ZINC000853904006	DG	On-Demand	Anodyne	HRH4	50	38
C[C@@H](C(=O)OCCOC(F)F)c1ccc(S(C)(=O)=O)cc1	ZINC000853904133	DD	On-Demand	Anodyne	PTGS2	16	42
C[C@H](C(=O)OCCOC(F)F)c1ccc(S(C)(=O)=O)cc1	ZINC000853904134	DD	On-Demand	Anodyne	PTGS2	16	42
O=C(OCCOC(F)F)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904200	FC	On-Demand	Anodyne	MMP2	16	42
O=C(OCCOC(F)F)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904202	FC	On-Demand	Anodyne	MMP2	16	42
O=C(OCCOC(F)F)C1(Cc2ccccc2)CCC1	ZINC000853904242	CG	On-Demand	Anodyne	SLC12A5	72	37
COc1ccc(-c2cncc(C(=O)OCc3nnc4n3CCOCC4)c2)cc1	ZINC000853904270	GE	On-Demand	Anodyne	CYP11B2	19	46
CC(C)c1cccc(COC(=O)C2CCC(=O)CC2)c1	ZINC000853904278	CH	On-Demand	Anodyne	AMY2	44	31
CCc1nn(C)c(CC)c1CNC(=O)NNc1ccc(C)c(F)c1	ZINC000853904342	EF	On-Demand	Reactive	FPR2	16	40
COC[C@@H](C)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904355	EE	On-Demand	Anodyne	MMP1	15	45
COC[C@H](C)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904356	EE	On-Demand	Anodyne	MMP1	15	45
COC[C@H](C)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904357	EE	On-Demand	Anodyne	MMP1	15	45
COC[C@@H](C)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904358	EE	On-Demand	Anodyne	MMP1	15	45
O=C(/C=C\c1cccc(O)c1)OCCOC(F)F	ZINC000853904379	CE	On-Demand	Anodyne	AKR1B10	43	48
O=C(/C=C/c1cccc(O)c1)OCCOC(F)F	ZINC000853904380	CE	On-Demand	Anodyne	AKR1B10	43	48
C[C@@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCCOC(F)F	ZINC000853904385	FI	On-Demand	Anodyne	HRP1_PLAFA	68	34
C[C@H](Sc1ccnc2cc(Cl)ccc12)C(=O)OCCOC(F)F	ZINC000853904386	FI	On-Demand	Anodyne	HRP1_PLAFA	68	34
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904395	GE	On-Demand	Anodyne	FKBP1A	23	40
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904395	GE	On-Demand	Anodyne	HRH3	17	44
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904395	GE	On-Demand	Anodyne	SIGMAR1	16	43
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904395	GE	On-Demand	Anodyne	MMP1	35	46
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904396	GE	On-Demand	Anodyne	FKBP1A	23	40
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904396	GE	On-Demand	Anodyne	HRH3	17	44
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904396	GE	On-Demand	Anodyne	SIGMAR1	16	43
COC(=O)[C@@H]1CCC[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904396	GE	On-Demand	Anodyne	MMP1	35	46
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904397	GE	On-Demand	Anodyne	FKBP1A	23	40
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904397	GE	On-Demand	Anodyne	HRH3	17	44
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904397	GE	On-Demand	Anodyne	SIGMAR1	16	43
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904397	GE	On-Demand	Anodyne	MMP1	35	46
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904398	GE	On-Demand	Anodyne	FKBP1A	23	40
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904398	GE	On-Demand	Anodyne	HRH3	17	44
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904398	GE	On-Demand	Anodyne	SIGMAR1	16	43
COC(=O)[C@@H]1CCC[C@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853904398	GE	On-Demand	Anodyne	MMP1	35	46
C/C=C(\C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904428	DE	On-Demand	Anodyne	SIGMAR1	17	41
C/C=C(\C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904428	DE	On-Demand	Anodyne	MMP1	27	47
C/C=C(\C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904428	DE	On-Demand	Anodyne	PROKR1	46	30
C/C=C(/C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904430	DE	On-Demand	Anodyne	SIGMAR1	17	41
C/C=C(/C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904430	DE	On-Demand	Anodyne	MMP1	27	47
C/C=C(/C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904430	DE	On-Demand	Anodyne	PROKR1	46	30
C/C=C(/C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904432	DE	On-Demand	Anodyne	SIGMAR1	17	41
C/C=C(/C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904432	DE	On-Demand	Anodyne	MMP1	27	47
C/C=C(/C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904432	DE	On-Demand	Anodyne	PROKR1	46	30
C/C=C(\C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904434	DE	On-Demand	Anodyne	SIGMAR1	17	41
C/C=C(\C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904434	DE	On-Demand	Anodyne	MMP1	27	47
C/C=C(\C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904434	DE	On-Demand	Anodyne	PROKR1	46	30
COc1cccc([C@@H](C)CC(=O)OCCOC(F)F)c1	ZINC000853904486	CF	On-Demand	Anodyne	MTNR1A	41	40
COc1cccc([C@@H](C)CC(=O)OCCOC(F)F)c1	ZINC000853904486	CF	On-Demand	Anodyne	MTNR1B	40	40
COc1cccc([C@@H](C)CC(=O)OCCOC(F)F)c1	ZINC000853904486	CF	On-Demand	Anodyne	FFAR1	15	43
COc1cccc([C@H](C)CC(=O)OCCOC(F)F)c1	ZINC000853904488	CF	On-Demand	Anodyne	MTNR1A	41	40
COc1cccc([C@H](C)CC(=O)OCCOC(F)F)c1	ZINC000853904488	CF	On-Demand	Anodyne	MTNR1B	40	40
COc1cccc([C@H](C)CC(=O)OCCOC(F)F)c1	ZINC000853904488	CF	On-Demand	Anodyne	FFAR1	15	43
COC(=O)c1ccncc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904503	GD	On-Demand	Anodyne	MMP1	16	42
COC(=O)c1ccncc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904503	GD	On-Demand	Anodyne	PROKR1	41	30
COC(=O)c1ccncc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904504	GD	On-Demand	Anodyne	MMP1	16	42
COC(=O)c1ccncc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904504	GD	On-Demand	Anodyne	PROKR1	41	30
CCC(CC)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904508	EG	On-Demand	Anodyne	MMP1	18	47
CCC(CC)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853904509	EG	On-Demand	Anodyne	MMP1	18	47
CCC(=CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)CC	ZINC000853904511	EG	On-Demand	Anodyne	MMP1	17	44
CCC(=CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)CC	ZINC000853904512	EG	On-Demand	Anodyne	MMP1	17	44
CCC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853904514	GG	On-Demand	Anodyne	SIGMAR1	15	45
CCC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853904514	GG	On-Demand	Anodyne	MMP1	16	43
CCC(=O)c1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853904515	GG	On-Demand	Anodyne	SIGMAR1	15	45
CCC(=O)c1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853904515	GG	On-Demand	Anodyne	MMP1	16	43
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904529	FD	On-Demand	Anodyne	MMP13	15	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904529	FD	On-Demand	Anodyne	MMP2	19	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904530	FD	On-Demand	Anodyne	MMP13	15	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904530	FD	On-Demand	Anodyne	MMP2	19	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904531	FD	On-Demand	Anodyne	MMP13	15	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904531	FD	On-Demand	Anodyne	MMP2	19	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904532	FD	On-Demand	Anodyne	MMP13	15	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000853904532	FD	On-Demand	Anodyne	MMP2	19	41
O=C(CNC(=O)c1ccccc1C(F)(F)F)OCC1C[C@H]2C[C@@H]2C1	ZINC000853904567	EG	On-Demand	Anodyne	RBP4	72	37
O=C(CNC(=O)c1ccccc1C(F)(F)F)OCC1C[C@@H]2C[C@H]2C1	ZINC000853904568	EG	On-Demand	Anodyne	RBP4	72	37
O=C(CNC(=O)c1ccccc1C(F)(F)F)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853904569	EG	On-Demand	Anodyne	RBP4	72	37
COC(=O)C[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853904580	CG	On-Demand	Anodyne	CTSB	24	40
COC(=O)C[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853904580	CG	On-Demand	Anodyne	CAPNS1	47	32
COC(=O)C[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853904580	CG	On-Demand	Anodyne	CAPN1	38	40
COC(=O)C[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853904580	CG	On-Demand	Anodyne	CAPN2	52	33
COC(=O)C[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853904580	CG	On-Demand	Anodyne	NPR	58	32
COc1ccc(N2CC[C@H](NC(=O)NCCc3ccncc3C)C2)cc1	ZINC000853904682	FF	On-Demand	Clean	MTNR1A	25	43
COc1ccc(OCC(=O)OCCOC(F)F)cc1C	ZINC000853904813	CE	On-Demand	Anodyne	PPARD	57	44
COc1ccc(OCC(=O)OCCOC(F)F)cc1C	ZINC000853904813	CE	On-Demand	Anodyne	PLA2G4B	84	41
COc1cc2c(cc1OC)CN(C(=O)CCC(=O)OCCOC(F)F)CC2	ZINC000853904840	GE	On-Demand	Anodyne	ABCB1	17	48
COC(=O)Nc1cc(C(=O)OCCOC(F)F)cc(C(F)(F)F)c1	ZINC000853904889	FG	On-Demand	Anodyne	ATF1	42	48
COC(=O)Nc1cc(C(=O)OCCOC(F)F)cc(C(F)(F)F)c1	ZINC000853904889	FG	On-Demand	Anodyne	NFKB1	39	48
O=C(CCSc1ccccn1)OCCOC(F)F	ZINC000853904898	CE	On-Demand	Anodyne	FAS	19	40
CC(C)(C)OC(=O)N(CC(=O)OCCOC(F)F)c1ccccc1	ZINC000853904947	EG	On-Demand	Anodyne	AMY2	55	32
O=C(CCCOc1ccc2c(c1)OCO2)OCCOC(F)F	ZINC000853904959	DE	On-Demand	Anodyne	EDNRB	40	42
O=C(CCCOc1ccc2c(c1)OCO2)OCCOC(F)F	ZINC000853904959	DE	On-Demand	Anodyne	EDNRA	43	42
O=C(CCCOc1ccc2c(c1)OCO2)OCCOC(F)F	ZINC000853904959	DE	On-Demand	Anodyne	LTB4R2	25	40
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	F2	42	34
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	ACE	54	46
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	FKBP1A	115	53
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	CELA1	29	57
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	ELANE	33	42
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	TRY1_BOVIN	58	34
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	CTSG	43	34
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	PREP	96	57
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	AMY2	43	29
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	CELA2A	51	34
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	LGMN	89	52
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	ACE2	24	49
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	KLK5	40	58
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	SLC12A5	64	37
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853904967	EF	On-Demand	Anodyne	TMPRSS11D	53	36
Cc1nc(NCC2CCC(O)CC2)nc(NCC2CCC(O)CC2)n1	ZINC000853904992	EE	On-Demand	Anodyne	VCP	51	40
CCNc1nc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905018	GF	On-Demand	Anodyne	PROKR1	53	32
CCNc1nc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905018	GF	On-Demand	Anodyne	TRPC6	42	43
CCNc1nc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905018	GF	On-Demand	Anodyne	TRPC3	34	43
CCNc1nc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905019	GF	On-Demand	Anodyne	PROKR1	53	32
CCNc1nc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905019	GF	On-Demand	Anodyne	TRPC6	42	43
CCNc1nc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905019	GF	On-Demand	Anodyne	TRPC3	34	43
CCNc1nc(C)c(C(=O)OCCOC(F)F)s1	ZINC000853905063	CE	On-Demand	Anodyne	DHODH	15	41
COc1ccc2c(NCC3CCC(O)CC3)ccnc2c1	ZINC000853905076	CG	On-Demand	Anodyne	HRP1_PLAFA	113	47
COc1ccc2c(NCC3CCC(O)CC3)ccnc2c1	ZINC000853905076	CG	On-Demand	Anodyne	FGFR2	42	39
COc1ccc2c(NCC3CCC(O)CC3)ccnc2c1	ZINC000853905076	CG	On-Demand	Anodyne	KDR	47	42
COc1ccc2c(NCC3CCC(O)CC3)ccnc2c1	ZINC000853905076	CG	On-Demand	Anodyne	HNMT	60	35
COc1ccc2c(NCC3CCC(O)CC3)ccnc2c1	ZINC000853905076	CG	On-Demand	Anodyne	PDGFRA	48	39
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC1CCC(O)CC1	ZINC000853905106	CE	On-Demand	Bother	PRKCQ	27	41
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC1CCC(O)CC1	ZINC000853905106	CE	On-Demand	Bother	VCP	16	41
O=C(OCCOC(F)F)c1cccc(OCC(F)(F)F)c1	ZINC000853905148	DG	On-Demand	Anodyne	PDS	41	39
CNc1nc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905178	FE	On-Demand	Anodyne	MMP1	16	42
CNc1nc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905178	FE	On-Demand	Anodyne	TRPC6	41	43
CNc1nc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905178	FE	On-Demand	Anodyne	TRPC3	33	43
CNc1nc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905179	FE	On-Demand	Anodyne	MMP1	16	42
CNc1nc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905179	FE	On-Demand	Anodyne	TRPC6	41	43
CNc1nc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cs1	ZINC000853905179	FE	On-Demand	Anodyne	TRPC3	33	43
Cc1cc(OCC(=O)OCCOC(F)F)cc(C)c1Cl	ZINC000853905190	DG	On-Demand	Anodyne	MCL1	28	40
O=C(CCC(=O)N1CCN(c2ccccc2)CC1)OCCOC(F)F	ZINC000853905192	FD	On-Demand	Anodyne	SSTR1	40	40
CC(C)c1cccc(COC(=O)CNC(=O)c2cccnc2)c1	ZINC000853905219	DF	On-Demand	Anodyne	TBXAS1	47	40
CC(C)c1cccc(COC(=O)CNC(=O)c2cccnc2)c1	ZINC000853905219	DF	On-Demand	Anodyne	PTAFR	27	40
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853905220	GH	On-Demand	Anodyne	HCRTR2	15	44
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853905221	GH	On-Demand	Anodyne	HCRTR2	15	44
O=C(CSc1nnc(-c2ccco2)n1Cc1ccco1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853905222	GH	On-Demand	Anodyne	HCRTR2	15	44
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1CCC(O)CC1	ZINC000853905253	CF	On-Demand	Bother	VCP	37	44
O=C(OCCOC(F)F)c1c[nH]c2ccc(F)cc12	ZINC000853905254	CF	On-Demand	Anodyne	SLC6A4	15	44
O=C(OCCOC(F)F)c1c[nH]c2ccc(F)cc12	ZINC000853905254	CF	On-Demand	Anodyne	MPO	96	48
C#CCOCCOC(=O)COc1ccc(OC)c(C)c1	ZINC000853905269	CD	On-Demand	Mild	PPARD	38	40
C#CCOCCOC(=O)COc1ccc(OC)c(C)c1	ZINC000853905269	CD	On-Demand	Mild	PLA2G4B	67	40
CCc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905280	FG	On-Demand	Anodyne	SIGMAR1	22	44
CCc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905280	FG	On-Demand	Anodyne	MMP1	26	43
CCc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905281	FG	On-Demand	Anodyne	SIGMAR1	22	44
CCc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905281	FG	On-Demand	Anodyne	MMP1	26	43
C#CCNc1nc(NCC2CCC(O)CC2)nc(NCC2CCC(O)CC2)n1	ZINC000853905300	GD	On-Demand	Mild	VCP	57	38
O=C(Cc1ccc(F)cc1Cl)OCCOC(F)F	ZINC000853905304	CF	On-Demand	Anodyne	P2RX7	46	38
CCNc1ncc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)s1	ZINC000853905332	GF	On-Demand	Anodyne	PROKR1	53	32
CCNc1ncc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)s1	ZINC000853905333	GF	On-Demand	Anodyne	PROKR1	53	32
O=C(CCCOc1ccc2c(c1)CCC2)OCCOC(F)F	ZINC000853905343	DG	On-Demand	Anodyne	PPARG	15	46
O=C(CCCOc1ccc2c(c1)CCC2)OCCOC(F)F	ZINC000853905343	DG	On-Demand	Anodyne	PPARA	15	47
CCNc1nc(C)c(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)s1	ZINC000853905344	GF	On-Demand	Anodyne	PROKR1	47	32
CCNc1nc(C)c(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)s1	ZINC000853905345	GF	On-Demand	Anodyne	PROKR1	47	32
C[C@H](CC(=O)OCCOC(F)F)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000853905366	FG	On-Demand	Anodyne	GPR119	29	46
COC(=O)c1cccc(NCC2CCC(O)CC2)n1	ZINC000853905369	CD	On-Demand	Anodyne	VCP	60	39
O=C(CCC(=O)N1CCN(c2ccccn2)CC1)OCCOC(F)F	ZINC000853905408	FD	On-Demand	Anodyne	DRD4	24	41
OC1CCC(CNc2cc(OCc3ccccc3)ncn2)CC1	ZINC000853905465	DG	On-Demand	Anodyne	GRIN2B	18	44
OC1CCC(CNc2cc(OCc3ccccc3)ncn2)CC1	ZINC000853905465	DG	On-Demand	Anodyne	VCP	61	36
CN1C(=O)CCc2cc(C(=O)OCc3nnc4n3CCOCC4)ccc21	ZINC000853905492	FD	On-Demand	Anodyne	SRD5A1	18	42
COC(=O)c1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905516	GE	On-Demand	Anodyne	F10	17	46
COC(=O)c1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905516	GE	On-Demand	Anodyne	SIGMAR1	21	43
COC(=O)c1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905516	GE	On-Demand	Anodyne	TRY2_BOVIN	23	45
COC(=O)c1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905516	GE	On-Demand	Anodyne	MMP1	19	44
COC(=O)c1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905517	GE	On-Demand	Anodyne	F10	17	46
COC(=O)c1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905517	GE	On-Demand	Anodyne	SIGMAR1	21	43
COC(=O)c1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905517	GE	On-Demand	Anodyne	TRY2_BOVIN	23	45
COC(=O)c1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853905517	GE	On-Demand	Anodyne	MMP1	19	44
O=[N+]([O-])c1ccc(N(CCN2CCOCC2)CC2CC2)c(F)c1	ZINC000853905561	DE	On-Demand	Bother	KCNJ1	20	42
C#CCOCCOC(=O)C(C)(C)C1CCCC1	ZINC000853905563	BE	On-Demand	Mild	AMY2	52	36
COC(=O)c1ccc(CNc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)c(F)c1	ZINC000853905609	GG	On-Demand	Bother	CACNA1D	55	33
COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853905638	GF	On-Demand	Bother	CACNA1C	40	34
COCCSc1ccc([N+](=O)[O-])cc1C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853905638	GF	On-Demand	Bother	CACNA1D	62	33
CC(C)(C(=O)OCCOC(F)F)C1CCCC1	ZINC000853905736	CF	On-Demand	Anodyne	AMY2	58	40
CCC(=O)N1CC[C@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853905792	DG	On-Demand	Anodyne	TRY2_BOVIN	32	42
CCC(=O)N1CC[C@@H](C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853905793	DG	On-Demand	Anodyne	TRY2_BOVIN	32	42
O=C(/C=C/c1ccc(O)c(O)c1)OCCOC(F)F	ZINC000853905827	CD	On-Demand	Clean	AKR1B10	36	45
O=C(/C=C\c1ccc(O)c(O)c1)OCCOC(F)F	ZINC000853905828	CD	On-Demand	Clean	AKR1B10	36	45
O=CNc1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1	ZINC000853905852	CE	On-Demand	Anodyne	ACR	47	31
O=CNc1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1	ZINC000853905853	CE	On-Demand	Anodyne	ACR	47	31
O=CNc1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1	ZINC000853905854	CE	On-Demand	Anodyne	ACR	47	31
O=C(Cc1ccc(OCc2ccccn2)cc1)OCCOC(F)F	ZINC000853905871	EF	On-Demand	Anodyne	FFAR4	40	34
CC(C)(C(=O)OCCOC(F)F)C1CCCCC1	ZINC000853905906	CG	On-Demand	Anodyne	AMY2	61	42
CCCCS(=O)(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905914	GD	On-Demand	Anodyne	MMP13	66	44
CCCCS(=O)(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905914	GD	On-Demand	Anodyne	ADAM17	28	44
CCCCS(=O)(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905914	GD	On-Demand	Anodyne	MMP3	57	39
CCCCS(=O)(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905914	GD	On-Demand	Anodyne	MMP9	45	44
CCCCS(=O)(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905914	GD	On-Demand	Anodyne	MMP7	54	39
CCCCS(=O)(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905914	GD	On-Demand	Anodyne	MMP1	58	45
CCCCS(=O)(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905915	GD	On-Demand	Anodyne	MMP13	66	44
CCCCS(=O)(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905915	GD	On-Demand	Anodyne	ADAM17	28	44
CCCCS(=O)(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905915	GD	On-Demand	Anodyne	MMP3	57	39
CCCCS(=O)(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905915	GD	On-Demand	Anodyne	MMP9	45	44
CCCCS(=O)(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905915	GD	On-Demand	Anodyne	MMP7	54	39
CCCCS(=O)(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853905915	GD	On-Demand	Anodyne	MMP1	58	45
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1SCCO	ZINC000853905940	EF	On-Demand	Bother	CACNA1D	44	38
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc([N+](=O)[O-])ccc1SCCO	ZINC000853905941	EF	On-Demand	Bother	CACNA1D	44	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc([N+](=O)[O-])ccc1SCCO	ZINC000853905942	EF	On-Demand	Bother	CACNA1D	44	38
C[C@@H](Sc1nc2ccccc2s1)C(=O)OCCOC(F)F	ZINC000853905958	EH	On-Demand	Anodyne	PPXI	30	41
C[C@H](Sc1nc2ccccc2s1)C(=O)OCCOC(F)F	ZINC000853905959	EH	On-Demand	Anodyne	PPXI	30	41
COC(=O)c1ccc(CNc2ncc3c(n2)CCCC3)c(F)c1	ZINC000853905961	DF	On-Demand	Anodyne	BDKRB1	28	40
O=[N+]([O-])c1ccc(N(CCN2CCOCC2)CC2CC2)cc1	ZINC000853905975	DE	On-Demand	Bother	KCNJ1	26	49
CC(C)c1cccc(COC(=O)C[C@](C)(O)C2CC2)c1	ZINC000853905990	CG	On-Demand	Anodyne	AMY2	48	33
CC(C)c1cccc(COC(=O)C[C@@](C)(O)C2CC2)c1	ZINC000853905991	CG	On-Demand	Anodyne	AMY2	48	33
CN1C(=O)CCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853906032	CD	On-Demand	Anodyne	SRD5A1	23	47
C#CCOCCOC(=O)c1cc(OC)c(N)cc1F	ZINC000853906037	CD	On-Demand	Mild	HTR4	28	40
O=[N+]([O-])c1ccc(N(CCN2CCOCC2)CC2CC2)c([N+](=O)[O-])c1	ZINC000853906089	FE	On-Demand	Bother	KCNJ1	21	43
CCC(=O)N1CC[C@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853906106	FD	On-Demand	Anodyne	MMP1	21	43
CCC(=O)N1CC[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853906107	FD	On-Demand	Anodyne	MMP1	21	43
CCC(=O)N1CC[C@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853906108	FD	On-Demand	Anodyne	MMP1	21	43
CCC(=O)N1CC[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000853906109	FD	On-Demand	Anodyne	MMP1	21	43
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)OCCOC(F)F)c1	ZINC000853906129	ED	On-Demand	Anodyne	CA2	19	42
NS(=O)(=O)c1cc(Cl)c(F)c(C(=O)OCCOC(F)F)c1	ZINC000853906129	ED	On-Demand	Anodyne	CA4	21	42
C#CCNC(=O)c1ccc(NCC2CCC(O)CC2)nc1	ZINC000853906150	CD	On-Demand	Mild	IKBKB	20	45
C#CCNC(=O)c1ccc(NCC2CCC(O)CC2)nc1	ZINC000853906150	CD	On-Demand	Mild	CACNA1I	41	33
Cc1c(CC(=O)OCCOC(F)F)cccc1[N+](=O)[O-]	ZINC000853906164	CE	On-Demand	Bother	COLA	97	35
O=[N+]([O-])c1ccc2nc(NCC3CCC(O)CC3)sc2c1	ZINC000853906186	DG	On-Demand	Bother	VCP	27	45
CNS(=O)(=O)CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853906198	FC	On-Demand	Anodyne	MMP13	48	39
CNS(=O)(=O)CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853906198	FC	On-Demand	Anodyne	MMP1	46	46
CNS(=O)(=O)CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853906200	FC	On-Demand	Anodyne	MMP13	48	39
CNS(=O)(=O)CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853906200	FC	On-Demand	Anodyne	MMP1	46	46
C#CCOCCOC(=O)C1(OCc2ccccc2)CCOCC1	ZINC000853906207	DD	On-Demand	Mild	SLC12A5	51	32
O=C(OCC1C[C@@H]2C[C@H]2C1)c1ccc(=O)n(-c2ccccc2F)n1	ZINC000853906221	EF	On-Demand	Anodyne	CTSA	41	38
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccc(=O)n(-c2ccccc2F)n1	ZINC000853906223	EF	On-Demand	Anodyne	CTSA	41	38
O=C(OCC1C[C@H]2C[C@@H]2C1)c1ccc(=O)n(-c2ccccc2F)n1	ZINC000853906224	EF	On-Demand	Anodyne	CTSA	41	38
COC(=O)c1ccc(CNc2ccnc(C(C)C)n2)c(F)c1	ZINC000853906252	DG	On-Demand	Anodyne	BDKRB1	30	44
CC(C)c1cccc(COC(=O)C2(O)CCSCC2)c1	ZINC000853906268	CG	On-Demand	Anodyne	SLC12A5	61	34
Cc1c(C(=O)OCCOC(F)F)cccc1S(N)(=O)=O	ZINC000853906288	DD	On-Demand	Anodyne	CA2	15	44
C[C@@H](CCCc1ccccc1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853906456	EF	On-Demand	Anodyne	GHRHR	42	35
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	HRH2	30	41
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	LTA4H	19	41
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	HCRTR1	18	44
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	HRH3	15	40
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	SIGMAR1	22	43
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	MMP13	30	42
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	PLA2G4B	36	40
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	MMP9	15	42
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	HCRTR2	16	44
CCCOc1cccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906488	GG	On-Demand	Anodyne	MMP1	18	40
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	HRH2	30	41
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	LTA4H	19	41
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	HCRTR1	18	44
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	HRH3	15	40
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	SIGMAR1	22	43
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	MMP13	30	42
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	PLA2G4B	36	40
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	MMP9	15	42
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	HCRTR2	16	44
CCCOc1cccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853906489	GG	On-Demand	Anodyne	MMP1	18	40
CCOc1ccccc1C(F)(F)C(=O)OCCOC(F)F	ZINC000853906521	DF	On-Demand	Anodyne	AMY2	57	33
CCOc1ccccc1C(F)(F)C(=O)OCCOC(F)F	ZINC000853906521	DF	On-Demand	Anodyne	KCNK3	24	40
CCOc1ccccc1C(F)(F)C(=O)OCCOC(F)F	ZINC000853906521	DF	On-Demand	Anodyne	KCNK9	22	40
COC(=O)c1ccc(CNc2nnc(C)cc2C(F)(F)F)c(F)c1	ZINC000853906522	EG	On-Demand	Anodyne	BDKRB1	28	40
O=CNc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853906566	CD	On-Demand	Anodyne	ACR	51	33
CNC(=O)COc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853906605	DD	On-Demand	Anodyne	UPP1	59	35
CNC(=O)COc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853906605	DD	On-Demand	Anodyne	PLA2G4B	34	43
CNC(=O)COc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853906605	DD	On-Demand	Anodyne	PDS	59	36
O=C(OCCOC(F)F)[C@H](c1ccccc1)C1CC1	ZINC000853906608	CF	On-Demand	Anodyne	SLC6A3	28	40
O=C(OCCOC(F)F)[C@H](c1ccccc1)C1CC1	ZINC000853906608	CF	On-Demand	Anodyne	AMY2	46	32
O=C(OCCOC(F)F)[C@@H](c1ccccc1)C1CC1	ZINC000853906610	CF	On-Demand	Anodyne	SLC6A3	28	40
O=C(OCCOC(F)F)[C@@H](c1ccccc1)C1CC1	ZINC000853906610	CF	On-Demand	Anodyne	AMY2	46	32
OC1CCC(CNc2nccc(N3CCCC3)n2)CC1	ZINC000853906613	CE	On-Demand	Anodyne	GRIN2B	20	40
OC1CCC(CNc2nccc(N3CCCC3)n2)CC1	ZINC000853906613	CE	On-Demand	Anodyne	MAPK9	19	40
OC1CCC(CNc2nccc(N3CCCC3)n2)CC1	ZINC000853906613	CE	On-Demand	Anodyne	SORD	52	38
OC1CCC(CNc2nccc(N3CCCC3)n2)CC1	ZINC000853906613	CE	On-Demand	Anodyne	MAPK8	20	40
OC1CCC(CNc2nccc(N3CCCC3)n2)CC1	ZINC000853906613	CE	On-Demand	Anodyne	MERTK	42	33
OC1CCC(CNc2nccc(N3CCCC3)n2)CC1	ZINC000853906613	CE	On-Demand	Anodyne	VCP	60	40
CC(C)c1cccc(COC(=O)C[C@H](O)C(C)C)c1	ZINC000853906623	CG	On-Demand	Anodyne	PGA	18	40
CC(C)c1cccc(COC(=O)C[C@@H](O)C(C)C)c1	ZINC000853906624	CG	On-Demand	Anodyne	PGA	18	40
O=C(Cc1cccc(OCC(F)(F)F)c1)OCCOC(F)F	ZINC000853906636	EF	On-Demand	Anodyne	NR1H3	18	42
O=C(Cc1cccc(OCC(F)(F)F)c1)OCCOC(F)F	ZINC000853906636	EF	On-Demand	Anodyne	PDS	56	42
COC(=O)c1ccc(CNc2nccc(N(C)C)n2)c(F)c1	ZINC000853906663	DE	On-Demand	Anodyne	BDKRB1	29	41
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CTSB	40	36
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	PAPA1_CARPA	57	42
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CCKAR	46	38
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CTSK	35	41
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CTSL	31	42
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	TACR3	15	40
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CAPNS1	54	32
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	REN	53	44
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CTSS	17	42
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CAPN1	58	38
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	CAPN2	87	36
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	KLK5	23	43
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	FPR1	53	41
CC(C)c1cccc(COC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906742	FF	On-Demand	Anodyne	PSMB5	15	41
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CTSB	40	36
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	PAPA1_CARPA	57	42
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CCKAR	46	38
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CTSK	35	41
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CTSL	31	42
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	TACR3	15	40
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CAPNS1	54	32
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	REN	53	44
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CTSS	17	42
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CAPN1	58	38
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	CAPN2	87	36
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	KLK5	23	43
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	FPR1	53	41
CC(C)c1cccc(COC(=O)[C@@H](CC(N)=O)NC(=O)OC(C)(C)C)c1	ZINC000853906743	FF	On-Demand	Anodyne	PSMB5	15	41
CC(C)c1cccc(COC(=O)CCc2ccc(N)nc2)c1	ZINC000853906757	CG	On-Demand	Anodyne	FFAR1	32	41
C#CCOCCOC(=O)[C@H]1CCCCN1C(=O)c1cc(C)cc(C)c1	ZINC000853906789	EE	On-Demand	Mild	FKBP1A	70	40
C#CCOCCOC(=O)[C@H]1CCCCN1C(=O)c1cc(C)cc(C)c1	ZINC000853906789	EE	On-Demand	Mild	PREP	50	41
C#CCOCCOC(=O)[C@@H]1CCCCN1C(=O)c1cc(C)cc(C)c1	ZINC000853906790	EE	On-Demand	Mild	FKBP1A	70	40
C#CCOCCOC(=O)[C@@H]1CCCCN1C(=O)c1cc(C)cc(C)c1	ZINC000853906790	EE	On-Demand	Mild	PREP	50	41
COc1ccc(-n2nc(C(=O)OCCOC(F)F)cc2C)cc1	ZINC000853906802	EF	On-Demand	Anodyne	RPA1	17	41
COC(=O)c1c(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)sc(C)c1C	ZINC000853906809	IF	On-Demand	Anodyne	CA2	40	43
COC(=O)c1c(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)sc(C)c1C	ZINC000853906809	IF	On-Demand	Anodyne	CA1	31	40
COC(=O)c1c(NC(=O)c2cc(S(N)(=O)=O)ccc2Br)sc(C)c1C	ZINC000853906809	IF	On-Demand	Anodyne	CA4	33	40
COC(=O)c1ccc(CNc2nccc(N3CCCC3)n2)c(F)c1	ZINC000853906893	EF	On-Demand	Anodyne	BDKRB1	28	45
COC(=O)c1ccc(CNc2nccc(N3CCCC3)n2)c(F)c1	ZINC000853906893	EF	On-Demand	Anodyne	GALR2	43	35
COC(=O)c1ccc(CNc2nccc(N3CCCC3)n2)c(F)c1	ZINC000853906893	EF	On-Demand	Anodyne	MRGPRX1	40	35
C[C@@H](C(=O)OCCOC(F)F)c1cccc(C(=O)c2ccccc2)c1	ZINC000853906895	EH	On-Demand	Anodyne	PTGS1	16	60
C[C@H](C(=O)OCCOC(F)F)c1cccc(C(=O)c2ccccc2)c1	ZINC000853906896	EH	On-Demand	Anodyne	PTGS1	16	60
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853906906	GG	On-Demand	Reactive	CSNK1D	26	40
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853906907	GG	On-Demand	Reactive	CSNK1D	26	40
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853906908	GG	On-Demand	Reactive	CSNK1D	26	40
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853906909	GG	On-Demand	Reactive	CSNK1D	26	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCc2cnc(C3CC3)nc2)C1	ZINC000853906910	GF	On-Demand	Anodyne	GPR119	26	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCc2cnc(C3CC3)nc2)C1	ZINC000853906911	GF	On-Demand	Anodyne	GPR119	26	41
O=C(OCCOC(F)F)c1cc(N2CCCC2=O)ccc1Cl	ZINC000853906912	EF	On-Demand	Anodyne	Q9FYV8_MAIZE	53	48
CC(C)(C)OC(=O)N1CCC(CCC(=O)OCCOC(F)F)CC1	ZINC000853906936	FG	On-Demand	Anodyne	GPR119	31	42
COC(=O)c1ccc(CNc2cc(C)nc(C(C)C)n2)c(F)c1	ZINC000853906938	DG	On-Demand	Anodyne	BDKRB1	31	40
CC(C)c1cccc(COC(=O)Cc2cccc(OCC#N)c2)c1	ZINC000853906939	DH	On-Demand	Mild	MAOB	16	42
C#CCOCCOC(=O)/C=C/c1ccc(O)c(OCC)c1	ZINC000853906955	CD	On-Demand	Mild	AKR1C3	15	41
C#CCOCCOC(=O)/C=C\c1ccc(O)c(OCC)c1	ZINC000853906956	CD	On-Demand	Mild	AKR1C3	15	41
N#Cc1cc([N+](=O)[O-])ccc1N(CCN1CCOCC1)CC1CC1	ZINC000853906991	EE	On-Demand	Mild	KCNJ1	21	42
O=C(CCCNC(=O)c1cccnc1)OCCOC(F)F	ZINC000853906994	DD	On-Demand	Anodyne	TBXAS1	58	42
O=C(CCCNC(=O)c1cccnc1)OCCOC(F)F	ZINC000853906994	DD	On-Demand	Anodyne	PTAFR	17	42
CC(C)(C)OC(=O)N1CCC(C(=O)OCCOC(F)F)(c2ccccc2)CC1	ZINC000853907017	GH	On-Demand	Anodyne	GHRHR	56	32
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)C1(OCc2ccccc2)CCOCC1	ZINC000853907022	EG	On-Demand	Anodyne	SLC12A5	56	35
O=C(OCC1C[C@@H]2C[C@H]2C1)C1(OCc2ccccc2)CCOCC1	ZINC000853907023	EG	On-Demand	Anodyne	SLC12A5	56	35
O=C(OCC1C[C@H]2C[C@@H]2C1)C1(OCc2ccccc2)CCOCC1	ZINC000853907024	EG	On-Demand	Anodyne	SLC12A5	56	35
CNC(=O)COc1cccc(CC(=O)OCc2cccc(C(C)C)c2)c1	ZINC000853907045	FG	On-Demand	Anodyne	UPP1	51	35
CNC(=O)COc1cccc(CC(=O)OCc2cccc(C(C)C)c2)c1	ZINC000853907045	FG	On-Demand	Anodyne	PDS	28	40
c1cncc(-c2nc(N(CCN3CCOCC3)CC3CC3)c3ccccc3n2)c1	ZINC000853907050	GG	On-Demand	Anodyne	CASR	23	40
OC1CCC(CNc2cc3ccccc3c(Cl)n2)CC1	ZINC000853907059	CH	On-Demand	Anodyne	VCP	62	38
O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NCC1CCC(O)CC1	ZINC000853907061	EE	On-Demand	Bother	VCP	22	42
CC(C)c1cccc(COC(=O)[C@@H](C)NS(C)(=O)=O)c1	ZINC000853907124	CD	On-Demand	Anodyne	CAPN2	49	36
CC(C)c1cccc(COC(=O)[C@H](C)NS(C)(=O)=O)c1	ZINC000853907125	CD	On-Demand	Anodyne	CAPN2	49	36
O=C(/C=C/c1ccc(Cl)nc1)OCCOC(F)F	ZINC000853907151	CF	On-Demand	Anodyne	AKR1B10	23	40
O=C(/C=C\c1ccc(Cl)nc1)OCCOC(F)F	ZINC000853907152	CF	On-Demand	Anodyne	AKR1B10	23	40
O=C(OCCOC(F)F)c1ccccc1OC(F)(F)F	ZINC000853907186	DF	On-Demand	Anodyne	KCNK3	15	42
O=C(OCCOC(F)F)c1ccccc1OC(F)(F)F	ZINC000853907186	DF	On-Demand	Anodyne	KCNK9	22	42
COC[C@@H](O)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853907345	DC	On-Demand	Anodyne	MMP1	17	44
COC[C@@H](O)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853907345	DC	On-Demand	Anodyne	PROKR1	52	31
COC[C@@H](O)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853907347	DC	On-Demand	Anodyne	MMP1	17	44
COC[C@@H](O)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853907347	DC	On-Demand	Anodyne	PROKR1	52	31
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853907360	EE	On-Demand	Reactive	CCR3	35	43
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853907361	EE	On-Demand	Reactive	CCR3	35	43
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853907362	EE	On-Demand	Reactive	CCR3	35	43
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)NNc1ccc(C)c(F)c1	ZINC000853907363	EE	On-Demand	Reactive	CCR3	35	43
CC(C)c1cccc(COC(=O)CCCNC(=O)c2cccnc2)c1	ZINC000853907431	EG	On-Demand	Anodyne	TBXAS1	67	45
CC(C)c1cccc(COC(=O)CCCNC(=O)c2cccnc2)c1	ZINC000853907431	EG	On-Demand	Anodyne	PTAFR	29	45
CC(C)c1cccc(COC(=O)[C@@H]2CCCCO2)c1	ZINC000853907455	CG	On-Demand	Anodyne	AMY2	44	30
CC(C)c1cccc(COC(=O)[C@H]2CCCCO2)c1	ZINC000853907457	CG	On-Demand	Anodyne	AMY2	44	30
C#CCOCCOC(=O)COc1cccc(C(=O)NC)c1	ZINC000853907496	CC	On-Demand	Mild	PLA2G4B	30	41
CCC(=O)c1ccc(N(CCN2CCOCC2)CC2CC2)c([N+](=O)[O-])c1	ZINC000853907508	FF	On-Demand	Bother	CASR	20	40
CC[C@]1(C(=O)OCc2onc(C)c2[N+](=O)[O-])CCCN1C(=O)OC(C)(C)C	ZINC000853907576	GG	On-Demand	Bother	SLC12A5	51	35
CC[C@]1(C(=O)OCCOC(F)F)CCCN1C(=O)OC(C)(C)C	ZINC000853907691	EF	On-Demand	Anodyne	SLC12A5	42	35
COC(=O)c1ccc(CNc2nccc3c2C(=O)OC3(C)C)c(F)c1	ZINC000853907695	EG	On-Demand	Anodyne	BDKRB1	37	43
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1SCCO	ZINC000853907718	EE	On-Demand	Bother	CACNA1D	48	34
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)nc1	ZINC000853907719	CB	On-Demand	Mild	CA4	19	42
O=C(OCCOC(F)F)C(F)(F)c1ccccc1F	ZINC000853907722	CF	On-Demand	Anodyne	AMY2	53	31
COC(=O)c1cccc(CC(=O)OCc2onc(C)c2[N+](=O)[O-])c1	ZINC000853907821	ED	On-Demand	Bother	CACNA1D	57	36
C#CCOCCOC(=O)[C@H]1CCCCN1C(C)=O	ZINC000853907828	CC	On-Demand	Mild	FKBP1A	63	44
C#CCOCCOC(=O)[C@@H]1CCCCN1C(C)=O	ZINC000853907829	CC	On-Demand	Mild	FKBP1A	63	44
OC1CCC(CNc2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853907864	EH	On-Demand	Anodyne	MERTK	15	40
OC1CCC(CNc2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853907864	EH	On-Demand	Anodyne	VCP	48	41
NC(=O)c1cc(Cl)nnc1NCC1CCC(O)CC1	ZINC000853907865	CD	On-Demand	Anodyne	VCP	45	34
C#CCOCCOC(=O)c1cc2cc(OC)ccc2nc1Cl	ZINC000853907901	DF	On-Demand	Mild	CYSP_PLAFA	38	44
O=C(OCCOC(F)F)C1(OCc2ccccc2)CCOCC1	ZINC000853907910	EF	On-Demand	Anodyne	SLC12A5	58	33
OC1CCC(CNc2nn3cc(-c4ccccc4)nc3s2)CC1	ZINC000853907921	EG	On-Demand	Anodyne	VCP	68	43
O=C(Cc1cccc(OC(F)(F)F)c1)OCCOC(F)F	ZINC000853907923	DF	On-Demand	Anodyne	PDS	41	37
COC(=O)c1ccc(CNc2ccc(S(=O)(=O)NC(C)(C)C)cn2)c(F)c1	ZINC000853908009	GF	On-Demand	Anodyne	BDKRB1	31	45
COC(=O)c1ccc(CNc2ccc(S(=O)(=O)N(C)C)cn2)c(F)c1	ZINC000853908065	FD	On-Demand	Anodyne	BDKRB1	30	46
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853908090	FD	On-Demand	Anodyne	EPHX2	19	43
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853908091	FD	On-Demand	Anodyne	EPHX2	19	43
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853908092	FD	On-Demand	Anodyne	EPHX2	19	43
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)N1CCC(NC(=O)OC)CC1	ZINC000853908093	FD	On-Demand	Anodyne	EPHX2	19	43
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	GHRHR	41	34
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	ANPEP	40	35
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	CTSK	26	43
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	MMP3	41	39
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	FAAH	44	37
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	CES1	45	36
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	CAPN2	46	36
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	LAP3	48	36
C[C@@H](CCCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908174	CG	On-Demand	Anodyne	CRTM	42	38
COC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908185	FD	On-Demand	Anodyne	MMP13	46	38
COC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908185	FD	On-Demand	Anodyne	MMP3	40	38
COC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908185	FD	On-Demand	Anodyne	MMP1	47	45
COC(=O)N[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908185	FD	On-Demand	Anodyne	PROKR1	58	31
COC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908187	FD	On-Demand	Anodyne	MMP13	46	38
COC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908187	FD	On-Demand	Anodyne	MMP3	40	38
COC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908187	FD	On-Demand	Anodyne	MMP1	47	45
COC(=O)N[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908187	FD	On-Demand	Anodyne	PROKR1	58	31
C[C@H](CSCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908226	DG	On-Demand	Anodyne	ACE	18	47
C[C@H](CSCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908226	DG	On-Demand	Anodyne	CACNA2D1	18	49
C[C@H](CSCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908226	DG	On-Demand	Anodyne	MME	15	47
C[C@H](CSCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908226	DG	On-Demand	Anodyne	LTA4H	17	42
C[C@H](CSCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908226	DG	On-Demand	Anodyne	CTSK	18	40
C[C@H](CSCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908226	DG	On-Demand	Anodyne	CAPN2	62	38
C[C@H](CSCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853908226	DG	On-Demand	Anodyne	PDS	40	32
Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)OCCOC(F)F)c1	ZINC000853908293	FG	On-Demand	Anodyne	FKBP1A	79	41
Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C(=O)OCCOC(F)F)c1	ZINC000853908293	FG	On-Demand	Anodyne	PREP	41	42
Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)OCCOC(F)F)c1	ZINC000853908297	FG	On-Demand	Anodyne	FKBP1A	79	41
Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C(=O)OCCOC(F)F)c1	ZINC000853908297	FG	On-Demand	Anodyne	PREP	41	42
COC(=O)c1ccc(CNc2nccc(C(C)(C)C)n2)c(F)c1	ZINC000853908309	DG	On-Demand	Anodyne	BDKRB1	32	43
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)nc1	ZINC000853908325	CC	On-Demand	Anodyne	CA2	69	44
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)nc1	ZINC000853908325	CC	On-Demand	Anodyne	CA1	56	39
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)nc1	ZINC000853908325	CC	On-Demand	Anodyne	CA7	53	39
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)nc1	ZINC000853908325	CC	On-Demand	Anodyne	CA4	50	44
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)nc1	ZINC000853908325	CC	On-Demand	Anodyne	CA12	44	39
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)nc1	ZINC000853908325	CC	On-Demand	Anodyne	CA9	43	39
CC(C)c1cccc(COC(=O)C(C)(C)F)c1	ZINC000853908352	BH	On-Demand	Anodyne	AMY2	51	30
N#Cc1cc(S(N)(=O)=O)ccc1NCC1CCC(O)CC1	ZINC000853908368	DD	On-Demand	Mild	CA2	30	40
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	KLK3	41	34
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	CTSB	52	40
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	PAPA1_CARPA	51	34
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	CYSP_TRYCR	40	35
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	CTSK	24	40
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	CTSL	25	40
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	CAPNS1	58	35
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	CAPN1	71	40
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	CAPN2	109	37
COC(=O)N[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853908461	CF	On-Demand	Anodyne	NPR	65	33
CC(C)(C(=O)OCCOC(F)F)c1cccnc1	ZINC000853908462	CE	On-Demand	Anodyne	AMY2	58	33
C[C@H](CSCc1ccccc1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853908494	FE	On-Demand	Anodyne	ACE	15	41
CCCOc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853908499	CF	On-Demand	Anodyne	UPP1	46	42
CCCOc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853908499	CF	On-Demand	Anodyne	PLA2G4B	46	47
CCCOc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853908499	CF	On-Demand	Anodyne	PDS	78	37
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CA2	37	41
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CA1	28	41
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CA4	34	41
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CA14	19	40
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CA12	24	40
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CA9	22	40
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CAH_METTE	21	40
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	NCE103	17	40
NS(=O)(=O)c1ccc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c(F)c1	ZINC000853908587	DD	On-Demand	Anodyne	CA15	16	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CA2	37	41
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CA1	28	41
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CA4	34	41
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CA14	19	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CA12	24	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CA9	22	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CAH_METTE	21	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	NCE103	17	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c(F)c1	ZINC000853908588	DD	On-Demand	Anodyne	CA15	16	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CA2	37	41
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CA1	28	41
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CA4	34	41
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CA14	19	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CA12	24	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CA9	22	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CAH_METTE	21	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	NCE103	17	40
NS(=O)(=O)c1ccc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c(F)c1	ZINC000853908589	DD	On-Demand	Anodyne	CA15	16	40
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	CA2	44	52
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	CA1	35	43
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	CA7	28	43
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	CA4	45	43
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	CA12	22	52
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	CA9	22	43
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	CAH_METTE	22	40
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1F	ZINC000853908592	DC	On-Demand	Mild	NCE103	27	40
CC(C)c1cccc(COC(=O)c2ccc(S(N)(=O)=O)cn2)c1	ZINC000853908595	EE	On-Demand	Anodyne	CA2	40	38
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(OC)cc1	ZINC000853908645	GH	On-Demand	Anodyne	MMP1	17	43
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(OC)cc1	ZINC000853908646	GH	On-Demand	Anodyne	MMP1	17	43
CC[C@H]1CN(C(C)=O)CC[C@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853908653	EE	On-Demand	Reactive	CCR3	60	47
CC[C@@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853908654	EE	On-Demand	Reactive	CCR3	60	47
CC[C@@H]1CN(C(C)=O)CC[C@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853908655	EE	On-Demand	Reactive	CCR3	60	47
CC[C@H]1CN(C(C)=O)CC[C@@H]1NC(=O)NNc1cc(F)ccc1C	ZINC000853908656	EE	On-Demand	Reactive	CCR3	60	47
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	FKBP1A	16	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	LTA4H	26	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	HRH3	15	44
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	SIGMAR1	21	45
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	MMP13	43	39
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	ADAM17	19	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	MMP2	19	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	MMP3	36	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	MMP8	16	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	MMP9	33	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	MMP7	33	40
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	MMP1	41	48
COC(=O)C1CCC(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908674	GE	On-Demand	Anodyne	PROKR1	53	31
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	FKBP1A	16	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	LTA4H	26	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	HRH3	15	44
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	SIGMAR1	21	45
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	MMP13	43	39
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	ADAM17	19	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	MMP2	19	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	MMP3	36	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	MMP8	16	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	MMP9	33	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	MMP7	33	40
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	MMP1	41	48
COC(=O)C1CCC(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CC1	ZINC000853908675	GE	On-Demand	Anodyne	PROKR1	53	31
CN(C1CCCC1)C(C)(C)C(=O)OCCOC(F)F	ZINC000853908721	CE	On-Demand	Anodyne	AMY2	52	37
COC(=O)c1cncc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853908768	GD	On-Demand	Anodyne	MMP1	17	44
COC(=O)c1cncc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853908768	GD	On-Demand	Anodyne	PROKR1	61	33
COC(=O)c1cncc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853908769	GD	On-Demand	Anodyne	MMP1	17	44
COC(=O)c1cncc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853908769	GD	On-Demand	Anodyne	PROKR1	61	33
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cn1	ZINC000853908796	CB	On-Demand	Mild	CA2	24	50
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cn1	ZINC000853908796	CB	On-Demand	Mild	CA7	22	47
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA2	92	47
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA6	17	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA1	72	42
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA7	70	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA13	22	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA5B	47	39
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA4	74	47
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA5A	49	39
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA14	40	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA12	50	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA9	52	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CAH_METTE	40	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	NCE103	37	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	CA15	18	45
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	MTCA1	49	35
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	P96878_MYCTU	53	35
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)c(F)c1	ZINC000853908812	DC	On-Demand	Anodyne	A6YCJ1_9METZ	19	45
C[C@@H]1CCN(C(=O)N[C@H]2CN(C)Cc3ccccc32)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853908887	GE	On-Demand	Anodyne	RBP4	54	34
C[C@@H]1CCN(C(=O)N[C@@H]2CN(C)Cc3ccccc32)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853908888	GE	On-Demand	Anodyne	RBP4	54	34
CN1Cc2ccccc2[C@@H](NC(=O)N2CCC(N3CCOC3=O)CC2)C1	ZINC000853908917	FD	On-Demand	Anodyne	CALCRL	41	34
CN1Cc2ccccc2[C@H](NC(=O)N2CCC(N3CCOC3=O)CC2)C1	ZINC000853908918	FD	On-Demand	Anodyne	CALCRL	41	34
CC(C)(C)OC(=O)N1CCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853908927	FG	On-Demand	Anodyne	SRD5A1	17	44
CNC(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908951	DC	On-Demand	Anodyne	SIGMAR1	17	44
CNC(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908951	DC	On-Demand	Anodyne	MMP1	40	50
CNC(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908951	DC	On-Demand	Anodyne	PROKR1	52	31
CNC(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908952	DC	On-Demand	Anodyne	SIGMAR1	17	44
CNC(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908952	DC	On-Demand	Anodyne	MMP1	40	50
CNC(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853908952	DC	On-Demand	Anodyne	PROKR1	52	31
O=[N+]([O-])c1ccc(NC[C@]2(CO)COCCN2Cc2ccccc2)c2nonc12	ZINC000853908967	GD	On-Demand	Bother	GSTM2	110	41
O=[N+]([O-])c1ccc(NC[C@]2(CO)COCCN2Cc2ccccc2)c2nonc12	ZINC000853908967	GD	On-Demand	Bother	GSTP1	69	41
O=[N+]([O-])c1ccc(NC[C@@]2(CO)COCCN2Cc2ccccc2)c2nonc12	ZINC000853908968	GD	On-Demand	Bother	GSTM2	110	41
O=[N+]([O-])c1ccc(NC[C@@]2(CO)COCCN2Cc2ccccc2)c2nonc12	ZINC000853908968	GD	On-Demand	Bother	GSTP1	69	41
CC(C)(C(=O)OCCOC(F)F)N1C(=O)c2ccccc2C1=O	ZINC000853909011	ED	On-Demand	Anodyne	AMY2	57	33
C[C@@](O)(CC(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccccc1	ZINC000853909087	CF	On-Demand	Anodyne	AMY2	57	33
C[C@@](O)(CC(=O)OCCOC(F)F)c1ccccc1	ZINC000853909145	CE	On-Demand	Anodyne	AMY2	62	36
NC(=O)c1cc(Cl)nnc1NC[C@@]1(CO)COCCN1Cc1ccccc1	ZINC000853909154	GC	On-Demand	Anodyne	STAT6	72	38
NC(=O)c1cc(Cl)nnc1NC[C@]1(CO)COCCN1Cc1ccccc1	ZINC000853909155	GC	On-Demand	Anodyne	STAT6	72	38
CC(C)c1cccc(COC(=O)C2(CCO)CC2)c1	ZINC000853909218	CG	On-Demand	Anodyne	SLC12A5	62	33
CNC(=O)CCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909263	ED	On-Demand	Anodyne	MMP1	23	47
CNC(=O)CCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909264	ED	On-Demand	Anodyne	MMP1	23	47
C#CC[C@H](NC(=O)N1CCN(S(=O)(=O)NC)CC1)c1ccccc1	ZINC000853909318	FC	On-Demand	Mild	PTAFR	18	44
C#CC[C@@H](NC(=O)N1CCN(S(=O)(=O)NC)CC1)c1ccccc1	ZINC000853909320	FC	On-Demand	Mild	PTAFR	18	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909422	GD	On-Demand	Anodyne	MMP13	43	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909422	GD	On-Demand	Anodyne	ADAM17	27	47
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909422	GD	On-Demand	Anodyne	MMP2	23	47
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909422	GD	On-Demand	Anodyne	MMP3	53	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909422	GD	On-Demand	Anodyne	MMP8	17	40
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909422	GD	On-Demand	Anodyne	MMP7	44	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909422	GD	On-Demand	Anodyne	MMP1	41	44
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909425	GD	On-Demand	Anodyne	MMP13	43	44
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909425	GD	On-Demand	Anodyne	ADAM17	27	47
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909425	GD	On-Demand	Anodyne	MMP2	23	47
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909425	GD	On-Demand	Anodyne	MMP3	53	44
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909425	GD	On-Demand	Anodyne	MMP8	17	40
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909425	GD	On-Demand	Anodyne	MMP7	44	44
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909425	GD	On-Demand	Anodyne	MMP1	41	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909427	GD	On-Demand	Anodyne	MMP13	43	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909427	GD	On-Demand	Anodyne	ADAM17	27	47
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909427	GD	On-Demand	Anodyne	MMP2	23	47
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909427	GD	On-Demand	Anodyne	MMP3	53	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909427	GD	On-Demand	Anodyne	MMP8	17	40
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909427	GD	On-Demand	Anodyne	MMP7	44	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853909427	GD	On-Demand	Anodyne	MMP1	41	44
C#CCOCCOC(=O)[C@@H](O)Cc1cccc(OC)c1	ZINC000853909447	CC	On-Demand	Mild	MTNR1A	29	40
C#CCOCCOC(=O)[C@@H](O)Cc1cccc(OC)c1	ZINC000853909447	CC	On-Demand	Mild	MTNR1B	30	40
CNc1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853909448	BE	On-Demand	Anodyne	ACR	59	37
C#CCOCCOC(=O)[C@H](O)Cc1cccc(OC)c1	ZINC000853909449	CC	On-Demand	Mild	MTNR1A	29	40
C#CCOCCOC(=O)[C@H](O)Cc1cccc(OC)c1	ZINC000853909449	CC	On-Demand	Mild	MTNR1B	30	40
C=CCCOCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853909452	EG	On-Demand	Reactive	CSNK1D	36	43
C#CC[C@H](NC(=O)N[C@@H](C)CN(C)CCCN(C)C)c1ccccc1	ZINC000853909458	EE	On-Demand	Mild	UTS2	40	36
C#CC[C@@H](NC(=O)N[C@@H](C)CN(C)CCCN(C)C)c1ccccc1	ZINC000853909459	EE	On-Demand	Mild	UTS2	40	36
COCCC[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909529	EE	On-Demand	Anodyne	MMP1	17	44
COCCC[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909530	EE	On-Demand	Anodyne	MMP1	17	44
COCCC[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909531	EE	On-Demand	Anodyne	MMP1	17	44
COCCC[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909533	EE	On-Demand	Anodyne	MMP1	17	44
CNc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853909593	FF	On-Demand	Anodyne	LTA4H	29	44
CNc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853909593	FF	On-Demand	Anodyne	MMP1	28	45
CNc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853909593	FF	On-Demand	Anodyne	NOD2	34	41
CNc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853909595	FF	On-Demand	Anodyne	LTA4H	29	44
CNc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853909595	FF	On-Demand	Anodyne	MMP1	28	45
CNc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853909595	FF	On-Demand	Anodyne	NOD2	34	41
Nc1cccc([N+](=O)[O-])c1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853909630	CE	On-Demand	Bother	CACNA1D	49	39
Nc1cccc([N+](=O)[O-])c1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853909632	CE	On-Demand	Bother	CACNA1D	49	39
Nc1cccc([N+](=O)[O-])c1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853909634	CE	On-Demand	Bother	CACNA1D	49	39
C#CC[C@H](NC(=O)N(CCN1CCOCC1)CC1CC1)c1ccccc1	ZINC000853909658	FF	On-Demand	Mild	CASR	66	46
C#CC[C@@H](NC(=O)N(CCN1CCOCC1)CC1CC1)c1ccccc1	ZINC000853909659	FF	On-Demand	Mild	CASR	66	46
CCNC(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909660	EC	On-Demand	Anodyne	MMP1	28	48
CCNC(=O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909660	EC	On-Demand	Anodyne	PROKR1	59	32
CCNC(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909661	EC	On-Demand	Anodyne	MMP1	28	48
CCNC(=O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853909661	EC	On-Demand	Anodyne	PROKR1	59	32
C#CCOCCOC(=O)[C@@H]1CCCCN1Cc1ccccn1	ZINC000853909694	DD	On-Demand	Mild	FKBP1A	55	45
C#CCOCCOC(=O)[C@H]1CCCCN1Cc1ccccn1	ZINC000853909695	DD	On-Demand	Mild	FKBP1A	55	45
C#CC[C@@H](NC(=O)N1[C@H]2CC[C@H]1CC(=O)C2)c1ccccc1	ZINC000853909696	CF	On-Demand	Mild	BIRC8	44	31
C#CC[C@H](NC(=O)N1[C@H]2CC[C@H]1CC(=O)C2)c1ccccc1	ZINC000853909697	CF	On-Demand	Mild	BIRC8	44	31
C#CC[C@H](NC(=O)N(CCN(C)C)CC(=O)N(C)C)c1ccccc1	ZINC000853909717	ED	On-Demand	Mild	UTS2	56	36
C#CC[C@@H](NC(=O)N(CCN(C)C)CC(=O)N(C)C)c1ccccc1	ZINC000853909718	ED	On-Demand	Mild	UTS2	56	36
C#CC[C@H](NC(=O)NC[C@H](O)CC)c1ccccc1	ZINC000853909721	CD	On-Demand	Mild	TACR3	41	36
C#CC[C@@H](NC(=O)NC[C@H](O)CC)c1ccccc1	ZINC000853909722	CD	On-Demand	Mild	TACR3	41	36
C#CCOCCOC(=O)c1cc2cc(OC)ccc2[nH]1	ZINC000853909739	CD	On-Demand	Mild	TUBB2B	49	51
C#CC[C@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853909752	FF	On-Demand	Mild	CTSS	24	44
C#CC[C@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853909752	FF	On-Demand	Mild	L3MBTL3	86	40
Cc1n[nH]c(C)c1[C@@H](C)C(=O)OCc1cccc(C(C)C)c1	ZINC000853909789	DH	On-Demand	Anodyne	HAO2	61	35
C[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853909819	BF	On-Demand	Anodyne	CHRM4	21	43
C[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853909819	BF	On-Demand	Anodyne	AMY2	52	30
C[C@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853909820	BF	On-Demand	Anodyne	CHRM4	21	43
C[C@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853909820	BF	On-Demand	Anodyne	AMY2	52	30
O=C(CCCc1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853909929	EH	On-Demand	Anodyne	PDS	42	43
O=C(NCC1CCS(=O)(=O)CC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853910023	GE	On-Demand	Reactive	CSNK1D	39	43
C#CC[C@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853910049	FF	On-Demand	Mild	CTSS	24	44
C#CC[C@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853910049	FF	On-Demand	Mild	L3MBTL3	86	40
C#CC[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853910050	FF	On-Demand	Mild	CTSS	24	44
C#CC[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853910050	FF	On-Demand	Mild	L3MBTL3	86	40
C#CC[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853910051	FF	On-Demand	Mild	CTSS	24	44
C#CC[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1ccccc1	ZINC000853910051	FF	On-Demand	Mild	L3MBTL3	86	40
CC(C)(C)OC(=O)NCc1cccc(C(=O)OCCOC(F)F)c1	ZINC000853910060	EG	On-Demand	Anodyne	PDS	71	42
C#CC[C@H](NC(=O)NCCc1nnc(S)n1C1CC1)c1ccccc1	ZINC000853910073	FF	On-Demand	Mild	CCR5	15	40
C#CC[C@@H](NC(=O)NCCc1nnc(S)n1C1CC1)c1ccccc1	ZINC000853910074	FF	On-Demand	Mild	CCR5	15	40
C#CC[C@@H](NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccccc1	ZINC000853910095	GF	On-Demand	Mild	OPRK1	23	42
C#CC[C@@H](NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccccc1	ZINC000853910095	GF	On-Demand	Mild	SIGMAR1	24	46
C#CC[C@@H](NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccccc1	ZINC000853910096	GF	On-Demand	Mild	OPRK1	23	42
C#CC[C@@H](NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccccc1	ZINC000853910096	GF	On-Demand	Mild	SIGMAR1	24	46
C#CC[C@H](NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccccc1	ZINC000853910097	GF	On-Demand	Mild	OPRK1	23	42
C#CC[C@H](NC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1)c1ccccc1	ZINC000853910097	GF	On-Demand	Mild	SIGMAR1	24	46
C#CC[C@H](NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccccc1	ZINC000853910098	GF	On-Demand	Mild	OPRK1	23	42
C#CC[C@H](NC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1)c1ccccc1	ZINC000853910098	GF	On-Demand	Mild	SIGMAR1	24	46
O=C(OCCOC(F)F)c1cc(Cl)cc(C(F)(F)F)c1	ZINC000853910191	DH	On-Demand	Anodyne	ATF1	30	42
O=C(OCCOC(F)F)c1cc(Cl)cc(C(F)(F)F)c1	ZINC000853910191	DH	On-Demand	Anodyne	NFKB1	27	42
C[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1cn[nH]c1	ZINC000853910193	FD	On-Demand	Anodyne	MAPK1	34	40
C#CC[C@H](NC(=O)N1CCC(n2cnnc2O)CC1)c1ccccc1	ZINC000853910361	EE	On-Demand	Mild	CCR5	17	40
C#CCOCCOC(=O)c1ccc(NC)cc1	ZINC000853910362	BD	On-Demand	Mild	ACR	56	33
C#CC[C@@H](NC(=O)N1CCC(n2cnnc2O)CC1)c1ccccc1	ZINC000853910364	EE	On-Demand	Mild	CCR5	17	40
COC(=O)CCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853910365	ED	On-Demand	Anodyne	MMP1	32	50
COC(=O)CCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853910365	ED	On-Demand	Anodyne	PROKR1	47	31
COC(=O)CCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853910367	ED	On-Demand	Anodyne	MMP1	32	50
COC(=O)CCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853910367	ED	On-Demand	Anodyne	PROKR1	47	31
C#CC[C@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910371	FG	On-Demand	Mild	MTNR1A	30	41
C#CC[C@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910371	FG	On-Demand	Mild	MTNR1B	32	41
C#CC[C@@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910372	FG	On-Demand	Mild	MTNR1A	30	41
C#CC[C@@H](NC(=O)N[C@@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910372	FG	On-Demand	Mild	MTNR1B	32	41
C#CC[C@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910373	FG	On-Demand	Mild	MTNR1A	30	41
C#CC[C@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910373	FG	On-Demand	Mild	MTNR1B	32	41
C#CC[C@@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910374	FG	On-Demand	Mild	MTNR1A	30	41
C#CC[C@@H](NC(=O)N[C@H](COC)c1cccc(OC)c1)c1ccccc1	ZINC000853910374	FG	On-Demand	Mild	MTNR1B	32	41
CC(C)c1cccc(COC(=O)[C@H](O)c2ccc(C#N)cc2)c1	ZINC000853910401	DG	On-Demand	Mild	CTRB_BOVIN	44	32
CC(C)c1cccc(COC(=O)[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000853910403	DG	On-Demand	Mild	CTRB_BOVIN	44	32
C#CC[C@@H](NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910426	GI	On-Demand	Mild	CPT1A	52	37
C#CC[C@@H](NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910426	GI	On-Demand	Mild	SFRP1	49	32
C#CC[C@@H](NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910426	GI	On-Demand	Mild	WNT3	50	32
C#CC[C@H](NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910428	GI	On-Demand	Mild	CPT1A	52	37
C#CC[C@H](NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910428	GI	On-Demand	Mild	SFRP1	49	32
C#CC[C@H](NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910428	GI	On-Demand	Mild	WNT3	50	32
C#CC[C@@H](NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910430	GI	On-Demand	Mild	CPT1A	52	37
C#CC[C@@H](NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910430	GI	On-Demand	Mild	SFRP1	49	32
C#CC[C@@H](NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910430	GI	On-Demand	Mild	WNT3	50	32
C#CC[C@H](NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910431	GI	On-Demand	Mild	CPT1A	52	37
C#CC[C@H](NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910431	GI	On-Demand	Mild	SFRP1	49	32
C#CC[C@H](NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)c1ccccc1	ZINC000853910431	GI	On-Demand	Mild	WNT3	50	32
CC(C)c1cccc(COC(=O)C2(C)COC2)c1	ZINC000853910480	BF	On-Demand	Anodyne	SLC12A5	45	33
COC(=O)c1sc(N2CCOC(C3CC3)(C3CC3)C2)nc1Cl	ZINC000853910488	EF	On-Demand	Anodyne	PARE	47	32
C#CC[C@H](NC(=O)N1CCC[C@@H]1[C@H](C)O)c1ccccc1	ZINC000853910490	CE	On-Demand	Mild	ACE	27	40
C#CC[C@@H](NC(=O)N1CCC[C@@H]1[C@@H](C)O)c1ccccc1	ZINC000853910492	CE	On-Demand	Mild	ACE	27	40
C#CC[C@@H](NC(=O)N1CCC[C@@H]1[C@H](C)O)c1ccccc1	ZINC000853910494	CE	On-Demand	Mild	ACE	27	40
C#CC[C@H](NC(=O)N1CCC[C@@H]1[C@@H](C)O)c1ccccc1	ZINC000853910496	CE	On-Demand	Mild	ACE	27	40
C#CC[C@@H](NC(=O)N(CC)[C@H]1CCN(C)C1)c1ccccc1	ZINC000853910503	CE	On-Demand	Mild	CCR5	63	48
C#CC[C@@H](NC(=O)N(CC)[C@@H]1CCN(C)C1)c1ccccc1	ZINC000853910504	CE	On-Demand	Mild	CCR5	63	48
C#CC[C@H](NC(=O)N(CC)[C@H]1CCN(C)C1)c1ccccc1	ZINC000853910505	CE	On-Demand	Mild	CCR5	63	48
C#CC[C@H](NC(=O)N(CC)[C@@H]1CCN(C)C1)c1ccccc1	ZINC000853910506	CE	On-Demand	Mild	CCR5	63	48
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000853910536	EF	On-Demand	Bother	CACNA1D	46	34
O=C(OCc1ccccc1)N1CC[C@@](F)(C(=O)OCCOC(F)F)C1	ZINC000853910538	FF	On-Demand	Anodyne	SLC12A5	69	38
O=C(OCc1ccccc1)N1CC[C@](F)(C(=O)OCCOC(F)F)C1	ZINC000853910539	FF	On-Demand	Anodyne	SLC12A5	69	38
C#CCOCCOC(=O)c1ccc2c(c1)CCN2C	ZINC000853910562	CD	On-Demand	Mild	SRD5A1	20	44
C#CCOCCOC(=O)C[C@](C)(O)c1ccccc1	ZINC000853910592	CD	On-Demand	Mild	AMY2	57	37
C#CCOCCOC(=O)C[C@@](C)(O)c1ccccc1	ZINC000853910593	CD	On-Demand	Mild	AMY2	57	37
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)OCCOC(F)F	ZINC000853910605	CE	On-Demand	Anodyne	PAPA1_CARPA	35	41
CC[C@@H](NC(=O)OC(C)(C)C)C(=O)OCCOC(F)F	ZINC000853910605	CE	On-Demand	Anodyne	CTSK	19	45
CC(C)c1cccc(COC(=O)[C@@H]2CCC(=O)N2C)c1	ZINC000853910736	CE	On-Demand	Anodyne	P2RX7	16	41
C#CC[C@@H](NC(=O)N(CCOCCO)C1CCC1)c1ccccc1	ZINC000853910762	EE	On-Demand	Mild	AMY2	45	31
C#CC[C@H](NC(=O)N(CCOCCO)C1CCC1)c1ccccc1	ZINC000853910764	EE	On-Demand	Mild	AMY2	45	31
O=C(OCCOC(F)F)[C@H]1CCCCN1Cc1ccccn1	ZINC000853910769	DE	On-Demand	Anodyne	FKBP1A	63	46
O=C(OCCOC(F)F)[C@@H]1CCCCN1Cc1ccccn1	ZINC000853910770	DE	On-Demand	Anodyne	FKBP1A	63	46
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853910771	GC	On-Demand	Anodyne	MMP13	38	41
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853910771	GC	On-Demand	Anodyne	ADAM17	19	46
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853910771	GC	On-Demand	Anodyne	MMP2	18	44
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853910771	GC	On-Demand	Anodyne	MMP3	38	41
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853910771	GC	On-Demand	Anodyne	MMP7	34	41
O=C(OCCOC(F)F)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853910771	GC	On-Demand	Anodyne	MMP1	28	41
C#CC[C@@H](NC(=O)N1CCCC[C@H]1c1n[nH]c(C(C)C)n1)c1ccccc1	ZINC000853910777	FH	On-Demand	Mild	CPT1A	90	37
C#CC[C@@H](NC(=O)N1CCCC[C@@H]1c1n[nH]c(C(C)C)n1)c1ccccc1	ZINC000853910779	FH	On-Demand	Mild	CPT1A	90	37
C#CC[C@H](NC(=O)N1CCCC[C@H]1c1n[nH]c(C(C)C)n1)c1ccccc1	ZINC000853910781	FH	On-Demand	Mild	CPT1A	90	37
C#CC[C@H](NC(=O)N1CCCC[C@@H]1c1n[nH]c(C(C)C)n1)c1ccccc1	ZINC000853910782	FH	On-Demand	Mild	CPT1A	90	37
CN(C)[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853910877	CE	On-Demand	Anodyne	AMY2	53	31
CN(C)[C@@H](C(=O)OCCOC(F)F)c1ccccc1	ZINC000853910877	CE	On-Demand	Anodyne	AOC3	15	42
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853911109	FC	On-Demand	Mild	MMP13	30	41
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853911109	FC	On-Demand	Mild	ADAM17	22	42
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853911109	FC	On-Demand	Mild	MMP3	27	41
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853911109	FC	On-Demand	Mild	MMP7	20	41
C#CCOCCOC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(F)cc1	ZINC000853911109	FC	On-Demand	Mild	MMP1	22	41
CC[C@@H]1CCCC[C@@H]1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911112	GG	On-Demand	Anodyne	MMP9	15	40
CC[C@@H]1CCCC[C@@H]1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911112	GG	On-Demand	Anodyne	MMP7	16	40
CC[C@@H]1CCCC[C@@H]1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911112	GG	On-Demand	Anodyne	MMP1	17	44
CC[C@@H]1CCCC[C@H]1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911117	GG	On-Demand	Anodyne	MMP9	15	40
CC[C@@H]1CCCC[C@H]1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911117	GG	On-Demand	Anodyne	MMP7	16	40
CC[C@@H]1CCCC[C@H]1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911117	GG	On-Demand	Anodyne	MMP1	17	44
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCCN1Cc1ccccn1	ZINC000853911120	DG	On-Demand	Anodyne	FKBP1A	39	41
CC[C@@H]1CCCC[C@H]1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911121	GG	On-Demand	Anodyne	MMP9	15	40
CC[C@@H]1CCCC[C@H]1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911121	GG	On-Demand	Anodyne	MMP7	16	40
CC[C@@H]1CCCC[C@H]1OCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911121	GG	On-Demand	Anodyne	MMP1	17	44
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H]1CCCCN1Cc1ccccn1	ZINC000853911122	DG	On-Demand	Anodyne	FKBP1A	39	41
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H]1CCCCN1Cc1ccccn1	ZINC000853911123	DG	On-Demand	Anodyne	FKBP1A	39	41
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCCN1Cc1ccccn1	ZINC000853911124	DG	On-Demand	Anodyne	FKBP1A	39	41
CC[C@@H]1CCCC[C@@H]1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911125	GG	On-Demand	Anodyne	MMP9	15	40
CC[C@@H]1CCCC[C@@H]1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911125	GG	On-Demand	Anodyne	MMP7	16	40
CC[C@@H]1CCCC[C@@H]1OCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911125	GG	On-Demand	Anodyne	MMP1	17	44
CC[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1c(C)noc1C	ZINC000853911139	GI	On-Demand	Reactive	LCK	23	43
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(F)cc1	ZINC000853911173	GH	On-Demand	Anodyne	SLC6A3	17	43
CC[C@@H](C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(F)cc1	ZINC000853911173	GH	On-Demand	Anodyne	CACNA1G	19	41
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(F)cc1	ZINC000853911175	GH	On-Demand	Anodyne	SLC6A3	17	43
CC[C@@H](C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O)c1ccc(F)cc1	ZINC000853911175	GH	On-Demand	Anodyne	CACNA1G	19	41
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	FKBP1A	59	45
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	SLC6A1	60	39
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	CELA1	19	41
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	GRIN2B	21	41
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	PREP	57	50
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	AMY2	45	30
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	LGMN	45	38
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	TGM2	34	40
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	DPP7	54	39
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	KLK5	31	41
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	F13A1	29	40
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	BIRC2	17	47
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911179	FF	On-Demand	Anodyne	SLC12A5	43	36
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	FKBP1A	59	45
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	SLC6A1	60	39
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	CELA1	19	41
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	GRIN2B	21	41
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	PREP	57	50
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	AMY2	45	30
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	LGMN	45	38
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	TGM2	34	40
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	DPP7	54	39
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	KLK5	31	41
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	F13A1	29	40
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	BIRC2	17	47
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)OCc2ccccc2)C1	ZINC000853911180	FF	On-Demand	Anodyne	SLC12A5	43	36
O=C(Cc1cccs1)Nc1nc(CC(=O)OCCOC(F)F)cs1	ZINC000853911286	GF	On-Demand	Anodyne	CA5B	33	43
O=C(Cc1cccs1)Nc1nc(CC(=O)OCCOC(F)F)cs1	ZINC000853911286	GF	On-Demand	Anodyne	CA5A	33	43
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OCCOC(F)F	ZINC000853911300	FI	On-Demand	Anodyne	PPARG	57	47
Cc1oc(-c2cccc(C(F)(F)F)c2)nc1C(=O)OCCOC(F)F	ZINC000853911300	FI	On-Demand	Anodyne	PPARA	61	47
C#CC[C@H](NC(=O)N(CC)[C@@H]1CCN(CC)C1)c1ccccc1	ZINC000853911393	DF	On-Demand	Mild	CCR5	69	49
C#CC[C@@H](NC(=O)N(CC)[C@@H]1CCN(CC)C1)c1ccccc1	ZINC000853911394	DF	On-Demand	Mild	CCR5	69	49
C#CC[C@H](NC(=O)N(CC)[C@H]1CCN(CC)C1)c1ccccc1	ZINC000853911395	DF	On-Demand	Mild	CCR5	69	49
C#CC[C@@H](NC(=O)N(CC)[C@H]1CCN(CC)C1)c1ccccc1	ZINC000853911396	DF	On-Demand	Mild	CCR5	69	49
C#CC[C@@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1ccccc1	ZINC000853911403	DF	On-Demand	Mild	CPT1A	112	39
C#CC[C@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1ccccc1	ZINC000853911406	DF	On-Demand	Mild	CPT1A	112	39
C#CC[C@@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1ccccc1	ZINC000853911408	DF	On-Demand	Mild	CPT1A	112	39
C#CC[C@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1ccccc1	ZINC000853911411	DF	On-Demand	Mild	CPT1A	112	39
CC[C@@H](C)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911413	DF	On-Demand	Anodyne	MMP1	19	46
C#CC[C@@H](NC(=O)NCCN(C)CCCN(C)C)c1ccccc1	ZINC000853911415	ED	On-Demand	Mild	UTS2	46	37
CC[C@@H](C)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911416	DF	On-Demand	Anodyne	MMP1	19	46
C#CC[C@H](NC(=O)NCCN(C)CCCN(C)C)c1ccccc1	ZINC000853911417	ED	On-Demand	Mild	UTS2	46	37
CSC1(C(=O)OCc2cccc(C(C)C)c2)CC1	ZINC000853911481	CH	On-Demand	Anodyne	SLC12A5	66	34
CO[C@@](C)(C(=O)OCCOC(F)F)c1ccccc1F	ZINC000853911482	CE	On-Demand	Anodyne	AMY2	54	31
O=C(N[C@]1(C(=O)OCC2C[C@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911590	FF	On-Demand	Anodyne	CTSL	18	42
O=C(N[C@]1(C(=O)OCC2C[C@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911590	FF	On-Demand	Anodyne	NAAA	42	40
O=C(N[C@]1(C(=O)OCC2C[C@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911590	FF	On-Demand	Anodyne	SLC12A5	53	36
O=C(N[C@]1(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911593	FF	On-Demand	Anodyne	CTSL	18	42
O=C(N[C@]1(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911593	FF	On-Demand	Anodyne	NAAA	42	40
O=C(N[C@]1(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911593	FF	On-Demand	Anodyne	SLC12A5	53	36
O=C(N[C@@]1(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911595	FF	On-Demand	Anodyne	CTSL	18	42
O=C(N[C@@]1(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911595	FF	On-Demand	Anodyne	NAAA	42	40
O=C(N[C@@]1(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911595	FF	On-Demand	Anodyne	SLC12A5	53	36
O=C(N[C@]1(C(=O)OCC2C[C@@H]3C[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911597	FF	On-Demand	Anodyne	CTSL	18	42
O=C(N[C@]1(C(=O)OCC2C[C@@H]3C[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911597	FF	On-Demand	Anodyne	NAAA	42	40
O=C(N[C@]1(C(=O)OCC2C[C@@H]3C[C@H]3C2)CCOC1)OCc1ccccc1	ZINC000853911597	FF	On-Demand	Anodyne	SLC12A5	53	36
O=C(OCCOC(F)F)[C@@H](F)Cc1ccccc1	ZINC000853911615	CE	On-Demand	Anodyne	MME	49	36
O=C(OCCOC(F)F)[C@@H](F)Cc1ccccc1	ZINC000853911615	CE	On-Demand	Anodyne	ANPEP	59	34
O=C(OCCOC(F)F)[C@@H](F)Cc1ccccc1	ZINC000853911615	CE	On-Demand	Anodyne	CPA1	52	38
O=C(OCCOC(F)F)[C@@H](F)Cc1ccccc1	ZINC000853911615	CE	On-Demand	Anodyne	LAP3	54	38
O=C(OCCOC(F)F)[C@H](F)Cc1ccccc1	ZINC000853911616	CE	On-Demand	Anodyne	MME	49	36
O=C(OCCOC(F)F)[C@H](F)Cc1ccccc1	ZINC000853911616	CE	On-Demand	Anodyne	ANPEP	59	34
O=C(OCCOC(F)F)[C@H](F)Cc1ccccc1	ZINC000853911616	CE	On-Demand	Anodyne	CPA1	52	38
O=C(OCCOC(F)F)[C@H](F)Cc1ccccc1	ZINC000853911616	CE	On-Demand	Anodyne	LAP3	54	38
O=C(N[C@@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911657	FD	On-Demand	Anodyne	CTSK	18	42
O=C(N[C@@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911657	FD	On-Demand	Anodyne	CTSL	18	42
O=C(N[C@@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911657	FD	On-Demand	Anodyne	CAPNS1	56	34
O=C(N[C@@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911657	FD	On-Demand	Anodyne	CAPN1	42	35
O=C(N[C@@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911657	FD	On-Demand	Anodyne	CAPN2	83	35
O=C(N[C@@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911657	FD	On-Demand	Anodyne	NPR	53	32
O=C(N[C@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911658	FD	On-Demand	Anodyne	CTSK	18	42
O=C(N[C@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911658	FD	On-Demand	Anodyne	CTSL	18	42
O=C(N[C@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911658	FD	On-Demand	Anodyne	CAPNS1	56	34
O=C(N[C@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911658	FD	On-Demand	Anodyne	CAPN1	42	35
O=C(N[C@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911658	FD	On-Demand	Anodyne	CAPN2	83	35
O=C(N[C@]1(C(=O)OCCOC(F)F)CCOC1)OCc1ccccc1	ZINC000853911658	FD	On-Demand	Anodyne	NPR	53	32
O=C(CCc1cccc(C(F)(F)F)c1)OCCOC(F)F	ZINC000853911728	DG	On-Demand	Anodyne	PDS	43	45
O=C(OCCOC(F)F)[C@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	ZINC000853911748	DE	On-Demand	Anodyne	Q8AWE3_CHICK	16	44
O=C(OCCOC(F)F)[C@@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	ZINC000853911749	DE	On-Demand	Anodyne	Q8AWE3_CHICK	16	44
O=C(OCCOC(F)F)[C@H]1[C@H](C(F)(F)F)[C@H]2CC[C@H]1O2	ZINC000853911750	DE	On-Demand	Anodyne	Q8AWE3_CHICK	16	44
O=C(OCCOC(F)F)[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C(F)(F)F	ZINC000853911751	DE	On-Demand	Anodyne	Q8AWE3_CHICK	16	44
C#CC[C@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1ccccc1	ZINC000853911765	EF	On-Demand	Mild	NPY5R	27	41
C#CC[C@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1ccccc1	ZINC000853911766	EF	On-Demand	Mild	NPY5R	27	41
C#CC[C@@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1ccccc1	ZINC000853911767	EF	On-Demand	Mild	NPY5R	27	41
C#CC[C@@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1ccccc1	ZINC000853911768	EF	On-Demand	Mild	NPY5R	27	41
O=C(OCCOC(F)F)c1cn(-c2cccc(Cl)c2)nn1	ZINC000853911777	DE	On-Demand	Anodyne	ESRRA	24	42
CCCOc1cccnc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911865	GF	On-Demand	Anodyne	HCRTR1	17	42
CCCOc1cccnc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911865	GF	On-Demand	Anodyne	HCRTR2	17	42
CCCOc1cccnc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911866	GF	On-Demand	Anodyne	HCRTR1	17	42
CCCOc1cccnc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853911866	GF	On-Demand	Anodyne	HCRTR2	17	42
CC(C)(C(=O)OCCOC(F)F)c1ccc(OC(F)(F)F)cc1	ZINC000853911894	EH	On-Demand	Anodyne	AMY2	51	29
COc1cncc(C(=O)OCc2cccc(C(C)C)c2)n1	ZINC000853911917	CF	On-Demand	Anodyne	ALS	52	32
C#CC[C@@H](NC(=O)NC[C@@H](C)c1ccccn1)c1ccccc1	ZINC000853911954	DG	On-Demand	Mild	SOAT1	25	43
C#CC[C@@H](NC(=O)NC[C@H](C)c1ccccn1)c1ccccc1	ZINC000853911957	DG	On-Demand	Mild	SOAT1	25	43
C#CC[C@H](NC(=O)NC[C@@H](C)c1ccccn1)c1ccccc1	ZINC000853911961	DG	On-Demand	Mild	SOAT1	25	43
C#CC[C@H](NC(=O)NC[C@H](C)c1ccccn1)c1ccccc1	ZINC000853911965	DG	On-Demand	Mild	SOAT1	25	43
C#CC[C@@H](NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1)c1ccccc1	ZINC000853911972	GH	On-Demand	Mild	CCR5	47	40
C#CC[C@H](NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1)c1ccccc1	ZINC000853911976	GH	On-Demand	Mild	CCR5	47	40
C#CC[C@H](NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1)c1ccccc1	ZINC000853911982	GH	On-Demand	Mild	CCR5	47	40
C#CC[C@@H](NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1)c1ccccc1	ZINC000853911985	GH	On-Demand	Mild	CCR5	47	40
C#CC[C@@H](NC(=O)N[C@H]1CCc2ccc(O)cc21)c1ccccc1	ZINC000853912021	DG	On-Demand	Mild	NPY1R	18	41
C#CC[C@H](NC(=O)N[C@H]1CCc2ccc(O)cc21)c1ccccc1	ZINC000853912025	DG	On-Demand	Mild	NPY1R	18	41
CC[C@H](C)[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912028	EG	On-Demand	Anodyne	MMP1	21	44
CC[C@H](C)[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912028	EG	On-Demand	Anodyne	PROKR1	47	31
C#CC[C@H](NC(=O)N[C@@H]1CCc2ccc(O)cc21)c1ccccc1	ZINC000853912029	DG	On-Demand	Mild	NPY1R	18	41
C#CC[C@@H](NC(=O)N[C@@H]1CCc2ccc(O)cc21)c1ccccc1	ZINC000853912034	DG	On-Demand	Mild	NPY1R	18	41
CC[C@H](C)[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912040	EG	On-Demand	Anodyne	MMP1	21	44
CC[C@H](C)[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912040	EG	On-Demand	Anodyne	PROKR1	47	31
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853912058	FG	On-Demand	Anodyne	OPRD1	47	36
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853912058	FG	On-Demand	Anodyne	CFTR	55	33
CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)OCCOC(F)F	ZINC000853912058	FG	On-Demand	Anodyne	ADAM9	54	32
CC(C)c1cccc(COC(=O)CN2CCOCC2)c1	ZINC000853912061	CE	On-Demand	Anodyne	CASR	48	44
Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCCOC(F)F	ZINC000853912098	FI	On-Demand	Anodyne	PPARG	40	43
Cc1oc(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OCCOC(F)F	ZINC000853912098	FI	On-Demand	Anodyne	PPARA	39	43
COC(=O)c1cnc(C(=O)OCc2cccc(C(C)C)c2)cn1	ZINC000853912116	DF	On-Demand	Anodyne	CACNA1D	54	38
C=C(C)C[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912126	EF	On-Demand	Mild	MMP1	15	42
C=C(C)C[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912126	EF	On-Demand	Mild	PROKR1	53	31
COc1cccc(C[C@@H](O)C(=O)OCCOC(F)F)c1	ZINC000853912128	CD	On-Demand	Anodyne	MTNR1A	35	42
COc1cccc(C[C@@H](O)C(=O)OCCOC(F)F)c1	ZINC000853912128	CD	On-Demand	Anodyne	MTNR1B	36	42
C=C(C)C[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912129	EF	On-Demand	Mild	MMP1	15	42
C=C(C)C[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912129	EF	On-Demand	Mild	PROKR1	53	31
C=C(C)C[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912132	EF	On-Demand	Mild	MMP1	15	42
C=C(C)C[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912132	EF	On-Demand	Mild	PROKR1	53	31
C=C(C)C[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912135	EF	On-Demand	Mild	MMP1	15	42
C=C(C)C[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912135	EF	On-Demand	Mild	PROKR1	53	31
CCNC(=O)CC(=O)OCc1cccc(C(C)C)c1	ZINC000853912167	CE	On-Demand	Anodyne	CAPN1	38	41
CCNC(=O)CC(=O)OCc1cccc(C(C)C)c1	ZINC000853912167	CE	On-Demand	Anodyne	CAPN2	74	41
CCNC(=O)CC(=O)OCc1cccc(C(C)C)c1	ZINC000853912167	CE	On-Demand	Anodyne	NPR	52	36
CCNC(=O)CC(=O)OCc1cccc(C(C)C)c1	ZINC000853912167	CE	On-Demand	Anodyne	PDS	27	41
COc1ccc2[nH]c(C(=O)OCCOC(F)F)cc2c1	ZINC000853912174	CF	On-Demand	Anodyne	TUBB2B	53	52
C#CC[C@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)c1ccccc1	ZINC000853912177	EH	On-Demand	Mild	EPHX2	18	44
C#CC[C@@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)c1ccccc1	ZINC000853912180	EH	On-Demand	Mild	EPHX2	18	44
CC[C@@H]1C[C@@H](C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)CCO1	ZINC000853912197	FF	On-Demand	Anodyne	MMP1	15	40
CC[C@@H]1C[C@@H](C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)CCO1	ZINC000853912199	FF	On-Demand	Anodyne	MMP1	15	40
C#CC[C@H](NC(=O)N1CCC(=O)N(C)CC1)c1ccccc1	ZINC000853912208	CD	On-Demand	Mild	PTAFR	22	43
C#CC[C@@H](NC(=O)N1CCC(=O)N(C)CC1)c1ccccc1	ZINC000853912211	CD	On-Demand	Mild	PTAFR	22	43
C#CC[C@H](NC(=O)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1)c1ccccc1	ZINC000853912213	GH	On-Demand	Mild	CCR5	19	40
C#CC[C@@H](NC(=O)N1CCC[C@H](c2nnc(S)n2C2CC2)C1)c1ccccc1	ZINC000853912215	GH	On-Demand	Mild	CCR5	19	40
C#CC[C@@H](NC(=O)N1CCC[C@@H](c2nnc(S)n2C2CC2)C1)c1ccccc1	ZINC000853912218	GH	On-Demand	Mild	CCR5	19	40
C#CC[C@H](NC(=O)N1CCC[C@H](c2nnc(S)n2C2CC2)C1)c1ccccc1	ZINC000853912220	GH	On-Demand	Mild	CCR5	19	40
C#CC[C@H](NC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1)c1ccccc1	ZINC000853912236	FF	On-Demand	Mild	CPT1A	110	40
C#CC[C@@H](NC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1)c1ccccc1	ZINC000853912237	FF	On-Demand	Mild	CPT1A	110	40
C#CC[C@H](NC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1)c1ccccc1	ZINC000853912238	FF	On-Demand	Mild	CPT1A	110	40
C#CC[C@@H](NC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1)c1ccccc1	ZINC000853912239	FF	On-Demand	Mild	CPT1A	110	40
C#CC[C@H](NC(=O)N1CCC(N2CC[C@@H](O)C2)CC1)c1ccccc1	ZINC000853912261	ED	On-Demand	Mild	L3MBTL3	54	35
C#CC[C@H](NC(=O)N1CCC(N2CC[C@H](O)C2)CC1)c1ccccc1	ZINC000853912262	ED	On-Demand	Mild	L3MBTL3	54	35
C#CC[C@@H](NC(=O)N1CCC(N2CC[C@H](O)C2)CC1)c1ccccc1	ZINC000853912263	ED	On-Demand	Mild	L3MBTL3	54	35
C#CC[C@@H](NC(=O)N1CCC(N2CC[C@@H](O)C2)CC1)c1ccccc1	ZINC000853912264	ED	On-Demand	Mild	L3MBTL3	54	35
O=C(OCc1nnc2n1CCOCC2)c1cn(-c2cccc(Cl)c2)nn1	ZINC000853912265	FD	On-Demand	Anodyne	ESRRA	19	40
O=C(OCCOC(F)F)[C@@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000853912266	EE	On-Demand	Anodyne	PDS	42	41
O=C(OCCOC(F)F)[C@H](O)Cc1cccc(C(F)(F)F)c1	ZINC000853912267	EE	On-Demand	Anodyne	PDS	42	41
CC(C)c1cccc(COC(=O)[C@@]2(C)CCOC2)c1	ZINC000853912320	CG	On-Demand	Anodyne	SLC12A5	45	33
CC(C)c1cccc(COC(=O)[C@]2(C)CCOC2)c1	ZINC000853912321	CG	On-Demand	Anodyne	SLC12A5	45	33
CC#CCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912337	EF	On-Demand	Mild	MMP13	18	44
CC#CCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912337	EF	On-Demand	Mild	ADAM17	17	40
CC#CCCCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912337	EF	On-Demand	Mild	MMP1	16	44
CC#CCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912338	EF	On-Demand	Mild	MMP13	18	44
CC#CCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912338	EF	On-Demand	Mild	ADAM17	17	40
CC#CCCCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912338	EF	On-Demand	Mild	MMP1	16	44
COC(=O)c1cnc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853912435	GD	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)c1cnc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853912435	GD	On-Demand	Anodyne	MMP1	33	45
COC(=O)c1cnc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853912435	GD	On-Demand	Anodyne	PROKR1	63	34
COC(=O)c1cnc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853912437	GD	On-Demand	Anodyne	SIGMAR1	15	42
COC(=O)c1cnc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853912437	GD	On-Demand	Anodyne	MMP1	33	45
COC(=O)c1cnc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853912437	GD	On-Demand	Anodyne	PROKR1	63	34
O=C(NCC1CCS(=O)(=O)CC1)NNc1cc(F)cc(Cl)c1	ZINC000853912502	ED	On-Demand	Reactive	CACNA1I	62	37
CC[C@@H](C(=O)OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912680	ED	On-Demand	Anodyne	MMP1	28	46
CC[C@@H](C(=O)OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912680	ED	On-Demand	Anodyne	PROKR1	63	34
CC[C@@H](C(=O)OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912682	ED	On-Demand	Anodyne	MMP1	28	46
CC[C@@H](C(=O)OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912682	ED	On-Demand	Anodyne	PROKR1	63	34
CO[C@@]1(C(=O)OCc2cccc(C(C)C)c2)CCOC1	ZINC000853912713	CF	On-Demand	Anodyne	SLC12A5	45	35
CC(C)c1cccc(COC(=O)C(F)(F)C2CCOCC2)c1	ZINC000853912731	DH	On-Demand	Anodyne	AMY2	45	31
COc1cc(N)c([N+](=O)[O-])cc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853912732	DE	On-Demand	Bother	HTR4	70	43
COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853912733	DE	On-Demand	Bother	HTR4	70	43
COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853912734	DE	On-Demand	Bother	HTR4	70	43
C#CCOCCOC(=O)c1cc([N+](=O)[O-])c(N)cc1OC	ZINC000853912773	CC	On-Demand	Mild	HTR4	45	44
COc1cc(N)c([N+](=O)[O-])cc1C(=O)OCCOC(F)F	ZINC000853912815	DD	On-Demand	Bother	HTR4	45	43
c1cncc(-c2nc(N3CCOC(C4CC4)(C4CC4)C3)c3ccccc3n2)c1	ZINC000853912835	FI	On-Demand	Anodyne	PIK3CA	15	44
c1cncc(-c2nc(N3CCOC(C4CC4)(C4CC4)C3)c3ccccc3n2)c1	ZINC000853912835	FI	On-Demand	Anodyne	MTOR	18	44
CCCOc1cc(OC)ccc1C(=O)OCCOC(F)F	ZINC000853912841	DF	On-Demand	Anodyne	MTNR1A	36	44
CCCOc1cc(OC)ccc1C(=O)OCCOC(F)F	ZINC000853912841	DF	On-Demand	Anodyne	MTNR1B	24	44
O=[N+]([O-])c1ccc(N2CCOC(C3CC3)(C3CC3)C2)c2nonc12	ZINC000853912842	EF	On-Demand	Bother	GSTM2	86	39
O=[N+]([O-])c1ccc(N2CCOC(C3CC3)(C3CC3)C2)c2nonc12	ZINC000853912842	EF	On-Demand	Bother	GSTP1	45	39
C[C@@H](Nc1nccc(N2CCCC2)n1)C1CCC(F)CC1	ZINC000853912886	CG	On-Demand	Anodyne	SORD	56	33
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)OCCOC(F)F)c1	ZINC000853912894	DF	On-Demand	Anodyne	MTNR1A	24	48
COc1ccc(OC)c([C@H]2C[C@@H]2C(=O)OCCOC(F)F)c1	ZINC000853912894	DF	On-Demand	Anodyne	MTNR1B	24	48
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)OCCOC(F)F)c1	ZINC000853912895	DF	On-Demand	Anodyne	MTNR1A	24	48
COc1ccc(OC)c([C@H]2C[C@H]2C(=O)OCCOC(F)F)c1	ZINC000853912895	DF	On-Demand	Anodyne	MTNR1B	24	48
Cc1ccccc1C1(C(=O)OCc2nnc3n2CCOCC3)CCC1	ZINC000853912948	EE	On-Demand	Anodyne	SLC12A5	42	32
C/C=C(/CC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912949	DF	On-Demand	Anodyne	MMP1	18	44
C/C=C(\CC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912950	DF	On-Demand	Anodyne	MMP1	18	44
C/C=C(\CC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912951	DF	On-Demand	Anodyne	MMP1	18	44
C/C=C(/CC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853912952	DF	On-Demand	Anodyne	MMP1	18	44
C[C@H](C(=O)OCCOC(F)F)[C@@H](C)NC(=O)OC(C)(C)C	ZINC000853912983	DE	On-Demand	Anodyne	CTSK	16	42
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)C(=O)OCCOC(F)F	ZINC000853912984	DE	On-Demand	Anodyne	CTSK	16	42
CC(C)(C(=O)OCCOC(F)F)C1CCC(O)CC1	ZINC000853913028	CE	On-Demand	Anodyne	AMY2	45	31
COc1ccc(-c2ncc(C(=O)OCCOC(F)F)s2)cc1OC	ZINC000853913035	FG	On-Demand	Anodyne	DCK	49	39
O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c2nonc12	ZINC000853913046	FE	On-Demand	Bother	GSTM2	80	37
O=[N+]([O-])c1ccc(N[C@@H]2C[C@@H](N3CCOCC3)C23CCC3)c2nonc12	ZINC000853913046	FE	On-Demand	Bother	GSTP1	44	37
CCCCS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1	ZINC000853913049	EF	On-Demand	Anodyne	CA2	19	43
C#CCOCCOC(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913077	ED	On-Demand	Mild	SIGMAR1	28	44
CC(=O)Nc1ccccc1CC(=O)OCc1cccc(C(C)C)c1	ZINC000853913152	EI	On-Demand	Anodyne	CAPNS1	46	32
CC(=O)Nc1ccccc1CC(=O)OCc1cccc(C(C)C)c1	ZINC000853913152	EI	On-Demand	Anodyne	CAPN2	49	32
O=C(OCCOC(F)F)[C@H]1CCCN1c1ccccc1	ZINC000853913202	CE	On-Demand	Anodyne	FKBP1A	69	43
O=C(OCCOC(F)F)[C@H]1CCCN1c1ccccc1	ZINC000853913202	CE	On-Demand	Anodyne	PREP	65	38
O=C(OCCOC(F)F)[C@H]1CCCN1c1ccccc1	ZINC000853913202	CE	On-Demand	Anodyne	AMY2	43	30
O=C(OCCOC(F)F)[C@@H]1CCCN1c1ccccc1	ZINC000853913203	CE	On-Demand	Anodyne	FKBP1A	69	43
O=C(OCCOC(F)F)[C@@H]1CCCN1c1ccccc1	ZINC000853913203	CE	On-Demand	Anodyne	PREP	65	38
O=C(OCCOC(F)F)[C@@H]1CCCN1c1ccccc1	ZINC000853913203	CE	On-Demand	Anodyne	AMY2	43	30
COc1ccc(N2CC[C@H](NC(=O)NCCN3CCC(N(C)C)CC3)C2)cc1	ZINC000853913239	GD	On-Demand	Clean	HTR1A	15	40
COc1ccc(N2CC[C@H](NC(=O)NCCN3CCC(N(C)C)CC3)C2)cc1	ZINC000853913239	GD	On-Demand	Clean	DRD4	49	40
COc1ccc(N2CC[C@H](NC(=O)NCCN3CCC(N(C)C)CC3)C2)cc1	ZINC000853913239	GD	On-Demand	Clean	MCHR1	25	55
COC(=O)c1cccc(NNC(=O)NCCN2CCC(N(C)C)CC2)c1C	ZINC000853913241	GD	On-Demand	Reactive	DRD4	41	32
COC(=O)c1cccc(NNC(=O)NCCN2CCC(N(C)C)CC2)c1C	ZINC000853913241	GD	On-Demand	Reactive	HTR4	52	35
C#CCOCCOC(=O)c1ccc(S(=O)(=O)Nc2cccc(C)c2C)cc1	ZINC000853913254	GF	On-Demand	Mild	PRTN3	52	37
C#CCOCCOC(=O)c1ccc(S(=O)(=O)Nc2cccc(C)c2C)cc1	ZINC000853913254	GF	On-Demand	Mild	LIMK2	19	40
N#CCCCn1cc(C(=O)OCCOC(F)F)c2ccccc21	ZINC000853913393	DG	On-Demand	Mild	CNR1	17	43
N#CCCCn1cc(C(=O)OCCOC(F)F)c2ccccc21	ZINC000853913393	DG	On-Demand	Mild	CNR2	25	43
CCOC(=O)NCC(=O)OCc1cccc(C(C)C)c1	ZINC000853913399	CF	On-Demand	Anodyne	CAPN1	42	34
CCOC(=O)NCC(=O)OCc1cccc(C(C)C)c1	ZINC000853913399	CF	On-Demand	Anodyne	CAPN2	76	35
CCOC(=O)NCC(=O)OCc1cccc(C(C)C)c1	ZINC000853913399	CF	On-Demand	Anodyne	NPR	61	34
CCOC(=O)NCC(=O)OCc1cccc(C(C)C)c1	ZINC000853913399	CF	On-Demand	Anodyne	PDS	42	42
CC(C)c1cccc(COC(=O)C2(C(N)=O)CCC2)c1	ZINC000853913459	CF	On-Demand	Anodyne	SLC12A5	69	37
C#CCOCCOC(=O)[C@@](C)(NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853913466	EF	On-Demand	Mild	AMY2	61	38
C#CCOCCOC(=O)[C@](C)(NC(=O)OC(C)(C)C)c1ccccc1	ZINC000853913467	EF	On-Demand	Mild	AMY2	61	38
N#CCCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853913476	GE	On-Demand	Mild	CNR1	17	42
N#CCCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853913476	GE	On-Demand	Mild	CNR2	22	42
N#CCCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853913476	GE	On-Demand	Mild	ADCY5	15	40
N#CCCCn1cc(C(=O)OCc2nnc3n2CCOCC3)c2ccccc21	ZINC000853913476	GE	On-Demand	Mild	PTGDS	23	40
CC(C)c1cccc(COC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)c1	ZINC000853913495	FE	On-Demand	Anodyne	CASR	51	44
CC(C)c1cccc(COC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1	ZINC000853913496	FE	On-Demand	Anodyne	CASR	51	44
O=C(OCCOC(F)F)c1ccc(Cl)nc1C(F)(F)F	ZINC000853913497	DG	On-Demand	Anodyne	ATF1	63	36
O=C(OCCOC(F)F)c1ccc(Cl)nc1C(F)(F)F	ZINC000853913497	DG	On-Demand	Anodyne	NFKB1	58	36
C[C@@H](C(=O)OCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853913517	CE	On-Demand	Bother	CACNA1C	61	42
C[C@@H](C(=O)OCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853913517	CE	On-Demand	Bother	CACNA1D	95	40
C[C@H](C(=O)OCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853913518	CE	On-Demand	Bother	CACNA1C	61	42
C[C@H](C(=O)OCCOC(F)F)c1cccc([N+](=O)[O-])c1	ZINC000853913518	CE	On-Demand	Bother	CACNA1D	95	40
CC(C)(C(=O)OCCOC(F)F)c1ccc(O)cc1	ZINC000853913565	CE	On-Demand	Anodyne	AMY2	55	31
CCOC(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853913574	FD	On-Demand	Anodyne	MMP1	21	46
CCOC(=O)NCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853913574	FD	On-Demand	Anodyne	PROKR1	60	32
CCOC(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853913575	FD	On-Demand	Anodyne	MMP1	21	46
CCOC(=O)NCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853913575	FD	On-Demand	Anodyne	PROKR1	60	32
C#CCOCCOC(=O)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000853913659	FD	On-Demand	Mild	FKBP1A	45	49
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913728	EG	On-Demand	Anodyne	ACHE	31	40
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913728	EG	On-Demand	Anodyne	HTR4	47	40
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913728	EG	On-Demand	Anodyne	SIGMAR1	37	48
O=C(OCC1C[C@H]2C[C@@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913729	EG	On-Demand	Anodyne	ACHE	31	40
O=C(OCC1C[C@H]2C[C@@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913729	EG	On-Demand	Anodyne	HTR4	47	40
O=C(OCC1C[C@H]2C[C@@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913729	EG	On-Demand	Anodyne	SIGMAR1	37	48
O=C(OCC1C[C@@H]2C[C@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913730	EG	On-Demand	Anodyne	ACHE	31	40
O=C(OCC1C[C@@H]2C[C@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913730	EG	On-Demand	Anodyne	HTR4	47	40
O=C(OCC1C[C@@H]2C[C@H]2C1)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913730	EG	On-Demand	Anodyne	SIGMAR1	37	48
CC(C)c1cccc(COC(=O)c2nccs2)c1	ZINC000853913757	CH	On-Demand	Anodyne	HPN	48	32
O=C(OCCOC(F)F)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913788	EE	On-Demand	Anodyne	FKBP1A	47	40
O=C(OCCOC(F)F)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913788	EE	On-Demand	Anodyne	GRIN2B	28	44
O=C(OCCOC(F)F)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913788	EE	On-Demand	Anodyne	PREP	35	44
O=C(OCCOC(F)F)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913788	EE	On-Demand	Anodyne	AMY2	44	31
O=C(OCCOC(F)F)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913788	EE	On-Demand	Anodyne	TGM2	32	43
O=C(OCCOC(F)F)[C@@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913788	EE	On-Demand	Anodyne	F13A1	30	43
O=C(OCCOC(F)F)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913789	EE	On-Demand	Anodyne	FKBP1A	47	40
O=C(OCCOC(F)F)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913789	EE	On-Demand	Anodyne	GRIN2B	28	44
O=C(OCCOC(F)F)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913789	EE	On-Demand	Anodyne	PREP	35	44
O=C(OCCOC(F)F)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913789	EE	On-Demand	Anodyne	AMY2	44	31
O=C(OCCOC(F)F)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913789	EE	On-Demand	Anodyne	TGM2	32	43
O=C(OCCOC(F)F)[C@H]1CCN(C(=O)OCc2ccccc2)C1	ZINC000853913789	EE	On-Demand	Anodyne	F13A1	30	43
O=C(OCCOC(F)F)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913793	EE	On-Demand	Anodyne	SLC6A3	16	48
O=C(OCCOC(F)F)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913793	EE	On-Demand	Anodyne	SIGMAR1	33	46
O=C(OCCOC(F)F)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000853913793	EE	On-Demand	Anodyne	CACNA1I	45	40
CNc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853913804	FE	On-Demand	Anodyne	F10	17	41
CNc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853913804	FE	On-Demand	Anodyne	MMP1	17	42
CNc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853913805	FE	On-Demand	Anodyne	F10	17	41
CNc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cn1	ZINC000853913805	FE	On-Demand	Anodyne	MMP1	17	42
COC(=O)c1cn(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)nn1	ZINC000853913842	GC	On-Demand	Anodyne	PROKR1	52	31
COC(=O)c1cn(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)nn1	ZINC000853913843	GC	On-Demand	Anodyne	PROKR1	52	31
COc1cc2c(cc1OC)CN(CC(=O)OCCOC(F)F)CC2	ZINC000853913910	ED	On-Demand	Anodyne	SLC18A2	48	36
COc1cc2c(cc1OC)CN(CC(=O)OCCOC(F)F)CC2	ZINC000853913910	ED	On-Demand	Anodyne	ABCB1B	63	38
COc1cc2c(cc1OC)CN(CC(=O)OCCOC(F)F)CC2	ZINC000853913910	ED	On-Demand	Anodyne	ABCB1	26	46
CC(C)c1cccc(COC(=O)Cc2ccccc2CO)c1	ZINC000853913950	CH	On-Demand	Anodyne	CAPNS1	41	30
CC(C)c1cccc(COC(=O)Cc2ccccc2CO)c1	ZINC000853913950	CH	On-Demand	Anodyne	CAPN2	51	32
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000853913973	GG	On-Demand	Anodyne	FKBP1A	25	45
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000853913974	GG	On-Demand	Anodyne	FKBP1A	25	45
O=C(OCC1C[C@H]2C[C@@H]2C1)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000853913975	GG	On-Demand	Anodyne	FKBP1A	25	45
COC(=O)c1cn(CC(=O)OCc2cccc(C(C)C)c2)nn1	ZINC000853913991	DD	On-Demand	Anodyne	ESRRA	17	41
O=C(CCN1CCc2ccccc2C1)OCCOC(F)F	ZINC000853913999	CE	On-Demand	Anodyne	HTR7	18	43
O=C(CCN1CCc2ccccc2C1)OCCOC(F)F	ZINC000853913999	CE	On-Demand	Anodyne	NOD2	41	35
O=C(OCCOC(F)F)[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000853914000	ED	On-Demand	Anodyne	L3MBTL3	41	36
O=C(OCCOC(F)F)[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000853914001	ED	On-Demand	Anodyne	L3MBTL3	41	36
CC(C)c1cccc(COC(=O)c2cn(C(C)C)cn2)c1	ZINC000853914027	CH	On-Demand	Anodyne	ADA	27	40
C#CCOCCOC(=O)[C@@H](O)Cc1ccccc1	ZINC000853914054	BC	On-Demand	Mild	ANPEP	44	31
CC(C)c1cccc(COC(=O)[C@H]2NC(=O)O[C@H]2C)c1	ZINC000853914130	CE	On-Demand	Anodyne	NAAA	47	34
CC(C)c1cccc(COC(=O)[C@@H]2NC(=O)O[C@H]2C)c1	ZINC000853914131	CE	On-Demand	Anodyne	NAAA	47	34
CC(C)c1cccc(COC(=O)[C@H]2NC(=O)O[C@@H]2C)c1	ZINC000853914132	CE	On-Demand	Anodyne	NAAA	47	34
CC(C)c1cccc(COC(=O)[C@@H]2NC(=O)O[C@@H]2C)c1	ZINC000853914133	CE	On-Demand	Anodyne	NAAA	47	34
O=C(Cc1ccc([N+](=O)[O-])cc1Cl)OCCOC(F)F	ZINC000853914155	DF	On-Demand	Bother	SNCA	43	35
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914157	FH	On-Demand	Anodyne	FKBP1A	43	36
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914157	FH	On-Demand	Anodyne	TRY2_BOVIN	36	44
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914157	FH	On-Demand	Anodyne	HPGD	16	40
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914157	FH	On-Demand	Anodyne	MAP3K12	28	41
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914158	FH	On-Demand	Anodyne	FKBP1A	43	36
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914158	FH	On-Demand	Anodyne	TRY2_BOVIN	36	44
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914158	FH	On-Demand	Anodyne	HPGD	16	40
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C(=O)c3ccncc3)C2)c1	ZINC000853914158	FH	On-Demand	Anodyne	MAP3K12	28	41
CC(C)c1cccc(COC(=O)[C@H]2CCC(=O)N2C)c1	ZINC000853914184	CE	On-Demand	Anodyne	P2RX7	16	41
COCc1cc([N+](=O)[O-])ccc1N1CC[C@H](N(C)C(=O)N(C)C)C1	ZINC000853914217	ED	On-Demand	Bother	CACNA1D	48	33
COCc1cc([N+](=O)[O-])ccc1N1CC[C@@H](N(C)C(=O)N(C)C)C1	ZINC000853914218	ED	On-Demand	Bother	CACNA1D	48	33
CC(C)(C(=O)OCCOC(F)F)C1CCOCC1	ZINC000853914249	CE	On-Demand	Anodyne	AMY2	45	31
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	MME	58	37
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	ANPEP	46	34
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	CTSB	28	45
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	CAPNS1	52	33
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	HLA-DRB1	46	35
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	CAPN1	55	37
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	CASP1	22	46
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	CAPN2	78	35
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	ACE2	50	36
C[C@@H](NC(=O)CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853914257	DD	On-Demand	Anodyne	NPR	49	38
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCc2cccc(C(C)C)c2)CC1	ZINC000853914261	GI	On-Demand	Anodyne	PLG	26	40
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCc2cccc(C(C)C)c2)CC1	ZINC000853914261	GI	On-Demand	Anodyne	TRY2_BOVIN	72	46
CSC[C@@H](C)C(=O)N1CCC(C(=O)OCc2cccc(C(C)C)c2)CC1	ZINC000853914261	GI	On-Demand	Anodyne	ST14	63	40
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	F2	42	34
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	ACE	54	46
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	FKBP1A	115	53
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	CELA1	29	57
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	ELANE	33	42
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	CTRA_BOVIN	63	34
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	TRY1_BOVIN	58	34
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	CTSG	43	34
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	PREP	96	57
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	AMY2	43	29
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	CELA2A	51	34
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	LGMN	89	52
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	ACE2	24	49
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	KLK5	40	58
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	SLC12A5	64	37
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)OCc1ccccc1	ZINC000853914275	EF	On-Demand	Anodyne	TMPRSS11D	53	36
O=C(N[C@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914340	FG	On-Demand	Anodyne	CTRA_BOVIN	22	46
O=C(N[C@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914340	FG	On-Demand	Anodyne	CTSS	15	43
O=C(N[C@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914340	FG	On-Demand	Anodyne	CTRB_BOVIN	58	35
O=C(N[C@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914340	FG	On-Demand	Anodyne	PSMB5	43	39
O=C(N[C@@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914341	FG	On-Demand	Anodyne	CTRA_BOVIN	22	46
O=C(N[C@@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914341	FG	On-Demand	Anodyne	CTSS	15	43
O=C(N[C@@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914341	FG	On-Demand	Anodyne	CTRB_BOVIN	58	35
O=C(N[C@@H](Cc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914341	FG	On-Demand	Anodyne	PSMB5	43	39
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914342	FG	On-Demand	Anodyne	CTRA_BOVIN	22	46
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914342	FG	On-Demand	Anodyne	CTSS	15	43
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914342	FG	On-Demand	Anodyne	CTRB_BOVIN	58	35
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@H]2C[C@@H]2C1)c1cccnc1	ZINC000853914342	FG	On-Demand	Anodyne	PSMB5	43	39
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1)c1cccnc1	ZINC000853914343	FG	On-Demand	Anodyne	CTRA_BOVIN	22	46
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1)c1cccnc1	ZINC000853914343	FG	On-Demand	Anodyne	CTSS	15	43
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1)c1cccnc1	ZINC000853914343	FG	On-Demand	Anodyne	CTRB_BOVIN	58	35
O=C(N[C@H](Cc1ccccc1)C(=O)OCC1C[C@@H]2C[C@H]2C1)c1cccnc1	ZINC000853914343	FG	On-Demand	Anodyne	PSMB5	43	39
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	MME	41	34
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	ANPEP	40	38
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	PTAFR	23	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	CTRA_BOVIN	19	45
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	CTSB	23	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	PAPA1_CARPA	31	41
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	CYSP_TRYCR	43	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	CAPN2	27	40
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	CTRB_BOVIN	52	38
O=C(N[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914354	FE	On-Demand	Anodyne	BLA1_STEMA	42	34
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	MME	41	34
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	ANPEP	40	38
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	PTAFR	23	40
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	CTRA_BOVIN	19	45
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	CTSB	23	40
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	PAPA1_CARPA	31	41
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	CYSP_TRYCR	43	40
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	CAPN2	27	40
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	CTRB_BOVIN	52	38
O=C(N[C@H](Cc1ccccc1)C(=O)OCCOC(F)F)c1cccnc1	ZINC000853914355	FE	On-Demand	Anodyne	BLA1_STEMA	42	34
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)C(F)(F)F	ZINC000853914366	DD	On-Demand	Anodyne	FKBP1A	45	40
O=C(OCCOC(F)F)[C@H]1CCCN1C(=O)C(F)(F)F	ZINC000853914367	DD	On-Demand	Anodyne	FKBP1A	45	40
O=C(OCCOC(F)F)[C@@H]1CCCN1C(=O)Nc1ccc2c(c1)OCCO2	ZINC000853914408	GE	On-Demand	Anodyne	FKBP1A	40	50
O=C(OCCOC(F)F)c1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000853914414	GG	On-Demand	Anodyne	PIK3CD	21	40
O=C(OCCOC(F)F)c1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000853914414	GG	On-Demand	Anodyne	PIK3CB	32	41
CCCCS[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914516	FG	On-Demand	Anodyne	MMP13	24	42
CCCCS[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914516	FG	On-Demand	Anodyne	MMP9	22	42
CCCCS[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914516	FG	On-Demand	Anodyne	MMP1	16	41
CCCCS[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914517	FG	On-Demand	Anodyne	MMP13	24	42
CCCCS[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914517	FG	On-Demand	Anodyne	MMP9	22	42
CCCCS[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914517	FG	On-Demand	Anodyne	MMP1	16	41
CCCCS[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914518	FG	On-Demand	Anodyne	MMP13	24	42
CCCCS[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914518	FG	On-Demand	Anodyne	MMP9	22	42
CCCCS[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914518	FG	On-Demand	Anodyne	MMP1	16	41
CCCCS[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914519	FG	On-Demand	Anodyne	MMP13	24	42
CCCCS[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914519	FG	On-Demand	Anodyne	MMP9	22	42
CCCCS[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853914519	FG	On-Demand	Anodyne	MMP1	16	41
CCC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853914540	FF	On-Demand	Bother	PAPA1_CARPA	26	42
NC(=O)c1ccc(OCCC(=O)OCCOC(F)F)cc1	ZINC000853914584	DD	On-Demand	Anodyne	PLA2G4B	41	33
C#CCOCCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914589	FD	On-Demand	Mild	CTRA_BOVIN	15	42
C#CCOCCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914589	FD	On-Demand	Mild	PAPA1_CARPA	35	41
C#CCOCCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914589	FD	On-Demand	Mild	CTSL	20	41
C#CCOCCOC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914589	FD	On-Demand	Mild	CTRB_BOVIN	51	36
C#CCOCCOC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914590	FD	On-Demand	Mild	CTRA_BOVIN	15	42
C#CCOCCOC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914590	FD	On-Demand	Mild	PAPA1_CARPA	35	41
C#CCOCCOC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914590	FD	On-Demand	Mild	CTSL	20	41
C#CCOCCOC(=O)[C@H](Cc1ccccc1)NC(=O)c1cccnc1	ZINC000853914590	FD	On-Demand	Mild	CTRB_BOVIN	51	36
O=C(CNS(=O)(=O)c1ccccc1[N+](=O)[O-])OCCOC(F)F	ZINC000853914661	FC	On-Demand	Bother	COLA	79	37
C#CCOCCOC(=O)c1cc(Cl)c(Cl)cc1N	ZINC000853914701	CE	On-Demand	Mild	HTR4	30	40
O=C(COC(=O)CSCc1cccc(Cl)c1)N[C@@H](c1ccccc1)C1CC1	ZINC000853914706	HI	On-Demand	Anodyne	CACNA2D1	15	43
O=C(COC(=O)CSCc1cccc(Cl)c1)N[C@H](c1ccccc1)C1CC1	ZINC000853914707	HI	On-Demand	Anodyne	CACNA2D1	15	43
O=C(OCCOC(F)F)c1cccc(CN2CCCC2)c1	ZINC000853914739	CF	On-Demand	Anodyne	HRH2	34	42
C#CCOCCOC(=O)CCN1CCc2ccccc2C1	ZINC000853914792	CD	On-Demand	Mild	HTR7	17	42
CC(C)c1cccc(COC(=O)CNc2ccc(C(N)=O)cc2)c1	ZINC000853914796	EG	On-Demand	Anodyne	PRSS1	16	40
CC(C)c1cccc(COC(=O)C2(S(C)(=O)=O)CCC2)c1	ZINC000853914831	DF	On-Demand	Anodyne	SLC12A5	68	39
C#CCNC(=O)c1ccc(N2CC[C@H](N(C)C(=O)N(C)C)C2)nc1	ZINC000853914834	EC	On-Demand	Mild	HPGDS	24	41
C#CCNC(=O)c1ccc(N2CC[C@@H](N(C)C(=O)N(C)C)C2)nc1	ZINC000853914835	EC	On-Demand	Mild	HPGDS	24	41
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCCOC(F)F)cc1	ZINC000853914875	EE	On-Demand	Anodyne	FKBP1A	90	49
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCCOC(F)F)cc1	ZINC000853914875	EE	On-Demand	Anodyne	ELANE	28	40
COc1ccc(C(=O)N2CCC[C@@H]2C(=O)OCCOC(F)F)cc1	ZINC000853914875	EE	On-Demand	Anodyne	PREP	37	43
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCCOC(F)F)cc1	ZINC000853914877	EE	On-Demand	Anodyne	FKBP1A	90	49
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCCOC(F)F)cc1	ZINC000853914877	EE	On-Demand	Anodyne	ELANE	28	40
COc1ccc(C(=O)N2CCC[C@H]2C(=O)OCCOC(F)F)cc1	ZINC000853914877	EE	On-Demand	Anodyne	PREP	37	43
C[C@]1(C(=O)OCCOC(F)F)CCN(C(=O)OCc2ccccc2)C1	ZINC000853914887	FF	On-Demand	Anodyne	GHRHR	57	32
C[C@]1(C(=O)OCCOC(F)F)CCN(C(=O)OCc2ccccc2)C1	ZINC000853914887	FF	On-Demand	Anodyne	SLC12A5	72	39
COc1cc2c(cc1OC)CN(CC(=O)OCc1onc(C)c1[N+](=O)[O-])CC2	ZINC000853914923	GE	On-Demand	Bother	ABCB1B	60	36
COc1cc2c(cc1OC)CN(CC(=O)OCc1onc(C)c1[N+](=O)[O-])CC2	ZINC000853914923	GE	On-Demand	Bother	ABCG2	25	40
C#CCOCCOC(=O)[C@@H]1CCCN1C1CCCC1	ZINC000853915004	CD	On-Demand	Mild	FKBP1A	42	36
C#CCOCCOC(=O)[C@H]1CCCN1C1CCCC1	ZINC000853915005	CD	On-Demand	Mild	FKBP1A	42	36
CC(C)c1cccc(COC(=O)C(C)(C)S(C)(=O)=O)c1	ZINC000853915006	CF	On-Demand	Anodyne	AMY2	52	30
CC(C)(C)OC(=O)N1CCCc2cc(C(=O)OCCOC(F)F)ccc21	ZINC000853915036	FH	On-Demand	Anodyne	SRD5A1	18	44
COc1ccc2c(N3CC[C@@H](N(C)C(=O)N(C)C)C3)ccnc2c1	ZINC000853915043	EE	On-Demand	Anodyne	PDE3A	40	39
COc1ccc2c(N3CC[C@@H](N(C)C(=O)N(C)C)C3)ccnc2c1	ZINC000853915043	EE	On-Demand	Anodyne	KDR	49	40
COc1ccc2c(N3CC[C@@H](N(C)C(=O)N(C)C)C3)ccnc2c1	ZINC000853915043	EE	On-Demand	Anodyne	PDE3B	45	39
COc1ccc2c(N3CC[C@H](N(C)C(=O)N(C)C)C3)ccnc2c1	ZINC000853915044	EE	On-Demand	Anodyne	PDE3A	40	39
COc1ccc2c(N3CC[C@H](N(C)C(=O)N(C)C)C3)ccnc2c1	ZINC000853915044	EE	On-Demand	Anodyne	KDR	49	40
COc1ccc2c(N3CC[C@H](N(C)C(=O)N(C)C)C3)ccnc2c1	ZINC000853915044	EE	On-Demand	Anodyne	PDE3B	45	39
COC(=O)c1cnccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853915047	GD	On-Demand	Anodyne	MMP1	16	42
COC(=O)c1cnccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853915047	GD	On-Demand	Anodyne	PROKR1	41	30
COC(=O)c1cnccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853915048	GD	On-Demand	Anodyne	MMP1	16	42
COC(=O)c1cnccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853915048	GD	On-Demand	Anodyne	PROKR1	41	30
O=C(COC(=O)CSCc1cccc(Cl)c1)NCC1(c2ccccc2)CC1	ZINC000853915064	HH	On-Demand	Anodyne	KCNA3	43	37
O=C(COC(=O)CSCc1cccc(Cl)c1)NCC1(c2ccccc2)CC1	ZINC000853915064	HH	On-Demand	Anodyne	NPFFR1	38	45
Nc1cc(Cl)c(Cl)cc1C(=O)OCCOC(F)F	ZINC000853915114	DF	On-Demand	Anodyne	HTR4	34	40
O=C(OCCOC(F)F)C(F)(F)Cc1ccccc1	ZINC000853915163	CF	On-Demand	Anodyne	AMY2	55	31
CC(C)c1cccc(COC(=O)CNS(=O)(=O)c2ccccc2N)c1	ZINC000853915212	FE	On-Demand	Anodyne	CAPNS1	46	30
CC(C)c1cccc(COC(=O)CNS(=O)(=O)c2ccccc2N)c1	ZINC000853915212	FE	On-Demand	Anodyne	CAPN2	51	33
CC(C)(C(=O)OCCOC(F)F)c1ccccc1Br	ZINC000853915285	EH	On-Demand	Anodyne	AMY2	57	33
O=C(OCCOC(F)F)[C@@H](O)Cc1ccccc1	ZINC000853915311	CD	On-Demand	Anodyne	ANPEP	48	33
O=C(OCCOC(F)F)[C@@H](O)Cc1ccccc1	ZINC000853915311	CD	On-Demand	Anodyne	CPA1	50	37
O=C(OCCOC(F)F)[C@@H](O)Cc1ccccc1	ZINC000853915311	CD	On-Demand	Anodyne	LAP3	51	37
COC(=O)c1ccoc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853915372	FE	On-Demand	Anodyne	MMP1	17	44
COC(=O)c1ccoc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853915373	FE	On-Demand	Anodyne	MMP1	17	44
CN(c1ccccc1)[C@H]1CCN(c2nccc(N3CCCC3)n2)C1	ZINC000853915410	DF	On-Demand	Anodyne	SORD	103	40
CN(c1ccccc1)[C@@H]1CCN(c2nccc(N3CCCC3)n2)C1	ZINC000853915411	DF	On-Demand	Anodyne	SORD	103	40
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915413	GE	On-Demand	Anodyne	CACNA2D1	17	46
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915413	GE	On-Demand	Anodyne	MC4R	53	40
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915413	GE	On-Demand	Anodyne	CCR1	16	41
CC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915413	GE	On-Demand	Anodyne	DPP7	34	43
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915414	GE	On-Demand	Anodyne	CACNA2D1	17	46
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915414	GE	On-Demand	Anodyne	MC4R	53	40
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915414	GE	On-Demand	Anodyne	CCR1	16	41
CC(=O)N1CCN(C(=O)[C@H](C)OC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000853915414	GE	On-Demand	Anodyne	DPP7	34	43
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	ACHE	27	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	SSTR2	50	33
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	TACR1	32	51
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MC4R	45	41
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	NQO2	30	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	CCKAR	108	52
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	CTSL	25	41
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	BRS3	33	50
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	NMBR	38	50
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MC3R	71	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MC5R	70	41
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MTNR1A	32	43
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MTNR1B	23	43
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MMP14	23	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	GRPR	69	33
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	ECE1	49	36
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MMP11	87	38
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	CCKBR	78	43
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	GHSR	65	38
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MMP9	21	45
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	CAPN2	19	47
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MC1R	89	41
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	MMP1	21	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	KISS1R	73	36
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853915450	II	On-Demand	Anodyne	PDS	53	36
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853915507	EF	On-Demand	Bother	CACNA1C	40	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853915507	EF	On-Demand	Bother	CACNA1D	69	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853915507	EF	On-Demand	Bother	LUXR	17	45
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853915508	EF	On-Demand	Bother	CACNA1C	40	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853915508	EF	On-Demand	Bother	CACNA1D	69	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853915508	EF	On-Demand	Bother	LUXR	17	45
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853915509	EF	On-Demand	Bother	CACNA1C	40	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853915509	EF	On-Demand	Bother	CACNA1D	69	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853915509	EF	On-Demand	Bother	LUXR	17	45
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853915510	EF	On-Demand	Bother	CACNA1C	40	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853915510	EF	On-Demand	Bother	CACNA1D	69	35
O=C(NCCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853915510	EF	On-Demand	Bother	LUXR	17	45
CON(C)CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000853915515	CC	On-Demand	Bother	CACNA1C	56	38
CON(C)CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000853915515	CC	On-Demand	Bother	CACNA1D	86	38
O=C(OCc1nnc2n1CCOCC2)c1cnccc1Oc1ccccc1	ZINC000853915520	FE	On-Demand	Anodyne	GPBAR1	36	41
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915598	EG	On-Demand	Anodyne	CACNA2D1	18	46
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915598	EG	On-Demand	Anodyne	CYSP_TRYCR	35	40
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915598	EG	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915598	EG	On-Demand	Anodyne	PDS	77	41
CC[C@H](C)NC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915599	EG	On-Demand	Anodyne	CACNA2D1	18	46
CC[C@H](C)NC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915599	EG	On-Demand	Anodyne	CYSP_TRYCR	35	40
CC[C@H](C)NC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915599	EG	On-Demand	Anodyne	CAPN2	70	35
CC[C@H](C)NC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915599	EG	On-Demand	Anodyne	PDS	77	41
O=C(OCCOC(F)F)c1cc(Cc2ccccc2)[nH]n1	ZINC000853915624	CE	On-Demand	Anodyne	HAO2	41	32
O=C(CCCCN1CCOCC1)OCC1C[C@H]2C[C@@H]2C1	ZINC000853915648	CE	On-Demand	Anodyne	PAOX	17	41
O=C(CCCCN1CCOCC1)OCC1C[C@@H]2C[C@H]2C1	ZINC000853915649	CE	On-Demand	Anodyne	PAOX	17	41
O=C(CCCCN1CCOCC1)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853915650	CE	On-Demand	Anodyne	PAOX	17	41
O=C(OCCOC(F)F)c1cc(C(F)(F)F)cnc1Cl	ZINC000853915682	DG	On-Demand	Anodyne	ATF1	49	38
O=C(OCCOC(F)F)c1cc(C(F)(F)F)cnc1Cl	ZINC000853915682	DG	On-Demand	Anodyne	NFKB1	45	38
Cc1cc(N2CC[C@H](N(C)C(=O)N(C)C)C2)nc(N)n1	ZINC000853915690	CC	On-Demand	Anodyne	HRH4	49	39
Cc1nc(N2CC[C@H](N(C)C(=O)N(C)C)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853915740	GE	On-Demand	Anodyne	MTOR	18	47
Cc1nc(N2CC[C@@H](N(C)C(=O)N(C)C)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853915741	GE	On-Demand	Anodyne	MTOR	18	47
CC(C)c1cccc(COC(=O)C(C)(C)S(=O)(=O)C2CC2)c1	ZINC000853915816	DG	On-Demand	Anodyne	AMY2	49	34
O=C(CCCCN1CCOCC1)OCCOC(F)F	ZINC000853915846	CD	On-Demand	Anodyne	PAOX	17	41
COC(=O)c1sc(N2CC[C@@H](N(C)c3ccccc3)C2)nc1Cl	ZINC000853915890	FG	On-Demand	Anodyne	PARE	109	38
COC(=O)c1sc(N2CC[C@H](N(C)c3ccccc3)C2)nc1Cl	ZINC000853915893	FG	On-Demand	Anodyne	PARE	109	38
COc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915899	HI	On-Demand	Anodyne	CASP3	16	43
COc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915899	HI	On-Demand	Anodyne	PDS	40	38
COc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915901	HI	On-Demand	Anodyne	CASP3	16	43
COc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853915901	HI	On-Demand	Anodyne	PDS	40	38
CC(C)c1cccc(COC(=O)C2CCN(C3CC3)CC2)c1	ZINC000853915915	DH	On-Demand	Anodyne	FKBP1A	40	39
CC(C)c1cccc(COC(=O)C2CCN(C3CC3)CC2)c1	ZINC000853915915	DH	On-Demand	Anodyne	TRY2_BOVIN	27	40
CC(C)c1cccc(COC(=O)C2CCN(C3CC3)CC2)c1	ZINC000853915915	DH	On-Demand	Anodyne	L3MBTL3	43	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000853915926	FE	On-Demand	Mild	CACNA1D	60	36
CCOc1cccc([N+](=O)[O-])c1C(=O)OCCOC(F)F	ZINC000853915987	DE	On-Demand	Bother	CACNA1D	47	37
C[C@@](O)(Cn1ccccc1=O)C(=O)OCCOC(F)F	ZINC000853916022	CC	On-Demand	Anodyne	AMY2	52	29
CC(C)(COCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853916052	DG	On-Demand	Anodyne	AMY2	59	34
C#CCNC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916053	EE	On-Demand	Mild	CACNA2D1	16	45
C#CCNC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916053	EE	On-Demand	Mild	CTSL	25	45
C#CCNC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916053	EE	On-Demand	Mild	CTSS	15	45
C#CCNC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916053	EE	On-Demand	Mild	CTSV	35	45
C#CCNC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916053	EE	On-Demand	Mild	PDS	75	40
C#CCNC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916054	EE	On-Demand	Mild	CACNA2D1	16	45
C#CCNC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916054	EE	On-Demand	Mild	CTSL	25	45
C#CCNC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916054	EE	On-Demand	Mild	CTSS	15	45
C#CCNC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916054	EE	On-Demand	Mild	CTSV	35	45
C#CCNC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916054	EE	On-Demand	Mild	PDS	75	40
CCCC[C@@H](C)C(=O)OCCOC(F)F	ZINC000853916073	BF	On-Demand	Anodyne	NOD1	56	35
CCCC[C@H](C)C(=O)OCCOC(F)F	ZINC000853916074	BF	On-Demand	Anodyne	NOD1	56	35
NS(=O)(=O)c1ccc(C(=O)OCCOC(F)F)cc1[N+](=O)[O-]	ZINC000853916133	EC	On-Demand	Bother	CA2	21	45
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CHRM2	21	42
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CHRM1	19	42
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	DRD2	33	49
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	DRD4	63	54
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	ACHE	45	49
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	DRD3	22	49
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	KCNH2	21	42
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	HTR4	27	49
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CHRM3	30	42
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	LTA4H	22	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	SIGMAR1	54	64
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	SSTR5	61	38
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	BCHE	15	45
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CCR3	48	49
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CCR5	20	41
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	BDKRB1	15	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	FAAH	22	44
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	SLC6A5	15	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CXCR3	28	42
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	MCHR1	68	49
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CACNA1G	29	41
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	CCR8	17	45
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853916141	JI	On-Demand	Anodyne	PDS	50	38
CN(c1ccccc1)[C@H]1CCN(c2cc(C(F)(F)F)cnc2C#N)C1	ZINC000853916206	EH	On-Demand	Mild	LIPG	43	38
CN(c1ccccc1)[C@@H]1CCN(c2cc(C(F)(F)F)cnc2C#N)C1	ZINC000853916207	EH	On-Demand	Mild	LIPG	43	38
CC(C)c1cccc(COC(=O)C2(S(C)(=O)=O)CC2)c1	ZINC000853916251	CE	On-Demand	Anodyne	SLC12A5	63	38
C[C@H](CC(=O)OCCOC(F)F)c1c[nH]c2ccccc12	ZINC000853916268	CG	On-Demand	Anodyne	SSTR2	50	35
C#CCOCCOC(=O)c1cc(Br)c(OC)cc1N	ZINC000853916371	ED	On-Demand	Mild	HTR4	38	42
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853916380	IJ	On-Demand	Mild	VIPR1	31	49
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853916391	GH	On-Demand	Anodyne	ADRB3	48	38
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853916391	GH	On-Demand	Anodyne	KCNA5	18	40
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853916393	GH	On-Demand	Anodyne	ADRB3	48	38
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853916393	GH	On-Demand	Anodyne	KCNA5	18	40
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853916395	GH	On-Demand	Anodyne	ADRB3	48	38
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853916395	GH	On-Demand	Anodyne	KCNA5	18	40
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000853916396	GF	On-Demand	Bother	CACNA1D	51	33
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853916397	GH	On-Demand	Anodyne	ADRB3	48	38
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853916397	GH	On-Demand	Anodyne	KCNA5	18	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCc2cccc([N+](=O)[O-])c2)C1	ZINC000853916398	GF	On-Demand	Bother	CACNA1D	51	33
CC(C)(C(=O)OCCOC(F)F)S(=O)(=O)C1CC1	ZINC000853916434	CD	On-Demand	Anodyne	AMY2	45	31
C[C@@](O)(CCc1ccccc1)C(=O)OCCOC(F)F	ZINC000853916481	CE	On-Demand	Anodyne	AMY2	63	36
C=C(C)CN(CC)C(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916493	FH	On-Demand	Mild	PDS	33	42
C=C(C)CN(CC)C(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853916494	FH	On-Demand	Mild	PDS	33	42
O=C(OCCOC(F)F)c1ccc(CN2CCCC2)cc1	ZINC000853916502	CF	On-Demand	Anodyne	HRH3	27	45
O=C(OCCOC(F)F)c1ccc(CN2CCCC2)cc1	ZINC000853916502	CF	On-Demand	Anodyne	SIGMAR1	17	41
CN(c1ccccc1)[C@@H]1CCN(c2cc(Cl)nc(N)n2)C1	ZINC000853916521	DE	On-Demand	Anodyne	HRH4	56	48
CN(c1ccccc1)[C@H]1CCN(c2cc(Cl)nc(N)n2)C1	ZINC000853916522	DE	On-Demand	Anodyne	HRH4	56	48
COc1ccc(CC(=O)OCc2cccc(C(C)C)c2)nc1	ZINC000853916534	CG	On-Demand	Anodyne	FFAR1	35	41
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)NCc1ccccc1F	ZINC000853916638	GH	On-Demand	Anodyne	PDS	81	40
C[C@H](NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1)c1ccc(S(N)(=O)=O)cc1	ZINC000853916650	JG	On-Demand	Anodyne	CA2	54	37
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)N[C@H](C)c1ccc(S(N)(=O)=O)cc1	ZINC000853916651	JG	On-Demand	Anodyne	CA2	54	37
O=C(OCCOC(F)F)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000853916659	EF	On-Demand	Anodyne	SIGMAR1	51	41
O=C(OCCOC(F)F)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000853916660	EF	On-Demand	Anodyne	SIGMAR1	51	41
CN(c1ccccc1)[C@H]1CCN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1	ZINC000853916666	GF	On-Demand	Bother	SSTR1	15	40
CN(c1ccccc1)[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2S(C)(=O)=O)C1	ZINC000853916667	GF	On-Demand	Bother	SSTR1	15	40
O=C(OCCOC(F)F)c1ccc(C(F)(F)F)cc1N1CCCC1	ZINC000853916673	FH	On-Demand	Anodyne	MC4R	23	41
O=C(OCCOC(F)F)c1ccc(C(F)(F)F)cc1N1CCCC1	ZINC000853916673	FH	On-Demand	Anodyne	LIPG	51	37
CON(C)CCNC(=O)N[C@@H](c1cccnc1)C1CC1	ZINC000853916717	CD	On-Demand	Anodyne	KCNA5	23	42
CON(C)CCNC(=O)N[C@H](c1cccnc1)C1CC1	ZINC000853916718	CD	On-Demand	Anodyne	KCNA5	23	42
CN1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1	ZINC000853916767	FF	On-Demand	Reactive	F2RL3	44	32
CN1CC[C@H](NC(=O)NNc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1	ZINC000853916770	FF	On-Demand	Reactive	F2RL3	44	32
C[C@@](O)(CCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853916814	CF	On-Demand	Anodyne	GRM3	17	41
C[C@@](O)(CCc1ccccc1)C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853916814	CF	On-Demand	Anodyne	AMY2	55	33
N#Cc1ccc(C[C@H](C#N)C(=O)OCCOC(F)F)cc1	ZINC000853916831	CE	On-Demand	Mild	CTRB_BOVIN	45	33
N#Cc1ccc(C[C@@H](C#N)C(=O)OCCOC(F)F)cc1	ZINC000853916833	CE	On-Demand	Mild	CTRB_BOVIN	45	33
CC(C)c1cccc(COC(=O)Cc2ccccc2S(C)(=O)=O)c1	ZINC000853916876	EG	On-Demand	Anodyne	CAPNS1	46	30
CC(C)c1cccc(COC(=O)Cc2ccccc2S(C)(=O)=O)c1	ZINC000853916876	EG	On-Demand	Anodyne	CAPN2	49	34
Cn1c(S)nnc1CCNC(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000853916886	FD	On-Demand	Bother	CACNA1D	43	33
COCc1cc([N+](=O)[O-])ccc1N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853916892	EG	On-Demand	Bother	F2RL3	47	40
COCc1cc([N+](=O)[O-])ccc1N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853916895	EG	On-Demand	Bother	F2RL3	47	40
C#CCC(CC#C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853916953	EE	On-Demand	Mild	MMP1	16	43
C#CCC(CC#C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853916954	EE	On-Demand	Mild	MMP1	16	43
O=C(COc1ccc(CO)cc1)OCCOC(F)F	ZINC000853916958	CD	On-Demand	Anodyne	PLA2G4B	81	37
O=C(OCC1C[C@@H]2C[C@H]2C1)c1cc(=O)c2ccc(F)cc2o1	ZINC000853916968	DG	On-Demand	Anodyne	KCNH2	15	45
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)c1cc(=O)c2ccc(F)cc2o1	ZINC000853916969	DG	On-Demand	Anodyne	KCNH2	15	45
O=C(OCC1C[C@H]2C[C@@H]2C1)c1cc(=O)c2ccc(F)cc2o1	ZINC000853916970	DG	On-Demand	Anodyne	KCNH2	15	45
C#CCOCCOC(=O)COc1ccc(CO)cc1	ZINC000853916989	CC	On-Demand	Mild	PLA2G4B	62	36
Nc1cc(C(=O)OCCOC(F)F)ccc1S(N)(=O)=O	ZINC000853917013	DC	On-Demand	Anodyne	CA2	26	41
Nc1cc(C(=O)OCCOC(F)F)ccc1S(N)(=O)=O	ZINC000853917013	DC	On-Demand	Anodyne	CA4	18	41
C[C@@H](CO)CCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853917047	EF	On-Demand	Reactive	CSNK1D	39	43
C[C@@H](CO)CCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853917047	EF	On-Demand	Reactive	TMPRSS6	46	33
C[C@H](CO)CCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853917048	EF	On-Demand	Reactive	CSNK1D	39	43
C[C@H](CO)CCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853917048	EF	On-Demand	Reactive	TMPRSS6	46	33
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)Nc1ccccc1Br	ZINC000853917081	IJ	On-Demand	Anodyne	PDS	69	37
CC(C)c1cccc(COC(=O)CCCCN2CCOCC2)c1	ZINC000853917131	DG	On-Demand	Anodyne	CASR	53	46
CC(C)c1cccc(COC(=O)CCCCN2CCOCC2)c1	ZINC000853917131	DG	On-Demand	Anodyne	EPHX2	20	41
Cc1cc(N2CC[C@H](N(C)c3ccccc3)C2)nc(N)n1	ZINC000853917134	CE	On-Demand	Anodyne	HRH4	54	57
CC(=O)c1ccc(N2CC[C@H](N(C)c3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000853917140	EH	On-Demand	Bother	TAAR1	16	45
CC(=O)c1ccc(N2CC[C@@H](N(C)c3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000853917141	EH	On-Demand	Bother	TAAR1	16	45
O=C(OCc1nnc2n1CCOCC2)c1ccc(CN2CCCC2)cc1	ZINC000853917154	FD	On-Demand	Anodyne	HRH3	15	41
C#CCCN(CCOC)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000853917173	DD	On-Demand	Mild	CACNA1C	53	43
C#CCCN(CCOC)C(=O)NCCc1cccc([N+](=O)[O-])c1	ZINC000853917173	DD	On-Demand	Mild	CACNA1D	83	43
C#CCOCCOC(=O)[C@@](C)(O)CCc1ccccc1	ZINC000853917186	CD	On-Demand	Mild	AMY2	59	36
C#CCOCCOC(=O)[C@](C)(O)CCc1ccccc1	ZINC000853917187	CD	On-Demand	Mild	AMY2	59	36
CC(C)c1cccc(COC(=O)[C@@](C)(O)C2CC2)c1	ZINC000853917208	CG	On-Demand	Anodyne	AMY2	52	35
CC(C)c1cccc(COC(=O)[C@](C)(O)C2CC2)c1	ZINC000853917210	CG	On-Demand	Anodyne	AMY2	52	35
CCCC[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917258	EG	On-Demand	Anodyne	MMP1	24	44
CCCC[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917260	EG	On-Demand	Anodyne	MMP1	24	44
CCCC[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917261	EG	On-Demand	Anodyne	MMP1	24	44
CCCC[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917262	EG	On-Demand	Anodyne	MMP1	24	44
O=C(OCCOC(F)F)c1ccnc(NC(=O)C2CC2)c1	ZINC000853917298	DD	On-Demand	Anodyne	GSK3B	16	42
O=C(OCCOC(F)F)c1ccnc(NC(=O)C2CC2)c1	ZINC000853917298	DD	On-Demand	Anodyne	TYK2	64	41
CC(C)c1cccc(COC(=O)[C@@H](O)c2cccnc2)c1	ZINC000853917313	CF	On-Demand	Anodyne	TBXAS1	15	40
CC(C)c1cccc(COC(=O)[C@H](O)c2cccnc2)c1	ZINC000853917314	CF	On-Demand	Anodyne	TBXAS1	15	40
O=C(NC[C@H](O)c1cccc2ccccc12)N[C@@H](c1cccnc1)C1CC1	ZINC000853917318	FH	On-Demand	Anodyne	KCNA5	18	41
O=C(NC[C@@H](O)c1cccc2ccccc12)N[C@@H](c1cccnc1)C1CC1	ZINC000853917319	FH	On-Demand	Anodyne	KCNA5	18	41
O=C(NC[C@@H](O)c1cccc2ccccc12)N[C@H](c1cccnc1)C1CC1	ZINC000853917320	FH	On-Demand	Anodyne	KCNA5	18	41
O=C(NC[C@H](O)c1cccc2ccccc12)N[C@H](c1cccnc1)C1CC1	ZINC000853917321	FH	On-Demand	Anodyne	KCNA5	18	41
COc1cc(N)c(C(=O)OCCOC(F)F)cc1Br	ZINC000853917329	EE	On-Demand	Anodyne	HTR4	40	41
CC(=O)N1CCC[C@](O)(C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853917330	DE	On-Demand	Anodyne	SLC12A5	82	42
CC(=O)N1CCC[C@@](O)(C(=O)OCc2cccc(C(C)C)c2)C1	ZINC000853917331	DE	On-Demand	Anodyne	SLC12A5	82	42
C[C@H](CO)CCCNC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917348	EF	On-Demand	Anodyne	ADRB2	26	41
C[C@H](CO)CCCNC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917348	EF	On-Demand	Anodyne	ADRB1	16	50
C[C@H](CO)CCCNC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917349	EF	On-Demand	Anodyne	ADRB2	26	41
C[C@H](CO)CCCNC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917349	EF	On-Demand	Anodyne	ADRB1	16	50
C[C@@H](CO)CCCNC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917350	EF	On-Demand	Anodyne	ADRB2	26	41
C[C@@H](CO)CCCNC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917350	EF	On-Demand	Anodyne	ADRB1	16	50
C[C@@H](CO)CCCNC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917351	EF	On-Demand	Anodyne	ADRB2	26	41
C[C@@H](CO)CCCNC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853917351	EF	On-Demand	Anodyne	ADRB1	16	50
C[C@H](CC(=O)OCc1nnc2n1CCOCC2)c1c[nH]c2ccccc12	ZINC000853917367	FF	On-Demand	Anodyne	SSTR2	60	33
C[C@H](CC(=O)OCc1nnc2n1CCOCC2)c1c[nH]c2ccccc12	ZINC000853917367	FF	On-Demand	Anodyne	GHSR	41	36
CC(C)c1cccc(COC(=O)CCc2ccccc2C(N)=O)c1	ZINC000853917390	EH	On-Demand	Anodyne	PTGER3	58	36
CC(C)c1cccc(COC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)c1	ZINC000853917400	EI	On-Demand	Mild	CTRB_BOVIN	47	32
CC(C)c1cccc(COC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)c1	ZINC000853917401	EI	On-Demand	Mild	CTRB_BOVIN	47	32
CC(C)c1cccc(COC(=O)C2CCC(NC(=O)C3CC3)CC2)c1	ZINC000853917404	EH	On-Demand	Anodyne	EPHX2	17	40
CS(=O)(=O)Nc1cc(C(=O)OCCOC(F)F)cc(C(F)(F)F)c1	ZINC000853917428	GE	On-Demand	Anodyne	ATF1	31	43
CS(=O)(=O)Nc1cc(C(=O)OCCOC(F)F)cc(C(F)(F)F)c1	ZINC000853917428	GE	On-Demand	Anodyne	NFKB1	28	43
CC[C@@H](C)CCC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917443	EG	On-Demand	Anodyne	MMP1	17	47
CC[C@@H](C)CCC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917444	EG	On-Demand	Anodyne	MMP1	17	47
COC[C@@H](NC(=O)OC(C)(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853917452	FD	On-Demand	Bother	GSTM2	15	44
COC[C@H](NC(=O)OC(C)(C)C)C(=O)OCc1onc(C)c1[N+](=O)[O-]	ZINC000853917453	FD	On-Demand	Bother	GSTM2	15	44
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@@H](c1cccnc1)C1CC1	ZINC000853917454	FD	On-Demand	Anodyne	KCNA5	20	40
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@H](c1cccnc1)C1CC1	ZINC000853917455	FD	On-Demand	Anodyne	KCNA5	20	40
C#CCOCCOC(=O)[C@](C)(O)C1CC1	ZINC000853917525	BC	On-Demand	Mild	AMY2	43	29
C#CCOCCOC(=O)[C@@](C)(O)C1CC1	ZINC000853917526	BC	On-Demand	Mild	AMY2	43	29
O=C(CCSCc1ccccc1)OCCOC(F)F	ZINC000853917549	CG	On-Demand	Anodyne	CACNA2D1	34	50
CC[C@H](C)[C@@H](OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917563	EE	On-Demand	Anodyne	MMP1	18	43
CC[C@H](C)[C@@H](OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917563	EE	On-Demand	Anodyne	PROKR1	59	32
CC[C@H](C)[C@H](OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917564	EE	On-Demand	Anodyne	MMP1	18	43
CC[C@H](C)[C@H](OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917564	EE	On-Demand	Anodyne	PROKR1	59	32
CC[C@H](C)[C@@H](OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917565	EE	On-Demand	Anodyne	MMP1	18	43
CC[C@H](C)[C@@H](OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917565	EE	On-Demand	Anodyne	PROKR1	59	32
CC[C@H](C)[C@H](OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917566	EE	On-Demand	Anodyne	MMP1	18	43
CC[C@H](C)[C@H](OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917566	EE	On-Demand	Anodyne	PROKR1	59	32
COC(=O)c1sc(N2CC[C@@H](N(C)C(=O)N(C)C)C2)nc1Cl	ZINC000853917568	ED	On-Demand	Anodyne	PARE	91	39
COC(=O)c1sc(N2CC[C@H](N(C)C(=O)N(C)C)C2)nc1Cl	ZINC000853917569	ED	On-Demand	Anodyne	PARE	91	39
C[C@H](CO)CCCNC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853917594	FG	On-Demand	Anodyne	CCKAR	21	41
C[C@@H](CO)CCCNC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853917595	FG	On-Demand	Anodyne	CCKAR	21	41
O=C(OCCOC(F)F)c1cc2cc(Cl)sc2[nH]1	ZINC000853917630	CG	On-Demand	Anodyne	PYGL	21	40
C#Cc1ccccc1CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917652	FF	On-Demand	Mild	SIGMAR1	16	42
C#Cc1ccccc1CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917654	FF	On-Demand	Mild	SIGMAR1	16	42
C[C@@](O)(C(=O)OCCOC(F)F)C1CC1	ZINC000853917660	BC	On-Demand	Anodyne	AMY2	48	33
COc1cccc(C2(C(=O)OCc3nnc4n3CCOCC4)CC2)c1	ZINC000853917708	ED	On-Demand	Anodyne	DRD4	42	32
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2C(=O)OCCOC(F)F)CC1	ZINC000853917766	FG	On-Demand	Anodyne	GPR119	26	41
C#CCOCCOC(=O)[C@](C)(O)C1CCC1	ZINC000853917804	BC	On-Demand	Mild	AMY2	48	33
C#CCOCCOC(=O)[C@@](C)(O)C1CCC1	ZINC000853917805	BC	On-Demand	Mild	AMY2	48	33
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000853917819	IF	On-Demand	Anodyne	MC4R	62	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000853917819	IF	On-Demand	Anodyne	DPP7	20	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)N1CCN(c2ncccn2)CC1	ZINC000853917819	IF	On-Demand	Anodyne	AKT1	31	40
CCC(=O)Nc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917843	GG	On-Demand	Anodyne	MMP1	17	41
CCC(=O)Nc1ccccc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917843	GG	On-Demand	Anodyne	HCAR2	16	45
CCC(=O)Nc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917844	GG	On-Demand	Anodyne	MMP1	17	41
CCC(=O)Nc1ccccc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853917844	GG	On-Demand	Anodyne	HCAR2	16	45
O=C(OCC1C[C@H]2C[C@@H]2C1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000853917857	ED	On-Demand	Anodyne	ADAM10	37	40
O=C(OCC1C[C@@H]2C[C@H]2C1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000853917858	ED	On-Demand	Anodyne	ADAM10	37	40
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000853917859	ED	On-Demand	Anodyne	ADAM10	37	40
CC(C)c1cccc(COC(=O)COc2ccc(CO)cc2)c1	ZINC000853917915	DG	On-Demand	Anodyne	MAOB	17	40
CC(C)c1cccc(COC(=O)COc2ccc(CO)cc2)c1	ZINC000853917915	DG	On-Demand	Anodyne	PLA2G4B	41	37
CC(C)c1cccc(COC(=O)COc2ccc(CO)cc2)c1	ZINC000853917915	DG	On-Demand	Anodyne	FFAR1	48	43
O=C(OCCOC(F)F)[C@H]1CCN(c2ccccc2Cl)C1	ZINC000853917959	DF	On-Demand	Anodyne	KCNQ2	45	33
O=C(OCCOC(F)F)[C@@H]1CCN(c2ccccc2Cl)C1	ZINC000853917960	DF	On-Demand	Anodyne	KCNQ2	45	33
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853918021	JJ	On-Demand	Anodyne	PDS	42	35
Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)OC(=O)CSCc1cccc(Cl)c1	ZINC000853918026	JJ	On-Demand	Anodyne	PDS	42	35
CC(C)c1cccc(COC(=O)c2cn(C3CCOCC3)nn2)c1	ZINC000853918049	EG	On-Demand	Anodyne	ESRRA	16	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](c1cccnc1)C1CC1	ZINC000853918082	GF	On-Demand	Clean	ADRB3	17	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](c1cccnc1)C1CC1	ZINC000853918082	GF	On-Demand	Clean	KCNA5	16	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H](c1cccnc1)C1CC1	ZINC000853918082	GF	On-Demand	Clean	NAMPT	59	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918083	GF	On-Demand	Clean	ADRB3	17	43
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918083	GF	On-Demand	Clean	KCNA5	16	40
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918083	GF	On-Demand	Clean	NAMPT	59	40
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853918126	IH	On-Demand	Anodyne	MC4R	110	45
C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853918126	IH	On-Demand	Anodyne	DPP7	28	40
CC(C)(C(=O)OCCOC(F)F)c1ccccc1[N+](=O)[O-]	ZINC000853918200	DF	On-Demand	Bother	COLA	51	33
CC(C)(C(=O)OCCOC(F)F)c1ccccc1[N+](=O)[O-]	ZINC000853918200	DF	On-Demand	Bother	AMY2	56	33
Cc1cncc(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)c1	ZINC000853918205	CE	On-Demand	Anodyne	NAMPT	23	49
Cc1cncc(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)c1	ZINC000853918206	CE	On-Demand	Anodyne	NAMPT	23	49
Cc1cncc(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853918207	CE	On-Demand	Anodyne	NAMPT	23	49
Cc1cncc(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)c1	ZINC000853918208	CE	On-Demand	Anodyne	NAMPT	23	49
CC(C)c1cccc(COC(=O)[C@@H]2CC[C@H](C(=O)N3CCCC3)O2)c1	ZINC000853918236	EG	On-Demand	Anodyne	PREP	52	40
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)[nH]1	ZINC000853918317	FD	On-Demand	Anodyne	MMP1	27	49
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)[nH]1	ZINC000853918317	FD	On-Demand	Anodyne	PROKR1	47	31
C=C[C@H](O)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918330	DC	On-Demand	Mild	MMP1	15	43
C=C[C@@H](O)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918331	DC	On-Demand	Mild	MMP1	15	43
C=C[C@H](O)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918332	DC	On-Demand	Mild	MMP1	15	43
C=C[C@@H](O)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918333	DC	On-Demand	Mild	MMP1	15	43
Cc1cncc(CNC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853918365	FF	On-Demand	Anodyne	GPR119	30	40
CC(C)(C(=O)OCCOC(F)F)C1CC1	ZINC000853918438	BE	On-Demand	Anodyne	AMY2	49	33
O=C(OCC1C[C@H]2C[C@@H]2C1)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918455	FF	On-Demand	Anodyne	MMP13	26	46
O=C(OCC1C[C@H]2C[C@@H]2C1)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918455	FF	On-Demand	Anodyne	MMP2	17	46
O=C(OCC1C[C@@H]2C[C@H]2C1)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918456	FF	On-Demand	Anodyne	MMP13	26	46
O=C(OCC1C[C@@H]2C[C@H]2C1)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918456	FF	On-Demand	Anodyne	MMP2	17	46
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918457	FF	On-Demand	Anodyne	MMP13	26	46
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918457	FF	On-Demand	Anodyne	MMP2	17	46
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918460	FF	On-Demand	Anodyne	ADRB3	48	39
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918460	FF	On-Demand	Anodyne	KCNA5	18	40
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918460	FF	On-Demand	Anodyne	C3AR1	29	42
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918461	FF	On-Demand	Anodyne	ADRB3	48	39
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918461	FF	On-Demand	Anodyne	KCNA5	18	40
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@@H](c1cccnc1)C1CC1	ZINC000853918461	FF	On-Demand	Anodyne	C3AR1	29	42
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853918462	FF	On-Demand	Anodyne	ADRB3	48	39
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853918462	FF	On-Demand	Anodyne	KCNA5	18	40
O=C(NC[C@H](O)c1cc(F)c(F)c(F)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853918462	FF	On-Demand	Anodyne	C3AR1	29	42
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853918463	FF	On-Demand	Anodyne	ADRB3	48	39
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853918463	FF	On-Demand	Anodyne	KCNA5	18	40
O=C(NC[C@@H](O)c1cc(F)c(F)c(F)c1)N[C@H](c1cccnc1)C1CC1	ZINC000853918463	FF	On-Demand	Anodyne	C3AR1	29	42
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCOC(F)F)C(F)(F)F	ZINC000853918472	EE	On-Demand	Anodyne	CTSK	17	42
CO[C@@](C)(C(=O)OCCOC(F)F)C1CC1	ZINC000853918512	BD	On-Demand	Anodyne	AMY2	46	32
CC(C)c1cccc(COC(=O)[C@H]2CCCN(S(N)(=O)=O)C2)c1	ZINC000853918515	ED	On-Demand	Anodyne	FKBP1A	58	36
CC(C)c1cccc(COC(=O)[C@H]2CCCN(S(N)(=O)=O)C2)c1	ZINC000853918515	ED	On-Demand	Anodyne	TRY2_BOVIN	42	43
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(S(N)(=O)=O)C2)c1	ZINC000853918516	ED	On-Demand	Anodyne	FKBP1A	58	36
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(S(N)(=O)=O)C2)c1	ZINC000853918516	ED	On-Demand	Anodyne	TRY2_BOVIN	42	43
CC(C)c1cccc(COC(=O)c2ncccc2Cl)c1	ZINC000853918595	CI	On-Demand	Anodyne	NR1H4	45	38
C#CCOCCOC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918612	FD	On-Demand	Mild	MMP13	27	44
C#CCOCCOC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918612	FD	On-Demand	Mild	MMP2	19	44
C#CCOCCOC(=O)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918612	FD	On-Demand	Mild	MMP8	15	44
O=C(OCCOC(F)F)[C@H]1CCN(c2ccccc2F)C1	ZINC000853918618	DE	On-Demand	Anodyne	SLC6A1	43	32
O=C(OCCOC(F)F)[C@@H]1CCN(c2ccccc2F)C1	ZINC000853918619	DE	On-Demand	Anodyne	SLC6A1	43	32
C#CC[C@]1(C(=O)OCc2onc(C)c2[N+](=O)[O-])CCCN1C(=O)OC(C)(C)C	ZINC000853918631	GF	On-Demand	Mild	SLC12A5	47	34
C#CC[C@@]1(C(=O)OCc2onc(C)c2[N+](=O)[O-])CCCN1C(=O)OC(C)(C)C	ZINC000853918632	GF	On-Demand	Mild	SLC12A5	47	34
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918635	FD	On-Demand	Anodyne	MMP13	29	46
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918635	FD	On-Demand	Anodyne	MMP2	18	46
O=C(OCCOC(F)F)C1(S(=O)(=O)c2ccccc2)CCOCC1	ZINC000853918635	FD	On-Demand	Anodyne	MMP8	15	46
Cc1ccccc1C1(C(=O)OCc2nnc3n2CCOCC3)CCCC1	ZINC000853918650	FF	On-Demand	Anodyne	SLC12A5	42	32
COC(=O)C[C@@H](C)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918658	FD	On-Demand	Anodyne	MMP1	36	48
COC(=O)C[C@@H](C)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918658	FD	On-Demand	Anodyne	PROKR1	53	32
COC(=O)C[C@@H](C)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918659	FD	On-Demand	Anodyne	MMP1	36	48
COC(=O)C[C@@H](C)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853918659	FD	On-Demand	Anodyne	PROKR1	53	32
CC(C)c1cccc(COC(=O)c2cn(C)nn2)c1	ZINC000853918665	CE	On-Demand	Anodyne	ESRRA	17	42
O=C(Cc1cncn1Cc1ccccc1)OCCOC(F)F	ZINC000853918685	DE	On-Demand	Anodyne	CYP11B1	16	55
O=C(OCCOC(F)F)c1c[nH]nc1-c1ccccn1	ZINC000853918827	CD	On-Demand	Anodyne	TGFBR1	20	42
CCC(=O)Nc1ccccc1C(=O)OCC1C[C@@H]2C[C@H]2C1	ZINC000853918937	CG	On-Demand	Anodyne	FAS	17	42
CCC(=O)Nc1ccccc1C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1	ZINC000853918938	CG	On-Demand	Anodyne	FAS	17	42
CCC(=O)Nc1ccccc1C(=O)OCC1C[C@H]2C[C@@H]2C1	ZINC000853918939	CG	On-Demand	Anodyne	FAS	17	42
CC(C)c1cccc(COC(=O)c2cn(C(C)C)nn2)c1	ZINC000853918962	CG	On-Demand	Anodyne	ESRRA	17	41
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1C	ZINC000853918969	GD	On-Demand	Anodyne	MMP1	28	46
COC(=O)c1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1C	ZINC000853918969	GD	On-Demand	Anodyne	PROKR1	42	30
CC(C)c1cccc(COC(=O)c2cn(C)cn2)c1	ZINC000853919092	CF	On-Demand	Anodyne	SLC6A9	37	40
C[C@@](O)(C(=O)OCCOC(F)F)C1CCC1	ZINC000853919117	BD	On-Demand	Anodyne	AMY2	53	36
Cc1cncc(CNC(=O)N2CC(O)(c3ccc(Br)cc3)C2)c1	ZINC000853919139	GF	On-Demand	Anodyne	NAMPT	17	41
CCC(=O)Nc1ccccc1C(=O)OCCOC(F)F	ZINC000853919161	CE	On-Demand	Anodyne	FAS	17	42
CNc1nc(C)cc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853919228	FD	On-Demand	Anodyne	MMP13	15	41
CNc1nc(C)cc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853919228	FD	On-Demand	Anodyne	PROKR1	53	31
CNc1nc(C)cc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853919229	FD	On-Demand	Anodyne	MMP13	15	41
CNc1nc(C)cc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)n1	ZINC000853919229	FD	On-Demand	Anodyne	PROKR1	53	31
O=C(OCc1nnc2n1CCOCC2)C1(Cc2cccc(F)c2)CCCCC1	ZINC000853919234	GG	On-Demand	Anodyne	SLC12A5	62	35
CC(C)(C(=O)OCCOC(F)F)c1ccc2c(c1)OCO2	ZINC000853919312	DE	On-Demand	Anodyne	AMY2	55	31
C[C@@H](C(=O)OCCOC(F)F)c1ccc2c(c1)OCO2	ZINC000853919334	CE	On-Demand	Anodyne	EDNRB	43	38
C[C@@H](C(=O)OCCOC(F)F)c1ccc2c(c1)OCO2	ZINC000853919334	CE	On-Demand	Anodyne	EDNRA	44	38
C[C@H](C(=O)OCCOC(F)F)c1ccc2c(c1)OCO2	ZINC000853919335	CE	On-Demand	Anodyne	EDNRB	43	38
C[C@H](C(=O)OCCOC(F)F)c1ccc2c(c1)OCO2	ZINC000853919335	CE	On-Demand	Anodyne	EDNRA	44	38
O=C(OCCOC(F)F)C1(Cc2ccccc2)CCOCC1	ZINC000853919380	DF	On-Demand	Anodyne	SLC12A5	46	33
O=C(OCc1nnc2n1CCOCC2)C1(Cc2ccccc2)CCOCC1	ZINC000853919480	FD	On-Demand	Anodyne	SLC12A5	70	37
C#CCOCCOC(=O)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853919491	CC	On-Demand	Mild	CACNA1D	60	39
C#CCOCCOC(=O)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853919492	CC	On-Demand	Mild	CACNA1D	60	39
O=C(OCCOC(F)F)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853919541	CD	On-Demand	Bother	CACNA1C	52	38
O=C(OCCOC(F)F)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853919541	CD	On-Demand	Bother	CACNA1D	83	37
O=C(OCCOC(F)F)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853919542	CD	On-Demand	Bother	CACNA1C	52	38
O=C(OCCOC(F)F)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853919542	CD	On-Demand	Bother	CACNA1D	83	37
CC(C)(C)OC(=O)N1CC[C@@](C(=O)OCCOC(F)F)(c2ccccc2)C1	ZINC000853919652	GG	On-Demand	Anodyne	GHRHR	43	31
CC(C)(C)OC(=O)N1CC[C@](C(=O)OCCOC(F)F)(c2ccccc2)C1	ZINC000853919653	GG	On-Demand	Anodyne	GHRHR	43	31
C#C[C@H](Nc1ccc(C(=O)Nc2ccccc2)nn1)C1CCOCC1	ZINC000853919661	EF	On-Demand	Mild	NR2E3	59	33
C#C[C@@H](Nc1ccc(C(=O)Nc2ccccc2)nn1)C1CCOCC1	ZINC000853919662	EF	On-Demand	Mild	NR2E3	59	33
O=C(OCCOC(F)F)c1cc2ccncc2s1	ZINC000853919687	CF	On-Demand	Anodyne	SELE	53	32
O=C(OCCOC(F)F)c1cc2ccncc2s1	ZINC000853919687	CF	On-Demand	Anodyne	ICAM1	50	32
CC(C)c1cccc(COC(=O)C2(C)CCC(=O)CC2)c1	ZINC000853919744	CI	On-Demand	Anodyne	SLC12A5	61	33
CC(C)c1cccc(COC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000853919745	EG	On-Demand	Bother	CACNA1C	61	42
CC(C)c1cccc(COC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000853919745	EG	On-Demand	Bother	CACNA1D	96	42
CC(C)c1cccc(COC(=O)[C@@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000853919745	EG	On-Demand	Bother	ACR	18	45
CC(C)c1cccc(COC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000853919746	EG	On-Demand	Bother	CACNA1C	61	42
CC(C)c1cccc(COC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000853919746	EG	On-Demand	Bother	CACNA1D	96	42
CC(C)c1cccc(COC(=O)[C@H](O)c2cccc([N+](=O)[O-])c2)c1	ZINC000853919746	EG	On-Demand	Bother	ACR	18	45
CCC[C@H](OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853919771	EE	On-Demand	Anodyne	MMP1	34	45
CCC[C@H](OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853919772	EE	On-Demand	Anodyne	MMP1	34	45
CCC[C@@H](OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853919773	EE	On-Demand	Anodyne	MMP1	34	45
CCC[C@@H](OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853919774	EE	On-Demand	Anodyne	MMP1	34	45
O=C(OCCOC(F)F)c1cc(Cl)c(F)cc1Cl	ZINC000853919779	DH	On-Demand	Anodyne	Q9FYV8_MAIZE	34	42
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853919792	DE	On-Demand	Bother	CACNA1C	41	36
O=C(CCC(=O)c1cccc([N+](=O)[O-])c1)OCCOC(F)F	ZINC000853919792	DE	On-Demand	Bother	CACNA1D	65	35
C[C@@H](NC(=O)N1CCCC[C@H]1c1nc[nH]n1)c1ccc[nH]1	ZINC000853919845	CE	On-Demand	Anodyne	CPT1A	82	36
C[C@@H](NC(=O)N1CCCC[C@@H]1c1nc[nH]n1)c1ccc[nH]1	ZINC000853919846	CE	On-Demand	Anodyne	CPT1A	82	36
O=C(CCc1cccc(OC(F)F)c1)OCCOC(F)F	ZINC000853919866	DG	On-Demand	Anodyne	CRTM	47	32
C#C[C@@H](Nc1ncnc2c(C)csc12)C1CCOCC1	ZINC000853919913	CF	On-Demand	Mild	LPAR2	17	40
C#C[C@H](Nc1ncnc2c(C)csc12)C1CCOCC1	ZINC000853919915	CF	On-Demand	Mild	LPAR2	17	40
COCCn1cc(C(=O)OCc2cccc(C(C)C)c2)nn1	ZINC000853919920	DE	On-Demand	Anodyne	ESRRA	16	41
CC(C)c1cccc(COC(=O)[C@]2(O)CCOC2)c1	ZINC000853919922	CE	On-Demand	Anodyne	SLC12A5	45	33
CC(C)c1cccc(COC(=O)[C@@]2(O)CCOC2)c1	ZINC000853919924	CE	On-Demand	Anodyne	SLC12A5	45	33
CC(C)(C(=O)OCCOC(F)F)C1CCC1	ZINC000853919989	BF	On-Demand	Anodyne	AMY2	54	37
O=C(OCCOC(F)F)[C@@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000853920009	EE	On-Demand	Anodyne	PDE6D	41	38
O=C(OCCOC(F)F)[C@H]1CCc2nnc(-c3ccccc3)n2C1	ZINC000853920010	EE	On-Demand	Anodyne	PDE6D	41	38
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1cccnc1	ZINC000853920049	CD	On-Demand	Anodyne	NAMPT	23	44
COc1cc(N)c(C(=O)OCC2C[C@@H]3C[C@H]3C2)cc1S(C)(=O)=O	ZINC000853920072	ED	On-Demand	Anodyne	HTR4	56	39
COc1cc(N)c(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)cc1S(C)(=O)=O	ZINC000853920073	ED	On-Demand	Anodyne	HTR4	56	39
COc1cc(N)c(C(=O)OCC2C[C@H]3C[C@@H]3C2)cc1S(C)(=O)=O	ZINC000853920074	ED	On-Demand	Anodyne	HTR4	56	39
C#CCOCCOC(=O)C[C@@](O)(CC)c1ccccc1	ZINC000853920079	CD	On-Demand	Mild	AMY2	54	36
C#CCOCCOC(=O)C[C@](O)(CC)c1ccccc1	ZINC000853920080	CD	On-Demand	Mild	AMY2	54	36
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000853920105	DE	On-Demand	Bother	SLC27A4	45	32
C#CCOCCOC(=O)c1cc(S(C)(=O)=O)c(OC)cc1N	ZINC000853920109	EC	On-Demand	Mild	HTR4	31	40
O=C(Cc1ccccc1OC1CCCC1)OCCOC(F)F	ZINC000853920116	DG	On-Demand	Anodyne	AMY2	45	32
CC(C)c1cccc(COC(=O)CS(=O)(=O)C2CC2)c1	ZINC000853920159	CE	On-Demand	Anodyne	AMY2	44	31
COc1cccc(Oc2ccc(C(=O)OCCOC(F)F)nc2)c1	ZINC000853920193	EG	On-Demand	Anodyne	MTNR1A	26	40
COc1cccc(Oc2ccc(C(=O)OCCOC(F)F)nc2)c1	ZINC000853920193	EG	On-Demand	Anodyne	MTNR1B	26	40
CC(C)c1cccc(COC(=O)C2(CF)CCOCC2)c1	ZINC000853920283	CH	On-Demand	Anodyne	SLC12A5	50	32
C[C@@](O)(C(=O)OCCOC(F)F)c1ccc(Cl)cc1	ZINC000853920304	CE	On-Demand	Anodyne	AMY2	53	30
CC(C)(C)N1C[C@@H](CNc2nccc(N3CCCC3)n2)CC1=O	ZINC000853920331	DE	On-Demand	Anodyne	MRGPRX1	41	35
CC(C)(C)N1C[C@H](CNc2nccc(N3CCCC3)n2)CC1=O	ZINC000853920334	DE	On-Demand	Anodyne	MRGPRX1	41	35
C[C@@](O)(C(=O)OCCOC(F)F)c1ccccc1	ZINC000853920342	CD	On-Demand	Anodyne	CHRM4	15	43
C[C@@](O)(C(=O)OCCOC(F)F)c1ccccc1	ZINC000853920342	CD	On-Demand	Anodyne	AMY2	72	43
O=C(OCCOC(F)F)c1cc([N+](=O)[O-])ccc1C(F)(F)F	ZINC000853920414	EG	On-Demand	Bother	CACNA1D	46	34
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000853920436	CG	On-Demand	Anodyne	SLC6A4	16	46
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000853920436	CG	On-Demand	Anodyne	SLC6A3	39	46
O=C(Cc1cc2cc(Cl)ccc2[nH]1)OCCOC(F)F	ZINC000853920452	DG	On-Demand	Anodyne	PYGL	57	40
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000853920453	CG	On-Demand	Anodyne	MDM2	40	36
CCO/C=C/C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853920500	DD	On-Demand	Anodyne	MMP1	17	43
CCO/C=C\C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853920501	DD	On-Demand	Anodyne	MMP1	17	43
CCO/C=C/C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853920502	DD	On-Demand	Anodyne	MMP1	17	43
CCO/C=C\C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853920503	DD	On-Demand	Anodyne	MMP1	17	43
C#C[C@H](Nc1ncnc2ccc(I)cc12)C1CCOCC1	ZINC000853920573	GG	On-Demand	Mild	CD38	38	41
C#C[C@@H](Nc1ncnc2ccc(I)cc12)C1CCOCC1	ZINC000853920575	GG	On-Demand	Mild	CD38	38	41
CC[C@@](C)(CO)C(=O)OCc1cccc(C(C)C)c1	ZINC000853920647	CG	On-Demand	Anodyne	PDS	22	40
C#CCOCCOC(=O)Cc1noc2ccc(OC)cc12	ZINC000853920682	CD	On-Demand	Mild	MTNR1A	41	37
O=C(C[C@@]1(O)CCCN(Cc2ccccc2)C1)OCCOC(F)F	ZINC000853920735	EE	On-Demand	Anodyne	NPFFR1	41	41
O=C(C[C@@]1(O)CCCN(Cc2ccccc2)C1)OCCOC(F)F	ZINC000853920735	EE	On-Demand	Anodyne	SLC12A5	42	32
O=C(C[C@]1(O)CCCN(Cc2ccccc2)C1)OCCOC(F)F	ZINC000853920736	EE	On-Demand	Anodyne	NPFFR1	41	41
O=C(C[C@]1(O)CCCN(Cc2ccccc2)C1)OCCOC(F)F	ZINC000853920736	EE	On-Demand	Anodyne	SLC12A5	42	32
C[C@@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1ccc[nH]1	ZINC000853920752	DE	On-Demand	Anodyne	MME	58	38
C[C@@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1ccc[nH]1	ZINC000853920752	DE	On-Demand	Anodyne	NPY5R	24	41
C[C@@H](NC(=O)N(C)[C@H](CO)Cc1ccccc1)c1ccc[nH]1	ZINC000853920752	DE	On-Demand	Anodyne	ACE2	49	34
C[C@@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1ccc[nH]1	ZINC000853920753	DE	On-Demand	Anodyne	MME	58	38
C[C@@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1ccc[nH]1	ZINC000853920753	DE	On-Demand	Anodyne	NPY5R	24	41
C[C@@H](NC(=O)N(C)[C@@H](CO)Cc1ccccc1)c1ccc[nH]1	ZINC000853920753	DE	On-Demand	Anodyne	ACE2	49	34
C#C[C@@H](Nc1ncnc2c1ncn2C1CC1)C1CCOCC1	ZINC000853920825	CE	On-Demand	Mild	ADORA1	36	42
C#C[C@@H](Nc1ncnc2c1ncn2C1CC1)C1CCOCC1	ZINC000853920825	CE	On-Demand	Mild	Q4VQ11_PIG	41	40
C#C[C@H](Nc1ncnc2c1ncn2C1CC1)C1CCOCC1	ZINC000853920827	CE	On-Demand	Mild	ADORA1	36	42
C#C[C@H](Nc1ncnc2c1ncn2C1CC1)C1CCOCC1	ZINC000853920827	CE	On-Demand	Mild	Q4VQ11_PIG	41	40
CO[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853920935	CE	On-Demand	Anodyne	PPARG	19	44
CO[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853920935	CE	On-Demand	Anodyne	PPARA	25	44
CO[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853920935	CE	On-Demand	Anodyne	MME	40	39
CO[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853920935	CE	On-Demand	Anodyne	ANPEP	44	31
CO[C@@H](Cc1ccccc1)C(=O)OCCOC(F)F	ZINC000853920935	CE	On-Demand	Anodyne	LAP3	44	34
C[C@]1(C(=O)OCCOC(F)F)C[C@@H]1c1ccccc1	ZINC000853920968	CF	On-Demand	Anodyne	AMY2	42	29
Cn1nc(-c2ccccc2)cc1C(=O)OCCOC(F)F	ZINC000853921006	CE	On-Demand	Anodyne	P2RY12	43	31
CCC(CC)(CO)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853921056	EE	On-Demand	Anodyne	MMP1	15	43
CCC(CC)(CO)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853921057	EE	On-Demand	Anodyne	MMP1	15	43
C#CCOCCOC(=O)C[C@@]1(O)CCCN(Cc2ccccc2)C1	ZINC000853921062	ED	On-Demand	Mild	NPFFR1	41	41
C#CCOCCOC(=O)C[C@]1(O)CCCN(Cc2ccccc2)C1	ZINC000853921063	ED	On-Demand	Mild	NPFFR1	41	41
CCOC(=O)CC[C@@H](C)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853921080	EE	On-Demand	Reactive	CACNA1D	42	33
CCOC(=O)CC[C@H](C)NC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853921081	EE	On-Demand	Reactive	CACNA1D	42	33
C#C[C@H](Nc1ncnc2cc(F)c(OC)cc12)C1CCOCC1	ZINC000853921150	DF	On-Demand	Mild	EGFR	49	42
C#C[C@H](Nc1ncnc2cc(F)c(OC)cc12)C1CCOCC1	ZINC000853921150	DF	On-Demand	Mild	FLT1	20	41
C#C[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C1CCOCC1	ZINC000853921153	DF	On-Demand	Mild	EGFR	49	42
C#C[C@@H](Nc1ncnc2cc(F)c(OC)cc12)C1CCOCC1	ZINC000853921153	DF	On-Demand	Mild	FLT1	20	41
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	ADORA1	159	69
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	SLC29A1	129	53
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	ADORA2A	52	62
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	ADORA2B	15	67
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	ADK	47	52
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	AHCY	43	41
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	P2RX1	43	37
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	ADORA3	118	61
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	OXGR1	116	43
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	RNASE1	40	31
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	DNMT3B	77	41
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	Q4VQ11_PIG	90	67
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	GPR17	45	44
C#C[C@@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921236	GB	On-Demand	Mild	DOT1L	86	44
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	ADORA1	159	69
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	SLC29A1	129	53
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	ADORA2A	52	62
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	ADORA2B	15	67
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	ADK	47	52
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	AHCY	43	41
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	P2RX1	43	37
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	ADORA3	118	61
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	OXGR1	116	43
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	RNASE1	40	31
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	DNMT3B	77	41
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	Q4VQ11_PIG	90	67
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	GPR17	45	44
C#C[C@H](Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O)C1CCOCC1	ZINC000853921237	GB	On-Demand	Mild	DOT1L	86	44
C#CCOCCOC(=O)[C@@H]1[C@@H](NC(=O)OCc2ccccc2)[C@H]2C=C[C@H]1C2	ZINC000853921248	FE	On-Demand	Mild	NAAA	36	41
C/C=C\COc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853921380	DF	On-Demand	Anodyne	PDS	41	34
C/C=C/COc1cccc(CC(=O)OCCOC(F)F)c1	ZINC000853921381	DF	On-Demand	Anodyne	PDS	41	34
CC[C@H](O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853921439	DD	On-Demand	Anodyne	MMP1	18	46
CC[C@@H](O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853921441	DD	On-Demand	Anodyne	MMP1	18	46
C#C[C@H](Nc1cc(C)nc(-c2cccnc2)n1)C1CCOCC1	ZINC000853921442	DF	On-Demand	Mild	ROS1	46	33
CC[C@@H](O)CC(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853921443	DD	On-Demand	Anodyne	MMP1	18	46
CC[C@H](O)CC(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853921444	DD	On-Demand	Anodyne	MMP1	18	46
C#C[C@@H](Nc1cc(C)nc(-c2cccnc2)n1)C1CCOCC1	ZINC000853921446	DF	On-Demand	Mild	ROS1	46	33
Cc1cccc(CNC(=O)c2ccc(C(=O)OCCOC(F)F)cc2)c1	ZINC000853921461	FG	On-Demand	Anodyne	PDS	43	38
O=C(OCCOC(F)F)[C@H]1CCCCN1C1CCCC1	ZINC000853921481	CF	On-Demand	Anodyne	FKBP1A	43	37
O=C(OCCOC(F)F)[C@@H]1CCCCN1C1CCCC1	ZINC000853921483	CF	On-Demand	Anodyne	FKBP1A	43	37
O=C(OCCOC(F)F)c1ccc(C(=O)OCc2ccccc2)[nH]1	ZINC000853921486	EF	On-Demand	Anodyne	CAPN2	40	33
C[C@@H](NC(=O)N1CCc2nnc(N3CCCC3)cc2C1)c1ccc[nH]1	ZINC000853921503	EE	On-Demand	Anodyne	MAPK1	42	37
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921509	CE	On-Demand	Bother	CACNA1C	61	42
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921509	CE	On-Demand	Bother	CACNA1D	94	42
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921512	CE	On-Demand	Bother	CACNA1C	61	42
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921512	CE	On-Demand	Bother	CACNA1D	94	42
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921514	CE	On-Demand	Bother	CACNA1C	61	42
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921514	CE	On-Demand	Bother	CACNA1D	94	42
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921517	CE	On-Demand	Bother	CACNA1C	61	42
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000853921517	CE	On-Demand	Bother	CACNA1D	94	42
C[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1ccc[nH]1	ZINC000853921531	FE	On-Demand	Anodyne	MAPK1	47	39
C#CCOCCOC(=O)[C@@](C)(O)c1ccccc1	ZINC000853921663	BD	On-Demand	Mild	AMY2	68	45
COC[C@@H](NC(=O)N[C@@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921714	DF	On-Demand	Anodyne	MTNR1A	24	40
COC[C@@H](NC(=O)N[C@@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921714	DF	On-Demand	Anodyne	MTNR1B	26	40
COC[C@H](NC(=O)N[C@@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921715	DF	On-Demand	Anodyne	MTNR1A	24	40
COC[C@H](NC(=O)N[C@@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921715	DF	On-Demand	Anodyne	MTNR1B	26	40
COC[C@@H](NC(=O)N[C@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921716	DF	On-Demand	Anodyne	MTNR1A	24	40
COC[C@@H](NC(=O)N[C@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921716	DF	On-Demand	Anodyne	MTNR1B	26	40
COC[C@H](NC(=O)N[C@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921717	DF	On-Demand	Anodyne	MTNR1A	24	40
COC[C@H](NC(=O)N[C@H](C)c1ccc[nH]1)c1cccc(OC)c1	ZINC000853921717	DF	On-Demand	Anodyne	MTNR1B	26	40
C#C[C@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853921766	DF	On-Demand	Mild	TAAR1	18	40
C#C[C@@H](Nc1ccc(C(C)=O)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853921768	DF	On-Demand	Mild	TAAR1	18	40
O=C(N[C@@H]1[C@@H](C(=O)OCCOC(F)F)[C@H]2C=C[C@H]1C2)OCc1ccccc1	ZINC000853921793	GF	On-Demand	Anodyne	CAPN2	69	34
O=C(N[C@@H]1[C@@H](C(=O)OCCOC(F)F)[C@H]2C=C[C@H]1C2)OCc1ccccc1	ZINC000853921793	GF	On-Demand	Anodyne	NAAA	35	43
O=C(OCCOC(F)F)[C@@H]1C[C@H]1c1ccc(Br)cc1	ZINC000853921893	EG	On-Demand	Anodyne	SLC6A3	18	50
COc1ccc2c(NC[C@H]3CC(=O)N(C(C)(C)C)C3)ccnc2c1	ZINC000853921922	EG	On-Demand	Anodyne	HRP1_PLAFA	131	45
COc1ccc2c(NC[C@H]3CC(=O)N(C(C)(C)C)C3)ccnc2c1	ZINC000853921922	EG	On-Demand	Anodyne	HNMT	61	37
COc1ccc2c(NC[C@@H]3CC(=O)N(C(C)(C)C)C3)ccnc2c1	ZINC000853921923	EG	On-Demand	Anodyne	HRP1_PLAFA	131	45
COc1ccc2c(NC[C@@H]3CC(=O)N(C(C)(C)C)C3)ccnc2c1	ZINC000853921923	EG	On-Demand	Anodyne	HNMT	61	37
CC(=O)Nc1ccccc1C(F)(F)C(=O)OCCOC(F)F	ZINC000853921933	DF	On-Demand	Anodyne	AMY2	53	30
C#CCCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853921973	GG	On-Demand	Mild	HRH3	20	41
C#CCCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853921973	GG	On-Demand	Mild	MMP13	15	40
C#CCCOc1ccc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853921973	GG	On-Demand	Mild	CHEK2	29	40
C#CCCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853921975	GG	On-Demand	Mild	HRH3	20	41
C#CCCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853921975	GG	On-Demand	Mild	MMP13	15	40
C#CCCOc1ccc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853921975	GG	On-Demand	Mild	CHEK2	29	40
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCOC(F)F)C1CCC1	ZINC000853921984	DE	On-Demand	Anodyne	POLG_HCV1	21	45
C#C[C@@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853922150	FD	On-Demand	Mild	BCL2L1	53	31
C#C[C@H](Nc1ccc(S(=O)(=O)NC)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853922152	FD	On-Demand	Mild	BCL2L1	53	31
O=C(OCCOC(F)F)C(F)(F)c1ccccc1Br	ZINC000853922168	EG	On-Demand	Anodyne	AMY2	44	30
O=C(OCCOC(F)F)c1ccc(I)cc1F	ZINC000853922275	FF	On-Demand	Anodyne	MAP2K1	42	35
C#CCOCCOC(=O)c1cc(N)ccc1OC	ZINC000853922287	BD	On-Demand	Mild	HTR4	35	41
C[C@@](O)(C(=O)OCC1C[C@@H]2C[C@H]2C1)c1ccccc1	ZINC000853922358	CE	On-Demand	Anodyne	AMY2	64	38
C[C@@](O)(C(=O)OCC1C[C@H]2C[C@@H]2C1)c1ccccc1	ZINC000853922359	CE	On-Demand	Anodyne	AMY2	64	38
C[C@@](O)(C(=O)OC[C@H]1C[C@@H]2C[C@@H]2C1)c1ccccc1	ZINC000853922360	CE	On-Demand	Anodyne	AMY2	64	38
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCOC(F)F)c1c(F)cccc1F	ZINC000853922368	GG	On-Demand	Anodyne	PAPA1_CARPA	29	40
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H](C)c2ccc[nH]2)cc1	ZINC000853922377	FE	On-Demand	Anodyne	ADRB2	41	54
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H](C)c2ccc[nH]2)cc1	ZINC000853922377	FE	On-Demand	Anodyne	ADRB1	71	54
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@H](C)c2ccc[nH]2)cc1	ZINC000853922377	FE	On-Demand	Anodyne	ADRB3	44	41
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H](C)c2ccc[nH]2)cc1	ZINC000853922378	FE	On-Demand	Anodyne	ADRB2	41	54
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H](C)c2ccc[nH]2)cc1	ZINC000853922378	FE	On-Demand	Anodyne	ADRB1	71	54
COCCc1ccc(OC[C@H](O)CNC(=O)N[C@@H](C)c2ccc[nH]2)cc1	ZINC000853922378	FE	On-Demand	Anodyne	ADRB3	44	41
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@@H](C)c2ccc[nH]2)cc1	ZINC000853922379	FE	On-Demand	Anodyne	ADRB2	41	54
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@@H](C)c2ccc[nH]2)cc1	ZINC000853922379	FE	On-Demand	Anodyne	ADRB1	71	54
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@@H](C)c2ccc[nH]2)cc1	ZINC000853922379	FE	On-Demand	Anodyne	ADRB3	44	41
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@H](C)c2ccc[nH]2)cc1	ZINC000853922380	FE	On-Demand	Anodyne	ADRB2	41	54
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@H](C)c2ccc[nH]2)cc1	ZINC000853922380	FE	On-Demand	Anodyne	ADRB1	71	54
COCCc1ccc(OC[C@@H](O)CNC(=O)N[C@H](C)c2ccc[nH]2)cc1	ZINC000853922380	FE	On-Demand	Anodyne	ADRB3	44	41
C#CCOCCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F	ZINC000853922382	FF	On-Demand	Mild	PAPA1_CARPA	30	41
C#CCOCCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1c(F)cccc1F	ZINC000853922383	FF	On-Demand	Mild	PAPA1_CARPA	30	41
COC(=O)c1ccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853922390	GE	On-Demand	Anodyne	LTA4H	17	40
COC(=O)c1ccc(CC(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853922390	GE	On-Demand	Anodyne	MMP1	26	47
COC(=O)c1ccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853922391	GE	On-Demand	Anodyne	LTA4H	17	40
COC(=O)c1ccc(CC(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)cc1	ZINC000853922391	GE	On-Demand	Anodyne	MMP1	26	47
CC[C@@H]1CCC[C@@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922395	EG	On-Demand	Anodyne	MMP1	24	44
CC[C@@H]1CCC[C@H]1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922396	EG	On-Demand	Anodyne	MMP1	24	44
CC[C@@H]1CCC[C@@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922397	EG	On-Demand	Anodyne	MMP1	24	44
CC[C@@H]1CCC[C@H]1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922398	EG	On-Demand	Anodyne	MMP1	24	44
CC(C)(C)N1C[C@@H](CNc2ccnc3c(F)cccc23)CC1=O	ZINC000853922441	DG	On-Demand	Anodyne	HRP1_PLAFA	83	35
CC(C)(C)N1C[C@H](CNc2ccnc3c(F)cccc23)CC1=O	ZINC000853922443	DG	On-Demand	Anodyne	HRP1_PLAFA	83	35
C#CCO[C@@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922445	ED	On-Demand	Mild	PROKR1	41	31
C#CCO[C@H](C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922447	ED	On-Demand	Mild	PROKR1	41	31
C#CCO[C@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922449	ED	On-Demand	Mild	PROKR1	41	31
C#CCO[C@@H](C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922450	ED	On-Demand	Mild	PROKR1	41	31
C#C[C@@H](Nc1ncnc2[nH]ccc12)C1CCOCC1	ZINC000853922451	CD	On-Demand	Mild	JAK3	18	41
C#C[C@@H](Nc1ncnc2[nH]ccc12)C1CCOCC1	ZINC000853922451	CD	On-Demand	Mild	JAK1	20	42
C#C[C@H](Nc1ncnc2[nH]ccc12)C1CCOCC1	ZINC000853922453	CD	On-Demand	Mild	JAK3	18	41
C#C[C@H](Nc1ncnc2[nH]ccc12)C1CCOCC1	ZINC000853922453	CD	On-Demand	Mild	JAK1	20	42
CCN1CC[C@@H](N(CC)C(=O)N[C@H](C)c2ccc[nH]2)C1	ZINC000853922481	CE	On-Demand	Anodyne	CCR5	31	42
CCN1CC[C@H](N(CC)C(=O)N[C@H](C)c2ccc[nH]2)C1	ZINC000853922483	CE	On-Demand	Anodyne	CCR5	31	42
CCN1CC[C@@H](N(CC)C(=O)N[C@@H](C)c2ccc[nH]2)C1	ZINC000853922484	CE	On-Demand	Anodyne	CCR5	31	42
CCN1CC[C@H](N(CC)C(=O)N[C@@H](C)c2ccc[nH]2)C1	ZINC000853922486	CE	On-Demand	Anodyne	CCR5	31	42
C[C@@H](NC(=O)NC(C)(C)c1cccc(C#N)c1)c1ccc[nH]1	ZINC000853922489	CG	On-Demand	Mild	IMDH_CRYPV	43	32
C[C@H](NC(=O)NC(C)(C)c1cccc(C#N)c1)c1ccc[nH]1	ZINC000853922494	CG	On-Demand	Mild	IMDH_CRYPV	43	32
C#C[C@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853922519	GE	On-Demand	Mild	BCL2L1	53	32
C#C[C@@H](Nc1ccc(S(=O)(=O)N(CC)CC)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853922520	GE	On-Demand	Mild	BCL2L1	53	32
CC(C)c1cccc(COC(=O)[C@H]2CCCN(C)C2=O)c1	ZINC000853922539	CF	On-Demand	Anodyne	FKBP1A	42	38
CC(C)c1cccc(COC(=O)[C@@H]2CCCN(C)C2=O)c1	ZINC000853922540	CF	On-Demand	Anodyne	FKBP1A	42	38
COC(=O)c1nccnc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922628	GD	On-Demand	Anodyne	MMP13	47	40
COC(=O)c1nccnc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922628	GD	On-Demand	Anodyne	ADAM17	35	40
COC(=O)c1nccnc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922628	GD	On-Demand	Anodyne	MMP1	43	45
COC(=O)c1nccnc1C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922628	GD	On-Demand	Anodyne	PROKR1	59	32
COC(=O)c1nccnc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922629	GD	On-Demand	Anodyne	MMP13	47	40
COC(=O)c1nccnc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922629	GD	On-Demand	Anodyne	ADAM17	35	40
COC(=O)c1nccnc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922629	GD	On-Demand	Anodyne	MMP1	43	45
COC(=O)c1nccnc1C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853922629	GD	On-Demand	Anodyne	PROKR1	59	32
C#C[C@@H](Nc1ccc(C(=O)NC)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853922732	DD	On-Demand	Mild	TAAR1	19	41
C#C[C@H](Nc1ccc(C(=O)NC)cc1[N+](=O)[O-])C1CCOCC1	ZINC000853922733	DD	On-Demand	Mild	TAAR1	19	41
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)F)cc1	ZINC000853922739	CD	On-Demand	Unstable	CA2	22	47
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)F)cc1	ZINC000853922739	CD	On-Demand	Unstable	CA4	15	46
O=C(OCCOC(F)F)c1ccc(S(=O)(=O)F)cc1	ZINC000853922739	CD	On-Demand	Unstable	CA14	15	47
C[C@@H](NC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1)c1ccc[nH]1	ZINC000853922770	FG	On-Demand	Anodyne	WNT3	40	31
C[C@@H](NC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1)c1ccc[nH]1	ZINC000853922772	FG	On-Demand	Anodyne	WNT3	40	31
CC(C)c1cccc(COC(=O)c2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1	ZINC000853922822	GG	On-Demand	Bother	COLA	42	31
CC(C)c1cccc(COC(=O)C2(CO)CCOCC2)c1	ZINC000853922853	CF	On-Demand	Anodyne	SLC12A5	66	34
CC[C@H](O)CC(=O)OCc1cccc(C(C)C)c1	ZINC000853922854	CG	On-Demand	Anodyne	CAPN2	42	36
CC[C@@H](O)CC(=O)OCc1cccc(C(C)C)c1	ZINC000853922855	CG	On-Demand	Anodyne	CAPN2	42	36
CC(C)c1cccc(COC(=O)[C@@H](O)C2CCC2)c1	ZINC000853922860	CG	On-Demand	Anodyne	AMY2	43	30
CC(C)c1cccc(COC(=O)[C@H](O)C2CCC2)c1	ZINC000853922862	CG	On-Demand	Anodyne	AMY2	43	30
C#CCOCCOC(=O)CCOc1cccc(OC)c1	ZINC000853922867	CD	On-Demand	Mild	MTNR1A	39	47
C#CCOCCOC(=O)CCOc1cccc(OC)c1	ZINC000853922867	CD	On-Demand	Mild	MTNR1B	38	47
C#CCOCCOC(=O)[C@H]1[C@@H]2CC[C@H](O2)[C@H]1C(=O)OC	ZINC000853922871	CC	On-Demand	Mild	Q8AWE3_CHICK	20	51
COc1cccc(OCCC(=O)OCCOC(F)F)c1	ZINC000853922908	CE	On-Demand	Anodyne	MTNR1A	47	49
COc1cccc(OCCC(=O)OCCOC(F)F)c1	ZINC000853922908	CE	On-Demand	Anodyne	MTNR1B	46	49
COc1cccc(OCCC(=O)OCCOC(F)F)c1	ZINC000853922908	CE	On-Demand	Anodyne	PDS	36	40
O=C(OCCOC(F)F)[C@@H]1CCN(c2ccccc2)C1	ZINC000853922945	CE	On-Demand	Anodyne	SLC6A1	43	34
O=C(OCCOC(F)F)[C@H]1CCN(c2ccccc2)C1	ZINC000853922946	CE	On-Demand	Anodyne	SLC6A1	43	34
C[C@@H](NC(=O)N1CCc2sccc2[C@H]1c1ccc(Cl)cc1)c1ccc[nH]1	ZINC000853923010	GK	On-Demand	Anodyne	TRPM8	40	60
C[C@@H](NC(=O)N1CCc2sccc2[C@@H]1c1ccc(Cl)cc1)c1ccc[nH]1	ZINC000853923013	GK	On-Demand	Anodyne	TRPM8	40	60
COC(=O)c1ccc(CC(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853923064	ED	On-Demand	Bother	GSTM2	34	40
COC(=O)c1ccc(CC(=O)OCc2onc(C)c2[N+](=O)[O-])cc1	ZINC000853923064	ED	On-Demand	Bother	GSTP1	21	40
O=C(OCCOC(F)F)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000853923103	CG	On-Demand	Anodyne	SLC6A3	18	40
O=C(OCCOC(F)F)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000853923103	CG	On-Demand	Anodyne	AMY2	45	31
O=C(OCCOC(F)F)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000853923104	CG	On-Demand	Anodyne	SLC6A3	18	40
O=C(OCCOC(F)F)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000853923104	CG	On-Demand	Anodyne	AMY2	45	31
O=C(OCCOC(F)F)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000853923105	CG	On-Demand	Anodyne	SLC6A3	18	40
O=C(OCCOC(F)F)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000853923105	CG	On-Demand	Anodyne	AMY2	45	31
O=C(OCCOC(F)F)[C@H]1CCC[C@H]1c1ccccc1	ZINC000853923106	CG	On-Demand	Anodyne	SLC6A3	18	40
O=C(OCCOC(F)F)[C@H]1CCC[C@H]1c1ccccc1	ZINC000853923106	CG	On-Demand	Anodyne	AMY2	45	31
O=C(OCCOC(F)F)[C@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923149	FD	On-Demand	Anodyne	FKBP1A	46	38
O=C(OCCOC(F)F)[C@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923149	FD	On-Demand	Anodyne	CELA1	19	42
O=C(OCCOC(F)F)[C@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923149	FD	On-Demand	Anodyne	PREP	35	42
O=C(OCCOC(F)F)[C@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923149	FD	On-Demand	Anodyne	LGMN	62	39
O=C(OCCOC(F)F)[C@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923149	FD	On-Demand	Anodyne	KLK5	35	46
O=C(OCCOC(F)F)[C@@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923150	FD	On-Demand	Anodyne	FKBP1A	46	38
O=C(OCCOC(F)F)[C@@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923150	FD	On-Demand	Anodyne	CELA1	19	42
O=C(OCCOC(F)F)[C@@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923150	FD	On-Demand	Anodyne	PREP	35	42
O=C(OCCOC(F)F)[C@@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923150	FD	On-Demand	Anodyne	LGMN	62	39
O=C(OCCOC(F)F)[C@@H]1COCCN1C(=O)OCc1ccccc1	ZINC000853923150	FD	On-Demand	Anodyne	KLK5	35	46
CC(C)(C)N1C[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853923191	EE	On-Demand	Bother	GSTM2	111	43
CC(C)(C)N1C[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853923191	EE	On-Demand	Bother	GSTP1	68	43
CC(C)(C)N1C[C@@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853923191	EE	On-Demand	Bother	EPAS1	60	32
CC(C)(C)N1C[C@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853923192	EE	On-Demand	Bother	GSTM2	111	43
CC(C)(C)N1C[C@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853923192	EE	On-Demand	Bother	GSTP1	68	43
CC(C)(C)N1C[C@H](CNc2ccc([N+](=O)[O-])c3nonc23)CC1=O	ZINC000853923192	EE	On-Demand	Bother	EPAS1	60	32
C[C@@H](NC(=O)N1CCC(N2CC[C@H](O)C2)CC1)c1ccc[nH]1	ZINC000853923346	DD	On-Demand	Anodyne	L3MBTL3	41	32
C[C@@H](NC(=O)N1CCC(N2CC[C@@H](O)C2)CC1)c1ccc[nH]1	ZINC000853923347	DD	On-Demand	Anodyne	L3MBTL3	41	32
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000853923355	FJ	On-Demand	Anodyne	MME	75	38
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000853923355	FJ	On-Demand	Anodyne	CPA1	42	37
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)N[C@H](C)c1ccc[nH]1	ZINC000853923355	FJ	On-Demand	Anodyne	ACE2	64	37
C[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)Cc1ccccc1)c1ccc[nH]1	ZINC000853923356	FJ	On-Demand	Anodyne	MME	75	38
C[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)Cc1ccccc1)c1ccc[nH]1	ZINC000853923356	FJ	On-Demand	Anodyne	CPA1	42	37
C[C@@H](NC(=O)N(Cc1ccccc1)[C@H](C)Cc1ccccc1)c1ccc[nH]1	ZINC000853923356	FJ	On-Demand	Anodyne	ACE2	64	37
C[C@@H](NC(=O)N1CCC[C@H](N2CCOCC2)CC1)c1ccc[nH]1	ZINC000853923376	DD	On-Demand	Anodyne	L3MBTL3	77	40
C[C@@H](NC(=O)N1CCC[C@@H](N2CCOCC2)CC1)c1ccc[nH]1	ZINC000853923378	DD	On-Demand	Anodyne	L3MBTL3	77	40
C[C@@H](NC(=O)N1CC[C@@H](Oc2ccccc2)C1)c1ccc[nH]1	ZINC000853923396	CF	On-Demand	Anodyne	EPHX2	19	45
C[C@@H](NC(=O)N(CCN1CCOCC1)CC1CC1)c1ccc[nH]1	ZINC000853923412	DD	On-Demand	Anodyne	CASR	56	39
C#C[C@H](Nc1ncnc2ccc(F)cc12)C1CCOCC1	ZINC000853923436	CF	On-Demand	Mild	CD38	32	41
C#C[C@@H](Nc1ncnc2ccc(F)cc12)C1CCOCC1	ZINC000853923437	CF	On-Demand	Mild	CD38	32	41
O=C(OCc1nnc2n1CCOCC2)C1=C(c2ccccc2)CCCC1	ZINC000853923526	FF	On-Demand	Anodyne	CHRM5	35	40
CC(C)(C)N1C[C@H](CNc2nc(-c3cccnc3)nc3ccccc23)CC1=O	ZINC000853923533	GH	On-Demand	Anodyne	PKN2	17	40
CC(C)(C)N1C[C@@H](CNc2nc(-c3cccnc3)nc3ccccc23)CC1=O	ZINC000853923534	GH	On-Demand	Anodyne	PKN2	17	40
C#C[C@@H](N=c1nc(-c2ccncc2)[nH]c2ccccc12)C1CCOCC1	ZINC000853923553	EF	On-Demand	Mild	NR2E3	44	32
C#C[C@H](N=c1nc(-c2ccncc2)[nH]c2ccccc12)C1CCOCC1	ZINC000853923554	EF	On-Demand	Mild	NR2E3	44	32
C#C[C@H](Nc1ncnc2ccc(Br)cc12)C1CCOCC1	ZINC000853923555	EG	On-Demand	Mild	CD38	33	40
C#C[C@@H](Nc1ncnc2ccc(Br)cc12)C1CCOCC1	ZINC000853923556	EG	On-Demand	Mild	CD38	33	40
O=C(OCCOC(F)F)c1cnc(Nc2ccccc2)nc1C(F)(F)F	ZINC000853923654	GH	On-Demand	Anodyne	ATF1	59	37
O=C(OCCOC(F)F)c1cnc(Nc2ccccc2)nc1C(F)(F)F	ZINC000853923654	GH	On-Demand	Anodyne	NFKB1	54	37
O=C(OCCOC(F)F)c1cnc(Nc2ccccc2)nc1C(F)(F)F	ZINC000853923654	GH	On-Demand	Anodyne	STAT6	65	38
O=C(OCCOC(F)F)c1nn(-c2ccc(Cl)cc2F)c2c1CCC2	ZINC000853923697	FH	On-Demand	Anodyne	CNR1	57	35
CCOC(=O)CC(C)(C)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853923718	GE	On-Demand	Anodyne	PROKR1	47	31
CCOC(=O)CC(C)(C)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853923719	GE	On-Demand	Anodyne	PROKR1	47	31
CC(C)c1cccc(COC(=O)C2(F)CC2)c1	ZINC000853923792	BG	On-Demand	Anodyne	SLC12A5	73	38
CC(C)(C)OC(=O)NC[C@H](NC(=O)NC/C=C/CO)c1ccc2ccccc2c1	ZINC000853923793	GG	On-Demand	Anodyne	PAPA1_CARPA	28	45
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NC/C=C\CO)c1ccc2ccccc2c1	ZINC000853923794	GG	On-Demand	Anodyne	PAPA1_CARPA	28	45
CC(C)(C)OC(=O)NC[C@@H](NC(=O)NC/C=C/CO)c1ccc2ccccc2c1	ZINC000853923795	GG	On-Demand	Anodyne	PAPA1_CARPA	28	45
CC(C)(C)OC(=O)NC[C@H](NC(=O)NC/C=C\CO)c1ccc2ccccc2c1	ZINC000853923796	GG	On-Demand	Anodyne	PAPA1_CARPA	28	45
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1N	ZINC000853923831	CB	On-Demand	Mild	CA2	30	49
C#CCOCCOC(=O)c1ccc(S(N)(=O)=O)cc1N	ZINC000853923831	CB	On-Demand	Mild	CA7	16	43
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923839	FD	On-Demand	Mild	ACE	33	40
C#CCCN(CCOC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923839	FD	On-Demand	Mild	MME	19	40
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923840	FD	On-Demand	Mild	ACE	33	40
C#CCCN(CCOC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923840	FD	On-Demand	Mild	MME	19	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853923841	FD	On-Demand	Anodyne	ACE	33	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853923841	FD	On-Demand	Anodyne	MME	24	45
O=C(N[C@H]1C[C@H](O)C12CCC2)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923842	FD	On-Demand	Anodyne	ACE	33	45
O=C(N[C@H]1C[C@H](O)C12CCC2)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923842	FD	On-Demand	Anodyne	MME	24	45
O=C(N[C@H]1C[C@@H](O)C12CCC2)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923843	FD	On-Demand	Anodyne	ACE	33	45
O=C(N[C@H]1C[C@@H](O)C12CCC2)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853923843	FD	On-Demand	Anodyne	MME	24	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853923844	FD	On-Demand	Anodyne	ACE	33	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853923844	FD	On-Demand	Anodyne	MME	24	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923851	EF	On-Demand	Anodyne	PRSS1	15	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923851	EF	On-Demand	Anodyne	ACE	59	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923851	EF	On-Demand	Anodyne	MME	29	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923851	EF	On-Demand	Anodyne	BIRC2	51	39
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923851	EF	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923852	EF	On-Demand	Anodyne	PRSS1	15	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923852	EF	On-Demand	Anodyne	ACE	59	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923852	EF	On-Demand	Anodyne	MME	29	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923852	EF	On-Demand	Anodyne	BIRC2	51	39
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853923852	EF	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccon2)CC1	ZINC000853923855	GF	On-Demand	Anodyne	ACE	24	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccon2)CC1	ZINC000853923855	GF	On-Demand	Anodyne	MME	15	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccon2)CC1	ZINC000853923856	GF	On-Demand	Anodyne	ACE	24	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccon2)CC1	ZINC000853923856	GF	On-Demand	Anodyne	MME	15	40
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923892	GD	On-Demand	Anodyne	ACE	36	41
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923892	GD	On-Demand	Anodyne	ACHE	20	46
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923892	GD	On-Demand	Anodyne	MME	20	41
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923893	GD	On-Demand	Anodyne	ACE	36	41
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923893	GD	On-Demand	Anodyne	ACHE	20	46
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923893	GD	On-Demand	Anodyne	MME	20	41
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923894	GD	On-Demand	Anodyne	ACE	36	41
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923894	GD	On-Demand	Anodyne	ACHE	20	46
O=C1CCCN1C[C@@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923894	GD	On-Demand	Anodyne	MME	20	41
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923895	GD	On-Demand	Anodyne	ACE	36	41
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923895	GD	On-Demand	Anodyne	ACHE	20	46
O=C1CCCN1C[C@H]1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923895	GD	On-Demand	Anodyne	MME	20	41
CN1C[C@@H](CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923904	FC	On-Demand	Anodyne	ACE	33	43
CN1C[C@@H](CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923904	FC	On-Demand	Anodyne	MME	20	43
CN1C[C@H](CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923905	FC	On-Demand	Anodyne	ACE	33	43
CN1C[C@H](CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923905	FC	On-Demand	Anodyne	MME	20	43
CN1C[C@@H](CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923906	FC	On-Demand	Anodyne	ACE	33	43
CN1C[C@@H](CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923906	FC	On-Demand	Anodyne	MME	20	43
CN1C[C@H](CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923907	FC	On-Demand	Anodyne	ACE	33	43
CN1C[C@H](CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC1=O	ZINC000853923907	FC	On-Demand	Anodyne	MME	20	43
COC(=O)[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923926	FD	On-Demand	Anodyne	ACE	42	43
COC(=O)[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923926	FD	On-Demand	Anodyne	FKBP1A	46	37
COC(=O)[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923926	FD	On-Demand	Anodyne	MME	22	43
COC(=O)[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923927	FD	On-Demand	Anodyne	ACE	42	43
COC(=O)[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923927	FD	On-Demand	Anodyne	FKBP1A	46	37
COC(=O)[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853923927	FD	On-Demand	Anodyne	MME	22	43
CC(C)c1cccc(COC(=O)c2cn(C3CCC3)nn2)c1	ZINC000853923948	CG	On-Demand	Anodyne	ESRRA	17	42
C[C@H](CC(=O)OCCOC(F)F)n1ccnc1	ZINC000853923958	BD	On-Demand	Anodyne	CYP26A1	57	34
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	PLG	22	44
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	FKBP1A	127	49
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	CELA1	25	44
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	TRY1_BOVIN	43	33
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	UL80	46	37
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	PREP	104	46
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	LGMN	73	45
CC(C)c1cccc(COC(=O)[C@@H]2CCCN2C(=O)C2CC2)c1	ZINC000853924004	DG	On-Demand	Anodyne	BRCA1	50	30
C#CCOCCOC(=O)[C@@]1(Cc2ccccc2)CCN(C)C1=O	ZINC000853924009	DD	On-Demand	Mild	SLC12A5	64	35
C#CCOCCOC(=O)[C@]1(Cc2ccccc2)CCN(C)C1=O	ZINC000853924010	DD	On-Demand	Mild	SLC12A5	64	35
CC(C)(C)OC(=O)NC[C@H](NC(=O)N[C@H]1C[C@H](O)C1)c1ccc2ccccc2c1	ZINC000853924028	GG	On-Demand	Anodyne	PAPA1_CARPA	26	42
CC(C)(C)OC(=O)NC[C@@H](NC(=O)N[C@H]1C[C@H](O)C1)c1ccc2ccccc2c1	ZINC000853924029	GG	On-Demand	Anodyne	PAPA1_CARPA	26	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCOC(C2CC2)(C2CC2)C1	ZINC000853924063	GF	On-Demand	Anodyne	ACE	32	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCOC(C2CC2)(C2CC2)C1	ZINC000853924063	GF	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCOC(C2CC2)(C2CC2)C1	ZINC000853924064	GF	On-Demand	Anodyne	ACE	32	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCOC(C2CC2)(C2CC2)C1	ZINC000853924064	GF	On-Demand	Anodyne	MME	23	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(COC2)C1	ZINC000853924078	ED	On-Demand	Anodyne	ACE	26	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(COC2)C1	ZINC000853924078	ED	On-Demand	Anodyne	MME	17	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(COC2)C1	ZINC000853924079	ED	On-Demand	Anodyne	ACE	26	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC2(COC2)C1	ZINC000853924079	ED	On-Demand	Anodyne	MME	17	41
CN(CC(=O)N1CCCC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924112	FD	On-Demand	Anodyne	ACE	50	45
CN(CC(=O)N1CCCC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924112	FD	On-Demand	Anodyne	F10	25	41
CN(CC(=O)N1CCCC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924112	FD	On-Demand	Anodyne	MME	29	45
CN(CC(=O)N1CCCC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924112	FD	On-Demand	Anodyne	PREP	67	42
CN(CC(=O)N1CCCC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924112	FD	On-Demand	Anodyne	SAP2	33	41
CN(CC(=O)N1CCCC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924113	FD	On-Demand	Anodyne	ACE	50	45
CN(CC(=O)N1CCCC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924113	FD	On-Demand	Anodyne	F10	25	41
CN(CC(=O)N1CCCC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924113	FD	On-Demand	Anodyne	MME	29	45
CN(CC(=O)N1CCCC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924113	FD	On-Demand	Anodyne	PREP	67	42
CN(CC(=O)N1CCCC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924113	FD	On-Demand	Anodyne	SAP2	33	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCc2nccnc2C1	ZINC000853924114	FD	On-Demand	Anodyne	ACE	39	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCc2nccnc2C1	ZINC000853924114	FD	On-Demand	Anodyne	MME	25	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCc2nccnc2C1	ZINC000853924115	FD	On-Demand	Anodyne	ACE	39	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCc2nccnc2C1	ZINC000853924115	FD	On-Demand	Anodyne	MME	25	41
O=C1[C@H](NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924119	FD	On-Demand	Anodyne	ACE	33	40
O=C1[C@H](NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924119	FD	On-Demand	Anodyne	MME	21	40
O=C1[C@H](NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924120	FD	On-Demand	Anodyne	ACE	33	40
O=C1[C@H](NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924120	FD	On-Demand	Anodyne	MME	21	40
O=C1[C@@H](NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924121	FD	On-Demand	Anodyne	ACE	33	40
O=C1[C@@H](NC(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924121	FD	On-Demand	Anodyne	MME	21	40
O=C1[C@@H](NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924122	FD	On-Demand	Anodyne	ACE	33	40
O=C1[C@@H](NC(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)CCCN1Cc1ccccc1	ZINC000853924122	FD	On-Demand	Anodyne	MME	21	40
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA2	83	44
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA6	18	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA1	64	38
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA7	63	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA13	24	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA5B	45	32
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA4	68	44
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA5A	47	32
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA14	36	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA12	46	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA9	45	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CAH_METTE	47	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	NCE103	36	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	CA15	25	42
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	P96878_MYCTU	42	36
Nc1cc(S(N)(=O)=O)ccc1C(=O)OCCOC(F)F	ZINC000853924168	DC	On-Demand	Anodyne	A6YCJ1_9METZ	24	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924237	GF	On-Demand	Anodyne	ACE	28	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924237	GF	On-Demand	Anodyne	MME	16	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924237	GF	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924237	GF	On-Demand	Anodyne	CCR3	47	38
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924238	GF	On-Demand	Anodyne	ACE	28	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924238	GF	On-Demand	Anodyne	MME	16	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924238	GF	On-Demand	Anodyne	SIGMAR1	22	40
O=C(NC[C@H]1CCCN(CC2CC2)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924238	GF	On-Demand	Anodyne	CCR3	47	38
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1=O	ZINC000853924251	FD	On-Demand	Anodyne	ACKR3	51	33
O=C(NCC(O)(C1CC1)C1CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924273	FE	On-Demand	Anodyne	ACE	33	43
O=C(NCC(O)(C1CC1)C1CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924273	FE	On-Demand	Anodyne	MME	21	43
O=C(NCC(O)(C1CC1)C1CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924274	FE	On-Demand	Anodyne	ACE	33	43
O=C(NCC(O)(C1CC1)C1CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924274	FE	On-Demand	Anodyne	MME	21	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924286	FG	On-Demand	Anodyne	ACE	34	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924286	FG	On-Demand	Anodyne	ACHE	32	46
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924286	FG	On-Demand	Anodyne	MME	23	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924286	FG	On-Demand	Anodyne	SIGMAR1	21	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924287	FG	On-Demand	Anodyne	ACE	34	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924287	FG	On-Demand	Anodyne	ACHE	32	46
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924287	FG	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(CCC1CC1)CC1CC1	ZINC000853924287	FG	On-Demand	Anodyne	SIGMAR1	21	42
CC[C@@](C)(NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853924290	EG	On-Demand	Anodyne	ACE	45	42
CC[C@@](C)(NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853924290	EG	On-Demand	Anodyne	MME	26	42
CC[C@@](C)(NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853924290	EG	On-Demand	Anodyne	BIRC2	43	31
CC[C@@](C)(NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853924293	EG	On-Demand	Anodyne	ACE	45	42
CC[C@@](C)(NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853924293	EG	On-Demand	Anodyne	MME	26	42
CC[C@@](C)(NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853924293	EG	On-Demand	Anodyne	BIRC2	43	31
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)C1	ZINC000853924303	FC	On-Demand	Anodyne	ACE	36	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)C1	ZINC000853924303	FC	On-Demand	Anodyne	MME	22	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)C1	ZINC000853924304	FC	On-Demand	Anodyne	ACE	36	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(CO)(CO)C1	ZINC000853924304	FC	On-Demand	Anodyne	MME	22	42
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924309	FG	On-Demand	Anodyne	ACE	45	43
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924309	FG	On-Demand	Anodyne	MME	27	43
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924309	FG	On-Demand	Anodyne	BIRC3	42	35
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924309	FG	On-Demand	Anodyne	BIRC2	65	40
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924309	FG	On-Demand	Anodyne	BIRC8	41	32
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924310	FG	On-Demand	Anodyne	ACE	45	43
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924310	FG	On-Demand	Anodyne	MME	27	43
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924310	FG	On-Demand	Anodyne	BIRC3	42	35
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924310	FG	On-Demand	Anodyne	BIRC2	65	40
CC1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924310	FG	On-Demand	Anodyne	BIRC8	41	32
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@](C)(C(F)F)O1	ZINC000853924314	GF	On-Demand	Anodyne	ACE	43	39
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@](C)(C(F)F)O1	ZINC000853924315	GF	On-Demand	Anodyne	ACE	43	39
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@](C)(C(F)F)O1	ZINC000853924316	GF	On-Demand	Anodyne	ACE	43	39
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@](C)(C(F)F)O1	ZINC000853924317	GF	On-Demand	Anodyne	ACE	43	39
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](CO)c1ccccc1	ZINC000853924329	CE	On-Demand	Anodyne	CHRM4	31	50
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@@H](CO)c1ccccc1	ZINC000853924329	CE	On-Demand	Anodyne	CHRM5	42	50
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](CO)c1ccccc1	ZINC000853924330	CE	On-Demand	Anodyne	CHRM4	31	50
O=C(OC[C@H]1C[C@@H]2C[C@@H]2C1)[C@H](CO)c1ccccc1	ZINC000853924330	CE	On-Demand	Anodyne	CHRM5	42	50
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](CO)c1ccccc1	ZINC000853924331	CE	On-Demand	Anodyne	CHRM4	31	50
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@@H](CO)c1ccccc1	ZINC000853924331	CE	On-Demand	Anodyne	CHRM5	42	50
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](CO)c1ccccc1	ZINC000853924332	CE	On-Demand	Anodyne	CHRM4	31	50
O=C(OCC1C[C@@H]2C[C@H]2C1)[C@H](CO)c1ccccc1	ZINC000853924332	CE	On-Demand	Anodyne	CHRM5	42	50
CC(C)c1cccc(COC(=O)C[C@H](C)n2ccnc2)c1	ZINC000853924361	CH	On-Demand	Anodyne	CYP26A1	129	44
CC(C)c1cccc(COC(=O)C[C@@H](C)n2ccnc2)c1	ZINC000853924362	CH	On-Demand	Anodyne	CYP26A1	129	44
COc1cc(Br)c(Cl)cc1C(=O)OCCOC(F)F	ZINC000853924373	FH	On-Demand	Anodyne	HTR4	71	48
CC(C)c1cccc(COC(=O)C2(S(N)(=O)=O)CC2)c1	ZINC000853924402	CD	On-Demand	Anodyne	SLC12A5	62	36
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	ALOX5	20	52
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	MAOB	30	46
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	PPARG	28	40
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	PPARA	30	46
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	LTA4H	51	50
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	PLA2G4B	56	37
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	ACE2	21	41
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	TAAR1	22	48
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	FFAR1	67	51
O=C(Cc1ccc(OCc2ccccc2)cc1)OCCOC(F)F	ZINC000853924523	EH	On-Demand	Anodyne	FFAR4	50	41
CC(C)c1cccc(COC(=O)C2(n3cnnn3)CCOCC2)c1	ZINC000853924526	EE	On-Demand	Anodyne	SLC12A5	42	31
CN(CC1=CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924532	FE	On-Demand	Anodyne	ACE	40	41
CN(CC1=CCSC1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924532	FE	On-Demand	Anodyne	MME	26	41
CN(CC1=CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924533	FE	On-Demand	Anodyne	ACE	40	41
CN(CC1=CCSC1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924533	FE	On-Demand	Anodyne	MME	26	41
CC(C)c1cccc(COC(=O)C2(n3cnnn3)CC2)c1	ZINC000853924535	CE	On-Demand	Anodyne	SLC12A5	65	34
O=C(OCc1nnc2n1CCOCC2)c1cccc(SC(F)(F)F)c1	ZINC000853924536	FF	On-Demand	Anodyne	ITGAL	40	33
O=C1CC[C@@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853924540	GD	On-Demand	Anodyne	ACE	32	40
O=C1CC[C@@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853924540	GD	On-Demand	Anodyne	MME	19	40
O=C1CC[C@@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853924540	GD	On-Demand	Anodyne	BIRC2	43	39
O=C1CC[C@@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853924541	GD	On-Demand	Anodyne	ACE	32	40
O=C1CC[C@@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853924541	GD	On-Demand	Anodyne	MME	19	40
O=C1CC[C@@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853924541	GD	On-Demand	Anodyne	BIRC2	43	39
O=C1CC[C@@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853924542	GD	On-Demand	Anodyne	ACE	32	40
O=C1CC[C@@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853924542	GD	On-Demand	Anodyne	MME	19	40
O=C1CC[C@@H]2CN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)CC[C@H]2N1	ZINC000853924542	GD	On-Demand	Anodyne	BIRC2	43	39
O=C1CC[C@@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853924543	GD	On-Demand	Anodyne	ACE	32	40
O=C1CC[C@@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853924543	GD	On-Demand	Anodyne	MME	19	40
O=C1CC[C@@H]2CN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)CC[C@@H]2N1	ZINC000853924543	GD	On-Demand	Anodyne	BIRC2	43	39
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924562	FE	On-Demand	Anodyne	PRSS1	15	40
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924562	FE	On-Demand	Anodyne	ACE	46	44
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924562	FE	On-Demand	Anodyne	MME	28	44
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924562	FE	On-Demand	Anodyne	BIRC3	40	37
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924562	FE	On-Demand	Anodyne	BIRC2	57	39
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924562	FE	On-Demand	Anodyne	BIRC8	45	33
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924563	FE	On-Demand	Anodyne	PRSS1	15	40
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924563	FE	On-Demand	Anodyne	ACE	46	44
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924563	FE	On-Demand	Anodyne	MME	28	44
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924563	FE	On-Demand	Anodyne	BIRC3	40	37
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924563	FE	On-Demand	Anodyne	BIRC2	57	39
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924563	FE	On-Demand	Anodyne	BIRC8	45	33
Cc1nnc(CN(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)o1	ZINC000853924565	FD	On-Demand	Anodyne	ACE	25	40
Cc1nnc(CN(C)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)o1	ZINC000853924565	FD	On-Demand	Anodyne	MME	19	40
Cc1nnc(CN(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)o1	ZINC000853924566	FD	On-Demand	Anodyne	ACE	25	40
Cc1nnc(CN(C)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)o1	ZINC000853924566	FD	On-Demand	Anodyne	MME	19	40
CCN1CC[C@@H](N(CC)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924570	FE	On-Demand	Anodyne	ACE	36	40
CCN1CC[C@@H](N(CC)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924570	FE	On-Demand	Anodyne	MME	22	40
CCN1CC[C@@H](N(CC)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924570	FE	On-Demand	Anodyne	CCR5	43	47
CCN1CC[C@H](N(CC)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924571	FE	On-Demand	Anodyne	ACE	36	40
CCN1CC[C@H](N(CC)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924571	FE	On-Demand	Anodyne	MME	22	40
CCN1CC[C@H](N(CC)C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924571	FE	On-Demand	Anodyne	CCR5	43	47
CCN1CC[C@H](N(CC)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924572	FE	On-Demand	Anodyne	ACE	36	40
CCN1CC[C@H](N(CC)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924572	FE	On-Demand	Anodyne	MME	22	40
CCN1CC[C@H](N(CC)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924572	FE	On-Demand	Anodyne	CCR5	43	47
CCN1CC[C@@H](N(CC)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924573	FE	On-Demand	Anodyne	ACE	36	40
CCN1CC[C@@H](N(CC)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924573	FE	On-Demand	Anodyne	MME	22	40
CCN1CC[C@@H](N(CC)C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924573	FE	On-Demand	Anodyne	CCR5	43	47
N#C[C@@H]1CCCC[C@@H]1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924577	FF	On-Demand	Mild	PRSS1	15	41
N#C[C@@H]1CCCC[C@@H]1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924577	FF	On-Demand	Mild	ACE	30	45
N#C[C@@H]1CCCC[C@@H]1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924577	FF	On-Demand	Mild	MME	21	45
N#C[C@@H]1CCCC[C@H]1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924578	FF	On-Demand	Mild	PRSS1	15	41
N#C[C@@H]1CCCC[C@H]1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924578	FF	On-Demand	Mild	ACE	30	45
N#C[C@@H]1CCCC[C@H]1NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924578	FF	On-Demand	Mild	MME	21	45
N#C[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924579	FF	On-Demand	Mild	PRSS1	15	41
N#C[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924579	FF	On-Demand	Mild	ACE	30	45
N#C[C@@H]1CCCC[C@@H]1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924579	FF	On-Demand	Mild	MME	21	45
N#C[C@@H]1CCCC[C@H]1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924580	FF	On-Demand	Mild	PRSS1	15	41
N#C[C@@H]1CCCC[C@H]1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924580	FF	On-Demand	Mild	ACE	30	45
N#C[C@@H]1CCCC[C@H]1NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924580	FF	On-Demand	Mild	MME	21	45
CN(Cc1cnc[nH]1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924587	ED	On-Demand	Anodyne	ACE	26	40
CN(Cc1cnc[nH]1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924587	ED	On-Demand	Anodyne	MME	18	40
CN(Cc1cnc[nH]1)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924587	ED	On-Demand	Anodyne	ACE2	20	40
CN(Cc1cnc[nH]1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924588	ED	On-Demand	Anodyne	ACE	26	40
CN(Cc1cnc[nH]1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924588	ED	On-Demand	Anodyne	MME	18	40
CN(Cc1cnc[nH]1)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924588	ED	On-Demand	Anodyne	ACE2	20	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@@H]2CCOC2)CC1	ZINC000853924594	GD	On-Demand	Anodyne	ACE	27	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@@H]2CCOC2)CC1	ZINC000853924594	GD	On-Demand	Anodyne	MME	17	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@H]2CCOC2)CC1	ZINC000853924595	GD	On-Demand	Anodyne	ACE	27	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@H]2CCOC2)CC1	ZINC000853924595	GD	On-Demand	Anodyne	MME	17	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@H]2CCOC2)CC1	ZINC000853924596	GD	On-Demand	Anodyne	ACE	27	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@H]2CCOC2)CC1	ZINC000853924596	GD	On-Demand	Anodyne	MME	17	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@@H]2CCOC2)CC1	ZINC000853924597	GD	On-Demand	Anodyne	ACE	27	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCN([C@@H]2CCOC2)CC1	ZINC000853924597	GD	On-Demand	Anodyne	MME	17	40
CC[C@@H](O)CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924628	DD	On-Demand	Anodyne	ACE	50	45
CC[C@@H](O)CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924628	DD	On-Demand	Anodyne	MME	31	45
CC[C@@H](O)CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924628	DD	On-Demand	Anodyne	NPY1R	26	41
CC[C@@H](O)CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924628	DD	On-Demand	Anodyne	BIRC2	40	38
CC[C@@H](O)CNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924629	DD	On-Demand	Anodyne	ACE	50	45
CC[C@@H](O)CNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924629	DD	On-Demand	Anodyne	MME	31	45
CC[C@@H](O)CNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924629	DD	On-Demand	Anodyne	NPY1R	26	41
CC[C@@H](O)CNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924629	DD	On-Demand	Anodyne	BIRC2	40	38
CC(C)c1cccc(COC(=O)CC2CCN(S(C)(=O)=O)CC2)c1	ZINC000853924634	FF	On-Demand	Anodyne	TRY2_BOVIN	47	38
O=C(OCCOC(F)F)c1cc2c(Br)cncc2s1	ZINC000853924639	FG	On-Demand	Anodyne	SELE	127	40
O=C(OCCOC(F)F)c1cc2c(Br)cncc2s1	ZINC000853924639	FG	On-Demand	Anodyne	ICAM1	122	40
O=C(OCCOC(F)F)c1cc2c(Br)cncc2s1	ZINC000853924639	FG	On-Demand	Anodyne	VCAM1	80	39
Cc1c(C(=O)OCCOC(F)F)nnn1-c1ccc(F)c(F)c1	ZINC000853924650	EE	On-Demand	Anodyne	SLC5A1	21	41
O=C(CN1CCCC[C@H](OCc2ccccc2)C1=O)OCCOC(F)F	ZINC000853924651	FE	On-Demand	Anodyne	ACE	32	43
O=C(CN1CCCC[C@H](OCc2ccccc2)C1=O)OCCOC(F)F	ZINC000853924651	FE	On-Demand	Anodyne	FKBP1A	44	39
O=C(CN1CCCC[C@@H](OCc2ccccc2)C1=O)OCCOC(F)F	ZINC000853924652	FE	On-Demand	Anodyne	ACE	32	43
O=C(CN1CCCC[C@@H](OCc2ccccc2)C1=O)OCCOC(F)F	ZINC000853924652	FE	On-Demand	Anodyne	FKBP1A	44	39
O=C(OCCOC(F)F)c1nn(-c2cc(Cl)ccc2F)c2c1CCC2	ZINC000853924666	FH	On-Demand	Anodyne	CNR1	52	32
O=C(OCCOC(F)F)[C@@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2	ZINC000853924688	FF	On-Demand	Anodyne	SLC12A5	51	35
O=C(OCCOC(F)F)[C@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2	ZINC000853924692	FF	On-Demand	Anodyne	SLC12A5	51	35
O=C(OCCOC(F)F)[C@@H]1C[C@]12CCN(C(=O)OCc1ccccc1)C2	ZINC000853924695	FF	On-Demand	Anodyne	SLC12A5	51	35
O=C(OCCOC(F)F)[C@H]1C[C@@]12CCN(C(=O)OCc1ccccc1)C2	ZINC000853924697	FF	On-Demand	Anodyne	SLC12A5	51	35
C[C@@H](CCNC(=O)NCC1CN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853924705	ED	On-Demand	Anodyne	CHRNA3	23	40
C[C@@H](CCNC(=O)NCC1CN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853924705	ED	On-Demand	Anodyne	CHRNA4	20	40
C=C[C@H](CO)NC(=O)N[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853924714	GG	On-Demand	Mild	PAPA1_CARPA	28	44
C=C[C@H](CO)NC(=O)N[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853924714	GG	On-Demand	Mild	TPH1	40	35
C=C[C@H](CO)NC(=O)N[C@@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853924714	GG	On-Demand	Mild	SOAT1	15	46
C=C[C@H](CO)NC(=O)N[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853924715	GG	On-Demand	Mild	PAPA1_CARPA	28	44
C=C[C@H](CO)NC(=O)N[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853924715	GG	On-Demand	Mild	TPH1	40	35
C=C[C@H](CO)NC(=O)N[C@H](CNC(=O)OC(C)(C)C)c1ccc2ccccc2c1	ZINC000853924715	GG	On-Demand	Mild	SOAT1	15	46
O=C(N[C@@H]1CC[C@@H]2SCCS[C@H]21)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853924753	FG	On-Demand	Anodyne	EPHX2	28	55
O=C(N[C@@H]1CC[C@H]2SCCS[C@H]12)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853924756	FG	On-Demand	Anodyne	EPHX2	28	55
O=C(N[C@@H]1CC[C@H]2SCCS[C@@H]12)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853924759	FG	On-Demand	Anodyne	EPHX2	28	55
O=C(N[C@@H]1CC[C@@H]2SCCS[C@@H]21)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853924760	FG	On-Demand	Anodyne	EPHX2	28	55
CC(C)(C)OC(=O)N1CC(CNC(=O)N(CCC2CC2)CC2CC2)C1	ZINC000853924774	FG	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC(CNC(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853924778	GD	On-Demand	Anodyne	CACNA1I	48	34
CC(C)(C)OC(=O)N1CC(CNC(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853924779	GD	On-Demand	Anodyne	CACNA1I	48	34
C#CCOCCOC(=O)[C@H](CO)c1ccccc1	ZINC000853924783	BC	On-Demand	Mild	CHRM4	22	40
C#CCOCCOC(=O)[C@H](CO)c1ccccc1	ZINC000853924783	BC	On-Demand	Mild	CHRM5	29	40
C#CCOCCOC(=O)[C@@H](CO)c1ccccc1	ZINC000853924784	BC	On-Demand	Mild	CHRM4	22	40
C#CCOCCOC(=O)[C@@H](CO)c1ccccc1	ZINC000853924784	BC	On-Demand	Mild	CHRM5	29	40
O=C(NCC1(O)CCC(F)(F)CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924786	GE	On-Demand	Anodyne	ACE	27	41
O=C(NCC1(O)CCC(F)(F)CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924786	GE	On-Demand	Anodyne	MME	18	41
O=C(NCC1(O)CCC(F)(F)CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924788	GE	On-Demand	Anodyne	ACE	27	41
O=C(NCC1(O)CCC(F)(F)CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924788	GE	On-Demand	Anodyne	MME	18	41
C=C[C@H](CO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924791	DD	On-Demand	Mild	ACE	44	45
C=C[C@H](CO)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924791	DD	On-Demand	Mild	MME	28	45
C=C[C@H](CO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924793	DD	On-Demand	Mild	ACE	44	45
C=C[C@H](CO)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924793	DD	On-Demand	Mild	MME	28	45
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924799	FD	On-Demand	Anodyne	PRSS1	21	41
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924799	FD	On-Demand	Anodyne	ACE	44	42
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924799	FD	On-Demand	Anodyne	F10	18	40
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924799	FD	On-Demand	Anodyne	MME	25	42
CN1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924799	FD	On-Demand	Anodyne	BIRC2	40	35
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924800	FD	On-Demand	Anodyne	PRSS1	21	41
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924800	FD	On-Demand	Anodyne	ACE	44	42
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924800	FD	On-Demand	Anodyne	F10	18	40
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924800	FD	On-Demand	Anodyne	MME	25	42
CN1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCC1=O	ZINC000853924800	FD	On-Demand	Anodyne	BIRC2	40	35
C[C@@]1(C#N)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924838	EE	On-Demand	Mild	ACE	32	40
C[C@@]1(C#N)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924838	EE	On-Demand	Mild	MME	21	40
C[C@@]1(C#N)CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924838	EE	On-Demand	Mild	DPP4	16	42
C[C@@]1(C#N)CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924840	EE	On-Demand	Mild	ACE	32	40
C[C@@]1(C#N)CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924840	EE	On-Demand	Mild	MME	21	40
C[C@@]1(C#N)CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853924840	EE	On-Demand	Mild	DPP4	16	42
CC(C)(C)OC(=O)N1CC(CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853924875	FF	On-Demand	Reactive	CACNA1I	80	42
C=C(C)C[C@H](NC(C)=O)C(=O)OCc1cccc(C(C)C)c1	ZINC000853924898	DG	On-Demand	Mild	PAPA1_CARPA	33	41
C=C(C)C[C@H](NC(C)=O)C(=O)OCc1cccc(C(C)C)c1	ZINC000853924898	DG	On-Demand	Mild	CAPNS1	47	32
C=C(C)C[C@H](NC(C)=O)C(=O)OCc1cccc(C(C)C)c1	ZINC000853924898	DG	On-Demand	Mild	CAPN2	60	32
C=C(C)C[C@@H](NC(C)=O)C(=O)OCc1cccc(C(C)C)c1	ZINC000853924899	DG	On-Demand	Mild	PAPA1_CARPA	33	41
C=C(C)C[C@@H](NC(C)=O)C(=O)OCc1cccc(C(C)C)c1	ZINC000853924899	DG	On-Demand	Mild	CAPNS1	47	32
C=C(C)C[C@@H](NC(C)=O)C(=O)OCc1cccc(C(C)C)c1	ZINC000853924899	DG	On-Demand	Mild	CAPN2	60	32
O=C(NCC1CCC(O)CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924903	FE	On-Demand	Anodyne	F2	17	44
O=C(NCC1CCC(O)CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924903	FE	On-Demand	Anodyne	PRSS1	20	41
O=C(NCC1CCC(O)CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924903	FE	On-Demand	Anodyne	ACE	33	45
O=C(NCC1CCC(O)CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924903	FE	On-Demand	Anodyne	MME	21	45
O=C(NCC1CCC(O)CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924904	FE	On-Demand	Anodyne	F2	17	44
O=C(NCC1CCC(O)CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924904	FE	On-Demand	Anodyne	PRSS1	20	41
O=C(NCC1CCC(O)CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924904	FE	On-Demand	Anodyne	ACE	33	45
O=C(NCC1CCC(O)CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924904	FE	On-Demand	Anodyne	MME	21	45
O=C(NC1CC(CO)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924922	ED	On-Demand	Anodyne	ACE	38	44
O=C(NC1CC(CO)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924922	ED	On-Demand	Anodyne	DRD4	15	41
O=C(NC1CC(CO)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924922	ED	On-Demand	Anodyne	MME	23	44
O=C(NC1CC(CO)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924922	ED	On-Demand	Anodyne	SIGMAR1	25	40
O=C(NC1CC(CO)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924923	ED	On-Demand	Anodyne	ACE	38	44
O=C(NC1CC(CO)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924923	ED	On-Demand	Anodyne	DRD4	15	41
O=C(NC1CC(CO)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924923	ED	On-Demand	Anodyne	MME	23	44
O=C(NC1CC(CO)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853924923	ED	On-Demand	Anodyne	SIGMAR1	25	40
CC(C)(C)OC(=O)N1CC(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853924990	GE	On-Demand	Reactive	GPR119	28	40
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](O)C(F)(F)C2)C1	ZINC000853925025	ED	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@H](O)C(F)(F)C2)C1	ZINC000853925026	ED	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC(CNC(=O)NCc2ccc3c(=O)cc[nH]c3c2)C1	ZINC000853925054	GE	On-Demand	Anodyne	CACNA1I	41	33
O=C(OCc1nnc2n1CCOCC2)c1ccc(Oc2ccc(F)cc2)nc1	ZINC000853925144	GF	On-Demand	Anodyne	MLNR	22	41
O=C(OCCOC(F)F)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000853925169	DF	On-Demand	Anodyne	AMY2	43	29
CN(C[C@@H]1CC1(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925237	EF	On-Demand	Anodyne	ACE	39	42
CN(C[C@@H]1CC1(C)C)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925237	EF	On-Demand	Anodyne	MME	24	42
CN(C[C@@H]1CC1(C)C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925239	EF	On-Demand	Anodyne	ACE	39	42
CN(C[C@@H]1CC1(C)C)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925239	EF	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853925252	EE	On-Demand	Anodyne	ACE	53	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853925252	EE	On-Demand	Anodyne	MME	27	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853925252	EE	On-Demand	Anodyne	RBP4	41	33
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853925252	EE	On-Demand	Anodyne	CALCRL	26	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853925252	EE	On-Demand	Anodyne	XIAP	24	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853925252	EE	On-Demand	Anodyne	BIRC2	59	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@@H]2C1	ZINC000853925252	EE	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853925254	EE	On-Demand	Anodyne	ACE	53	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853925254	EE	On-Demand	Anodyne	MME	27	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853925254	EE	On-Demand	Anodyne	RBP4	41	33
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853925254	EE	On-Demand	Anodyne	CALCRL	26	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853925254	EE	On-Demand	Anodyne	XIAP	24	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853925254	EE	On-Demand	Anodyne	BIRC2	59	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@@H]2C1	ZINC000853925254	EE	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853925256	EE	On-Demand	Anodyne	ACE	53	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853925256	EE	On-Demand	Anodyne	MME	27	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853925256	EE	On-Demand	Anodyne	RBP4	41	33
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853925256	EE	On-Demand	Anodyne	CALCRL	26	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853925256	EE	On-Demand	Anodyne	XIAP	24	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853925256	EE	On-Demand	Anodyne	BIRC2	59	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2C[C@H]2C1	ZINC000853925256	EE	On-Demand	Anodyne	SAP2	33	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@H]2C1	ZINC000853925258	EE	On-Demand	Anodyne	ACE	53	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@H]2C1	ZINC000853925258	EE	On-Demand	Anodyne	MME	27	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@H]2C1	ZINC000853925258	EE	On-Demand	Anodyne	RBP4	41	33
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@H]2C1	ZINC000853925258	EE	On-Demand	Anodyne	CALCRL	26	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@H]2C1	ZINC000853925258	EE	On-Demand	Anodyne	XIAP	24	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@H]2C1	ZINC000853925258	EE	On-Demand	Anodyne	BIRC2	59	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2C[C@H]2C1	ZINC000853925258	EE	On-Demand	Anodyne	SAP2	33	40
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@]1(C)CO	ZINC000853925280	FD	On-Demand	Anodyne	ACE	46	40
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@]1(C)CO	ZINC000853925280	FD	On-Demand	Anodyne	MME	23	40
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000853925282	FD	On-Demand	Anodyne	ACE	46	40
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000853925282	FD	On-Demand	Anodyne	MME	23	40
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@]1(C)CO	ZINC000853925284	FD	On-Demand	Anodyne	ACE	46	40
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@]1(C)CO	ZINC000853925284	FD	On-Demand	Anodyne	MME	23	40
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000853925285	FD	On-Demand	Anodyne	ACE	46	40
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@]1(C)CO	ZINC000853925285	FD	On-Demand	Anodyne	MME	23	40
O=C(N[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925301	DD	On-Demand	Anodyne	PRSS1	21	43
O=C(N[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925301	DD	On-Demand	Anodyne	ACE	43	46
O=C(N[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925301	DD	On-Demand	Anodyne	DRD4	18	45
O=C(N[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925301	DD	On-Demand	Anodyne	F10	17	42
O=C(N[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925301	DD	On-Demand	Anodyne	MME	28	46
O=C(N[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925301	DD	On-Demand	Anodyne	SIGMAR1	26	42
O=C(N[C@H]1C[C@H](O)C1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925301	DD	On-Demand	Anodyne	EPHX2	15	42
O=C(N[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925302	DD	On-Demand	Anodyne	PRSS1	21	43
O=C(N[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925302	DD	On-Demand	Anodyne	ACE	43	46
O=C(N[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925302	DD	On-Demand	Anodyne	DRD4	18	45
O=C(N[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925302	DD	On-Demand	Anodyne	F10	17	42
O=C(N[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925302	DD	On-Demand	Anodyne	MME	28	46
O=C(N[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925302	DD	On-Demand	Anodyne	SIGMAR1	26	42
O=C(N[C@H]1C[C@H](O)C1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925302	DD	On-Demand	Anodyne	EPHX2	15	42
Cc1ccc(CC2CN(C(=O)NCC3CN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853925326	FG	On-Demand	Anodyne	CACNA1I	42	37
Cc1ccc(CC2CN(C(=O)NCC3CN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853925326	FG	On-Demand	Anodyne	GPR119	30	42
CCn1cnc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853925347	BE	On-Demand	Anodyne	CPB2	15	42
CCn1cnc(C(=O)OCC2C[C@@H]3C[C@H]3C2)c1	ZINC000853925347	BE	On-Demand	Anodyne	CPB1	17	42
CCn1cnc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853925348	BE	On-Demand	Anodyne	CPB2	15	42
CCn1cnc(C(=O)OC[C@H]2C[C@@H]3C[C@@H]3C2)c1	ZINC000853925348	BE	On-Demand	Anodyne	CPB1	17	42
CCn1cnc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853925349	BE	On-Demand	Anodyne	CPB2	15	42
CCn1cnc(C(=O)OCC2C[C@H]3C[C@@H]3C2)c1	ZINC000853925349	BE	On-Demand	Anodyne	CPB1	17	42
CC(C)(C)OC(=O)N1CC(CNC(=O)N(CCN2CCOCC2)CC2CC2)C1	ZINC000853925358	GD	On-Demand	Anodyne	CACNA1I	46	35
CC(C)(C)OC(=O)N1CCC(n2nncc2C(=O)OCCOC(F)F)CC1	ZINC000853925438	GE	On-Demand	Anodyne	GPR119	41	39
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925444	FG	On-Demand	Mild	ACE	37	43
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925444	FG	On-Demand	Mild	MME	24	43
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925445	FG	On-Demand	Mild	ACE	37	43
C=C1C[C@@H]2CC[C@H](C1)N2C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925445	FG	On-Demand	Mild	MME	24	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853925457	FD	On-Demand	Anodyne	ACE	49	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853925457	FD	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853925457	FD	On-Demand	Anodyne	BIRC2	52	39
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853925457	FD	On-Demand	Anodyne	SAP2	34	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@H]2C1	ZINC000853925458	FD	On-Demand	Anodyne	ACE	49	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@H]2C1	ZINC000853925458	FD	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@H]2C1	ZINC000853925458	FD	On-Demand	Anodyne	BIRC2	52	39
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H]2COC[C@H]2C1	ZINC000853925458	FD	On-Demand	Anodyne	SAP2	34	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@@H]2C1	ZINC000853925459	FD	On-Demand	Anodyne	ACE	49	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@@H]2C1	ZINC000853925459	FD	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@@H]2C1	ZINC000853925459	FD	On-Demand	Anodyne	BIRC2	52	39
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@@H]2C1	ZINC000853925459	FD	On-Demand	Anodyne	SAP2	34	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@H]2C1	ZINC000853925460	FD	On-Demand	Anodyne	ACE	49	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@H]2C1	ZINC000853925460	FD	On-Demand	Anodyne	MME	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@H]2C1	ZINC000853925460	FD	On-Demand	Anodyne	BIRC2	52	39
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H]2COC[C@H]2C1	ZINC000853925460	FD	On-Demand	Anodyne	SAP2	34	41
O=C(NC[C@H](CO)CC1CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925490	FD	On-Demand	Anodyne	ACE	31	43
O=C(NC[C@H](CO)CC1CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925490	FD	On-Demand	Anodyne	MME	21	43
O=C(NC[C@H](CO)CC1CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925491	FD	On-Demand	Anodyne	ACE	31	43
O=C(NC[C@H](CO)CC1CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925491	FD	On-Demand	Anodyne	MME	21	43
O=C(NC[C@@H](CO)CC1CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925492	FD	On-Demand	Anodyne	ACE	31	43
O=C(NC[C@@H](CO)CC1CC1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925492	FD	On-Demand	Anodyne	MME	21	43
O=C(NC[C@@H](CO)CC1CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925493	FD	On-Demand	Anodyne	ACE	31	43
O=C(NC[C@@H](CO)CC1CC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925493	FD	On-Demand	Anodyne	MME	21	43
CC(C)(C)OC(=O)N1CC(CNC(=O)NC(C)(C2CC2)C2CC2)C1	ZINC000853925516	EF	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CC(CNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853925549	EC	On-Demand	Anodyne	CACNA1I	54	35
CC(C)(C)OC(=O)N1CC(CNC(=O)NCC2CCC(O)CC2)C1	ZINC000853925554	ED	On-Demand	Anodyne	CACNA1I	52	34
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853925599	GF	On-Demand	Anodyne	CHRM3	16	43
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853925599	GF	On-Demand	Anodyne	EPHX2	30	45
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853925599	GF	On-Demand	Anodyne	CACNA1I	49	33
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853925599	GF	On-Demand	Anodyne	GPR119	46	41
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925678	FE	On-Demand	Anodyne	ACE	49	42
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925678	FE	On-Demand	Anodyne	MME	26	42
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925678	FE	On-Demand	Anodyne	BIRC2	46	37
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925678	FE	On-Demand	Anodyne	SAP2	35	42
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925680	FE	On-Demand	Anodyne	ACE	49	42
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925680	FE	On-Demand	Anodyne	MME	26	42
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925680	FE	On-Demand	Anodyne	BIRC2	46	37
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CC[C@@H](C)O1	ZINC000853925680	FE	On-Demand	Anodyne	SAP2	35	42
COC[C@]1(C(=O)OCc2onc(C)c2[N+](=O)[O-])CCCN1C(=O)OC(C)(C)C	ZINC000853925682	GE	On-Demand	Bother	SLC12A5	48	37
COC[C@@]1(C(=O)OCc2onc(C)c2[N+](=O)[O-])CCCN1C(=O)OC(C)(C)C	ZINC000853925684	GE	On-Demand	Bother	SLC12A5	48	37
COCc1csc(C(=O)O[C@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853925699	GF	On-Demand	Anodyne	TRY2_BOVIN	18	47
COCc1csc(C(=O)O[C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)c1	ZINC000853925701	GF	On-Demand	Anodyne	TRY2_BOVIN	18	47
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	ACE	44	46
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	FKBP1A	44	38
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	DRD4	21	41
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	F10	22	40
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	MME	28	46
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	SIGMAR1	32	41
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	APP	15	44
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	EPHX2	20	40
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925706	FD	On-Demand	Anodyne	BIRC2	47	39
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	ACE	44	46
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	FKBP1A	44	38
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	DRD4	21	41
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	F10	22	40
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	MME	28	46
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	SIGMAR1	32	41
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	APP	15	44
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	EPHX2	20	40
COC(=O)[C@@H]1C[C@@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853925708	FD	On-Demand	Anodyne	BIRC2	47	39
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853925727	GG	On-Demand	Anodyne	ACE	43	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853925727	GG	On-Demand	Anodyne	MME	21	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853925727	GG	On-Demand	Anodyne	EPHX2	24	47
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853925728	FE	On-Demand	Anodyne	CACNA1I	41	33
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853925729	GG	On-Demand	Anodyne	ACE	43	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853925729	GG	On-Demand	Anodyne	MME	21	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853925729	GG	On-Demand	Anodyne	EPHX2	24	47
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853925730	FE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853925732	FE	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853925734	FE	On-Demand	Anodyne	CACNA1I	41	33
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853925738	GF	On-Demand	Anodyne	ACE	41	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853925738	GF	On-Demand	Anodyne	MME	25	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853925738	GF	On-Demand	Anodyne	SIGMAR1	22	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853925738	GF	On-Demand	Anodyne	NPY1R	32	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925740	GF	On-Demand	Anodyne	ACE	41	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925740	GF	On-Demand	Anodyne	MME	25	44
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925740	GF	On-Demand	Anodyne	SIGMAR1	22	50
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925740	GF	On-Demand	Anodyne	NPY1R	32	44
O=C(N[C@H]1CCc2ccc(O)cc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925742	GF	On-Demand	Anodyne	ACE	41	44
O=C(N[C@H]1CCc2ccc(O)cc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925742	GF	On-Demand	Anodyne	MME	25	44
O=C(N[C@H]1CCc2ccc(O)cc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925742	GF	On-Demand	Anodyne	SIGMAR1	22	50
O=C(N[C@H]1CCc2ccc(O)cc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925742	GF	On-Demand	Anodyne	NPY1R	32	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925744	GF	On-Demand	Anodyne	ACE	41	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925744	GF	On-Demand	Anodyne	MME	25	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925744	GF	On-Demand	Anodyne	SIGMAR1	22	50
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853925744	GF	On-Demand	Anodyne	NPY1R	32	44
C=CCCC(C)(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925758	EG	On-Demand	Mild	ACE	38	40
C=CCCC(C)(C)NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925758	EG	On-Demand	Mild	MME	21	40
C=CCCC(C)(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925760	EG	On-Demand	Mild	ACE	38	40
C=CCCC(C)(C)NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925760	EG	On-Demand	Mild	MME	21	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@H]2CCCCO2)CC1	ZINC000853925774	GG	On-Demand	Anodyne	ACE	24	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@H]2CCCCO2)CC1	ZINC000853925774	GG	On-Demand	Anodyne	MME	15	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@H]2CCCCO2)CC1	ZINC000853925776	GG	On-Demand	Anodyne	ACE	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@H]2CCCCO2)CC1	ZINC000853925776	GG	On-Demand	Anodyne	MME	15	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853925778	GG	On-Demand	Anodyne	ACE	24	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853925778	GG	On-Demand	Anodyne	MME	15	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853925780	GG	On-Demand	Anodyne	ACE	24	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853925780	GG	On-Demand	Anodyne	MME	15	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853925812	GF	On-Demand	Anodyne	ACE	31	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853925812	GF	On-Demand	Anodyne	MME	22	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853925813	GF	On-Demand	Anodyne	ACE	31	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853925813	GF	On-Demand	Anodyne	MME	22	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853925814	GF	On-Demand	Anodyne	ACE	31	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853925814	GF	On-Demand	Anodyne	MME	22	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853925815	GF	On-Demand	Anodyne	ACE	31	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853925815	GF	On-Demand	Anodyne	MME	22	41
O=C(OCCOC(F)F)[C@@H](CO)c1ccccc1	ZINC000853925821	CD	On-Demand	Anodyne	CHRM4	24	46
O=C(OCCOC(F)F)[C@@H](CO)c1ccccc1	ZINC000853925821	CD	On-Demand	Anodyne	CHRM5	32	46
O=C(OCCOC(F)F)[C@H](CO)c1ccccc1	ZINC000853925822	CD	On-Demand	Anodyne	CHRM4	24	46
O=C(OCCOC(F)F)[C@H](CO)c1ccccc1	ZINC000853925822	CD	On-Demand	Anodyne	CHRM5	32	46
O=C(NCc1ccc(N2CCC(O)CC2)cc1)NC1CCC(F)(F)CC1	ZINC000853925839	FG	On-Demand	Clean	EPHX2	21	46
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853925845	FE	On-Demand	Anodyne	ACE	40	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853925845	FE	On-Demand	Anodyne	MME	24	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853925846	FE	On-Demand	Anodyne	ACE	40	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853925846	FE	On-Demand	Anodyne	MME	24	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853925847	FE	On-Demand	Anodyne	ACE	40	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@](O)(C2CC2)C1	ZINC000853925847	FE	On-Demand	Anodyne	MME	24	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853925848	FE	On-Demand	Anodyne	ACE	40	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@](O)(C2CC2)C1	ZINC000853925848	FE	On-Demand	Anodyne	MME	24	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H](CO)C1CCC1	ZINC000853925850	ED	On-Demand	Anodyne	ACE	46	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H](CO)C1CCC1	ZINC000853925850	ED	On-Demand	Anodyne	MME	31	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H](CO)C1CCC1	ZINC000853925850	ED	On-Demand	Anodyne	BIRC2	43	38
O=C(N[C@H](CO)C1CCC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925851	ED	On-Demand	Anodyne	ACE	46	45
O=C(N[C@H](CO)C1CCC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925851	ED	On-Demand	Anodyne	MME	31	45
O=C(N[C@H](CO)C1CCC1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853925851	ED	On-Demand	Anodyne	BIRC2	43	38
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H](CO)C1CCC1	ZINC000853925852	ED	On-Demand	Anodyne	ACE	46	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H](CO)C1CCC1	ZINC000853925852	ED	On-Demand	Anodyne	MME	31	45
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H](CO)C1CCC1	ZINC000853925852	ED	On-Demand	Anodyne	BIRC2	43	38
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H](CO)C1CCC1	ZINC000853925853	ED	On-Demand	Anodyne	ACE	46	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H](CO)C1CCC1	ZINC000853925853	ED	On-Demand	Anodyne	MME	31	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H](CO)C1CCC1	ZINC000853925853	ED	On-Demand	Anodyne	BIRC2	43	38
O=C(NC1CCC(F)(F)CC1)N1Cc2ccc(NC(=O)C(F)(F)F)cc2C1	ZINC000853925868	GH	On-Demand	Anodyne	EPHX2	43	37
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(O)(CO)CC1	ZINC000853925882	FC	On-Demand	Anodyne	PRSS1	17	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(O)(CO)CC1	ZINC000853925882	FC	On-Demand	Anodyne	ACE	41	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(O)(CO)CC1	ZINC000853925882	FC	On-Demand	Anodyne	MME	26	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(O)(CO)CC1	ZINC000853925883	FC	On-Demand	Anodyne	PRSS1	17	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(O)(CO)CC1	ZINC000853925883	FC	On-Demand	Anodyne	ACE	41	43
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(O)(CO)CC1	ZINC000853925883	FC	On-Demand	Anodyne	MME	26	43
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853925959	GD	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853925959	GD	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853925960	GD	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC(CNC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853925960	GD	On-Demand	Anodyne	GPR119	30	42
O=C(N[C@@H]1CC[C@@H]2SCCS[C@@H]21)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853926006	GG	On-Demand	Anodyne	EPHX2	22	42
O=C(N[C@@H]1CC[C@@H]2SCCS[C@H]21)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853926007	GG	On-Demand	Anodyne	EPHX2	22	42
O=C(N[C@@H]1CC[C@H]2SCCS[C@H]12)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853926008	GG	On-Demand	Anodyne	EPHX2	22	42
O=C(N[C@@H]1CC[C@H]2SCCS[C@@H]12)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853926009	GG	On-Demand	Anodyne	EPHX2	22	42
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@H]2[C@@H]3c4ccc(F)cc4C[C@H]32)C1	ZINC000853926062	GF	On-Demand	Anodyne	CACNA1I	46	32
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@H]32)C1	ZINC000853926063	GF	On-Demand	Anodyne	CACNA1I	46	32
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853926064	GF	On-Demand	Anodyne	CACNA1I	46	32
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853926065	GF	On-Demand	Anodyne	CACNA1I	46	32
O=C(NCCCc1nc[nH]n1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926120	FD	On-Demand	Anodyne	ACE	36	42
O=C(NCCCc1nc[nH]n1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926120	FD	On-Demand	Anodyne	MME	21	42
O=C(NCCCc1nc[nH]n1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926122	FD	On-Demand	Anodyne	ACE	36	42
O=C(NCCCc1nc[nH]n1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926122	FD	On-Demand	Anodyne	MME	21	42
O=C1[C@@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926130	EF	On-Demand	Anodyne	PRSS1	20	42
O=C1[C@@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926130	EF	On-Demand	Anodyne	ACE	58	47
O=C1[C@@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926130	EF	On-Demand	Anodyne	F10	20	42
O=C1[C@@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926130	EF	On-Demand	Anodyne	MME	29	47
O=C1[C@@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926130	EF	On-Demand	Anodyne	BIRC2	57	41
O=C1[C@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926132	EF	On-Demand	Anodyne	PRSS1	20	42
O=C1[C@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926132	EF	On-Demand	Anodyne	ACE	58	47
O=C1[C@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926132	EF	On-Demand	Anodyne	F10	20	42
O=C1[C@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926132	EF	On-Demand	Anodyne	MME	29	47
O=C1[C@H](NC(=O)N2C[C@@H]3CCCC[C@@H]32)CCCN1Cc1ccccc1	ZINC000853926132	EF	On-Demand	Anodyne	BIRC2	57	41
COCC1(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926136	FE	On-Demand	Anodyne	ACE	28	41
COCC1(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926136	FE	On-Demand	Anodyne	MME	20	41
COCC1(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926138	FE	On-Demand	Anodyne	ACE	28	41
COCC1(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926138	FE	On-Demand	Anodyne	MME	20	41
CC(C)c1cccc(COC(=O)[C@H](C)CC#N)c1	ZINC000853926154	BG	On-Demand	Mild	CTSK	17	40
CC(C)c1cccc(COC(=O)[C@H](C)CC#N)c1	ZINC000853926154	BG	On-Demand	Mild	CTSL	22	40
CC(C)c1cccc(COC(=O)[C@H](C)CC#N)c1	ZINC000853926154	BG	On-Demand	Mild	CTSS	15	40
CC(C)c1cccc(COC(=O)[C@@H](C)CC#N)c1	ZINC000853926156	BG	On-Demand	Mild	CTSK	17	40
CC(C)c1cccc(COC(=O)[C@@H](C)CC#N)c1	ZINC000853926156	BG	On-Demand	Mild	CTSL	22	40
CC(C)c1cccc(COC(=O)[C@@H](C)CC#N)c1	ZINC000853926156	BG	On-Demand	Mild	CTSS	15	40
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926158	FD	On-Demand	Anodyne	F2	15	41
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926158	FD	On-Demand	Anodyne	PRSS1	22	41
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926158	FD	On-Demand	Anodyne	ACE	53	43
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926158	FD	On-Demand	Anodyne	MME	28	43
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926158	FD	On-Demand	Anodyne	BIRC2	55	38
C[C@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926158	FD	On-Demand	Anodyne	SAP2	35	41
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926160	FD	On-Demand	Anodyne	F2	15	41
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926160	FD	On-Demand	Anodyne	PRSS1	22	41
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926160	FD	On-Demand	Anodyne	ACE	53	43
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926160	FD	On-Demand	Anodyne	MME	28	43
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926160	FD	On-Demand	Anodyne	BIRC2	55	38
C[C@@H]1CN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926160	FD	On-Demand	Anodyne	SAP2	35	41
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926162	FD	On-Demand	Anodyne	F2	15	41
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926162	FD	On-Demand	Anodyne	PRSS1	22	41
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926162	FD	On-Demand	Anodyne	ACE	53	43
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926162	FD	On-Demand	Anodyne	MME	28	43
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926162	FD	On-Demand	Anodyne	BIRC2	55	38
C[C@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)[C@@H]1O	ZINC000853926162	FD	On-Demand	Anodyne	SAP2	35	41
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926164	FD	On-Demand	Anodyne	F2	15	41
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926164	FD	On-Demand	Anodyne	PRSS1	22	41
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926164	FD	On-Demand	Anodyne	ACE	53	43
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926164	FD	On-Demand	Anodyne	MME	28	43
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926164	FD	On-Demand	Anodyne	BIRC2	55	38
C[C@@H]1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C[C@@H](C)C1O	ZINC000853926164	FD	On-Demand	Anodyne	SAP2	35	41
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	F2	26	42
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	PRSS1	24	42
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	ACE	54	42
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	F10	27	41
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	MME	27	42
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	APP	21	43
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	BIRC2	53	38
CS(=O)(=O)C1CN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926168	FC	On-Demand	Anodyne	TMPRSS11D	61	33
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926172	GD	On-Demand	Anodyne	ACE	32	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926172	GD	On-Demand	Anodyne	MME	21	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926172	GD	On-Demand	Anodyne	CALCRL	45	38
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926172	GD	On-Demand	Anodyne	BIRC8	40	32
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926175	GD	On-Demand	Anodyne	ACE	32	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926175	GD	On-Demand	Anodyne	MME	21	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926175	GD	On-Demand	Anodyne	CALCRL	45	38
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(n2cnnc2O)CC1	ZINC000853926175	GD	On-Demand	Anodyne	BIRC8	40	32
O=C1[C@@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926186	GE	On-Demand	Anodyne	ACE	32	46
O=C1[C@@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926186	GE	On-Demand	Anodyne	F10	15	41
O=C1[C@@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926186	GE	On-Demand	Anodyne	MME	20	46
O=C1[C@@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926186	GE	On-Demand	Anodyne	CPT1A	109	39
O=C1[C@@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926186	GE	On-Demand	Anodyne	PREP	44	33
O=C1[C@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926187	GE	On-Demand	Anodyne	ACE	32	46
O=C1[C@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926187	GE	On-Demand	Anodyne	F10	15	41
O=C1[C@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926187	GE	On-Demand	Anodyne	MME	20	46
O=C1[C@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926187	GE	On-Demand	Anodyne	CPT1A	109	39
O=C1[C@H](NC(=O)N2CCCC[C@@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926187	GE	On-Demand	Anodyne	PREP	44	33
O=C1[C@@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926188	GE	On-Demand	Anodyne	ACE	32	46
O=C1[C@@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926188	GE	On-Demand	Anodyne	F10	15	41
O=C1[C@@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926188	GE	On-Demand	Anodyne	MME	20	46
O=C1[C@@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926188	GE	On-Demand	Anodyne	CPT1A	109	39
O=C1[C@@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926188	GE	On-Demand	Anodyne	PREP	44	33
O=C1[C@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926189	GE	On-Demand	Anodyne	ACE	32	46
O=C1[C@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926189	GE	On-Demand	Anodyne	F10	15	41
O=C1[C@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926189	GE	On-Demand	Anodyne	MME	20	46
O=C1[C@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926189	GE	On-Demand	Anodyne	CPT1A	109	39
O=C1[C@H](NC(=O)N2CCCC[C@H]2c2nc[nH]n2)CCCN1Cc1ccccc1	ZINC000853926189	GE	On-Demand	Anodyne	PREP	44	33
C#CCOCCOC(=O)C(F)(F)c1ccccc1OC(C)C	ZINC000853926202	DF	On-Demand	Mild	AMY2	53	31
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	CHRM2	22	43
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	CHRM1	17	43
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	DRD2	15	41
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	DRD4	42	41
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	SLC6A1	95	38
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	SLC6A3	43	42
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	CHRM5	24	43
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	CHRM3	21	43
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	LTA4H	23	43
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	SIGMAR1	58	46
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	SLC18A3	25	44
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	S1PR1	17	46
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	S1PR5	28	46
O=C(OCCOC(F)F)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926219	CE	On-Demand	Anodyne	CACNA1G	38	40
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	CHRM2	22	43
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	CHRM1	17	43
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	DRD2	15	41
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	FKBP1A	40	38
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	DRD4	42	41
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	SLC6A1	95	38
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	SLC6A3	43	42
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	CHRM5	24	43
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	CHRM3	21	43
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	LTA4H	23	43
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	SIGMAR1	58	46
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	SLC18A3	25	44
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	S1PR1	17	46
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	S1PR5	28	46
O=C(OCCOC(F)F)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926220	CE	On-Demand	Anodyne	CACNA1G	38	40
COC[C@@H](OC)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853926227	ED	On-Demand	Anodyne	MMP1	15	43
COC[C@@H](OC)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853926228	ED	On-Demand	Anodyne	MMP1	15	43
CCN1CC[C@H](N(CC)C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)C1	ZINC000853926237	FD	On-Demand	Anodyne	CACNA1I	50	33
CCN1CC[C@@H](N(CC)C(=O)NCC2CN(C(=O)OC(C)(C)C)C2)C1	ZINC000853926238	FD	On-Demand	Anodyne	CACNA1I	50	33
O=C(OCc1nnc2n1CCOCC2)c1ccc(Nc2cccnc2)cc1	ZINC000853926300	FE	On-Demand	Anodyne	STAT6	51	32
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	CHRM2	19	42
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	DRD4	36	41
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	SLC6A1	80	38
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	CHRM5	17	42
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	CHRM3	18	42
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	LTA4H	18	43
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	SIGMAR1	53	42
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	PDE6D	32	41
C#CCOCCOC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926364	CD	On-Demand	Mild	SLC18A3	19	41
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	CHRM2	19	42
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	DRD4	36	41
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	SLC6A1	80	38
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	CHRM5	17	42
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	CHRM3	18	42
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	LTA4H	18	43
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	SIGMAR1	53	42
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	PDE6D	32	41
C#CCOCCOC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926365	CD	On-Demand	Mild	SLC18A3	19	41
Cc1ccccc1CC1CN(c2nccc(N3CCCC3)n2)C1	ZINC000853926375	DG	On-Demand	Anodyne	SORD	89	37
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926393	GD	On-Demand	Anodyne	ACE	32	40
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926393	GD	On-Demand	Anodyne	MME	22	40
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926394	GD	On-Demand	Anodyne	ACE	32	40
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926394	GD	On-Demand	Anodyne	MME	22	40
CC(C)c1ccccc1C(=O)OCCOC(F)F	ZINC000853926398	CG	On-Demand	Anodyne	SOAT1	18	40
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926436	EC	On-Demand	Anodyne	ACE	34	41
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926436	EC	On-Demand	Anodyne	MME	22	41
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926436	EC	On-Demand	Anodyne	BIRC2	46	38
CON(C)CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926436	EC	On-Demand	Anodyne	BIRC8	40	31
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926437	EC	On-Demand	Anodyne	ACE	34	41
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926437	EC	On-Demand	Anodyne	MME	22	41
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926437	EC	On-Demand	Anodyne	BIRC2	46	38
CON(C)CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926437	EC	On-Demand	Anodyne	BIRC8	40	31
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCn2c(O)nnc2C1	ZINC000853926448	FC	On-Demand	Anodyne	ACE	34	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCn2c(O)nnc2C1	ZINC000853926448	FC	On-Demand	Anodyne	MME	24	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCn2c(O)nnc2C1	ZINC000853926449	FC	On-Demand	Anodyne	ACE	34	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCn2c(O)nnc2C1	ZINC000853926449	FC	On-Demand	Anodyne	MME	24	41
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NC2CCC(F)(F)CC2)C1	ZINC000853926450	FG	On-Demand	Anodyne	EPHX2	21	40
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NC2CCC(F)(F)CC2)C1	ZINC000853926451	FG	On-Demand	Anodyne	EPHX2	21	40
CN1C[C@@H](CNC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853926524	EC	On-Demand	Anodyne	CACNA1I	47	34
CN1C[C@H](CNC(=O)NCC2CN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853926525	EC	On-Demand	Anodyne	CACNA1I	47	34
CC(C)c1cccc(COC(=O)C2(C(F)(F)F)CCOCC2)c1	ZINC000853926535	EI	On-Demand	Anodyne	SLC12A5	43	35
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853926537	FF	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC(CNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853926538	FF	On-Demand	Anodyne	CACNA1I	41	33
CC(C)(C)OC(=O)N1CC(CNC(=O)NCC(O)(C2CC2)C2CC2)C1	ZINC000853926548	FD	On-Demand	Anodyne	CACNA1I	40	32
N#CC1(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCCCC1	ZINC000853926574	FF	On-Demand	Mild	ACE	25	41
N#CC1(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCCCC1	ZINC000853926574	FF	On-Demand	Mild	MME	18	41
N#CC1(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCCCC1	ZINC000853926574	FF	On-Demand	Mild	NPFFR1	41	36
N#CC1(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCCCC1	ZINC000853926576	FF	On-Demand	Mild	ACE	25	41
N#CC1(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCCCC1	ZINC000853926576	FF	On-Demand	Mild	MME	18	41
N#CC1(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCCCC1	ZINC000853926576	FF	On-Demand	Mild	NPFFR1	41	36
C[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)[C@@H]1CCO	ZINC000853926605	FE	On-Demand	Anodyne	ACE	46	41
C[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)[C@@H]1CCO	ZINC000853926605	FE	On-Demand	Anodyne	MME	28	41
C[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)[C@H]1CCO	ZINC000853926607	FE	On-Demand	Anodyne	ACE	46	41
C[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)[C@H]1CCO	ZINC000853926607	FE	On-Demand	Anodyne	MME	28	41
C[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)[C@@H]1CCO	ZINC000853926609	FE	On-Demand	Anodyne	ACE	46	41
C[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)[C@@H]1CCO	ZINC000853926609	FE	On-Demand	Anodyne	MME	28	41
C[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)[C@H]1CCO	ZINC000853926611	FE	On-Demand	Anodyne	ACE	46	41
C[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)[C@H]1CCO	ZINC000853926611	FE	On-Demand	Anodyne	MME	28	41
CNc1ccc(C(F)(F)F)cc1C(=O)OCCOC(F)F	ZINC000853926658	DG	On-Demand	Anodyne	LIPG	18	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccco2)CC1	ZINC000853926664	GG	On-Demand	Anodyne	ACE	28	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccco2)CC1	ZINC000853926664	GG	On-Demand	Anodyne	MME	18	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccco2)CC1	ZINC000853926666	GG	On-Demand	Anodyne	ACE	28	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC(c2ccco2)CC1	ZINC000853926666	GG	On-Demand	Anodyne	MME	18	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853926684	GG	On-Demand	Anodyne	ACE	33	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853926684	GG	On-Demand	Anodyne	MME	16	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000853926684	GG	On-Demand	Anodyne	SAP2	32	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853926687	GG	On-Demand	Anodyne	ACE	33	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853926687	GG	On-Demand	Anodyne	MME	16	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000853926687	GG	On-Demand	Anodyne	SAP2	32	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853926689	GG	On-Demand	Anodyne	ACE	33	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853926689	GG	On-Demand	Anodyne	MME	16	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000853926689	GG	On-Demand	Anodyne	SAP2	32	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853926691	GG	On-Demand	Anodyne	ACE	33	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853926691	GG	On-Demand	Anodyne	MME	16	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000853926691	GG	On-Demand	Anodyne	SAP2	32	40
C=CCN(C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853926748	FE	On-Demand	Mild	ACE	40	40
C=CCN(C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853926748	FE	On-Demand	Mild	MME	24	40
C=CCN(C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853926749	FE	On-Demand	Mild	ACE	40	40
C=CCN(C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853926749	FE	On-Demand	Mild	MME	24	40
C=CCN(C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853926750	FE	On-Demand	Mild	ACE	40	40
C=CCN(C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)[C@H](C)COC	ZINC000853926750	FE	On-Demand	Mild	MME	24	40
C=CCN(C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853926751	FE	On-Demand	Mild	ACE	40	40
C=CCN(C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)[C@@H](C)COC	ZINC000853926751	FE	On-Demand	Mild	MME	24	40
N#CC[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926755	FF	On-Demand	Mild	F2	17	42
N#CC[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926755	FF	On-Demand	Mild	ACE	42	42
N#CC[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926755	FF	On-Demand	Mild	F10	18	42
N#CC[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926755	FF	On-Demand	Mild	MME	22	42
N#CC[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926755	FF	On-Demand	Mild	DPP4	17	41
N#CC[C@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926755	FF	On-Demand	Mild	SAP2	33	40
N#CC[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926756	FF	On-Demand	Mild	F2	17	42
N#CC[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926756	FF	On-Demand	Mild	ACE	42	42
N#CC[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926756	FF	On-Demand	Mild	F10	18	42
N#CC[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926756	FF	On-Demand	Mild	MME	22	42
N#CC[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926756	FF	On-Demand	Mild	DPP4	17	41
N#CC[C@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926756	FF	On-Demand	Mild	SAP2	33	40
N#CC[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926757	FF	On-Demand	Mild	F2	17	42
N#CC[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926757	FF	On-Demand	Mild	ACE	42	42
N#CC[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926757	FF	On-Demand	Mild	F10	18	42
N#CC[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926757	FF	On-Demand	Mild	MME	22	42
N#CC[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926757	FF	On-Demand	Mild	DPP4	17	41
N#CC[C@@H]1CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926757	FF	On-Demand	Mild	SAP2	33	40
N#CC[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926794	FF	On-Demand	Mild	F2	17	42
N#CC[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926794	FF	On-Demand	Mild	ACE	42	42
N#CC[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926794	FF	On-Demand	Mild	F10	18	42
N#CC[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926794	FF	On-Demand	Mild	MME	22	42
N#CC[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926794	FF	On-Demand	Mild	DPP4	17	41
N#CC[C@@H]1CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853926794	FF	On-Demand	Mild	SAP2	33	40
CC(C)c1cccc(COC(=O)C2(C(=O)Nc3c(F)cccc3F)CC2)c1	ZINC000853926795	FJ	On-Demand	Anodyne	SLC12A5	48	33
O=C(OCCOC(F)F)c1nnn(-c2ccccc2)c1C(F)F	ZINC000853926806	EF	On-Demand	Anodyne	SLC5A1	23	53
C[C@@H]1CN(CCNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)[C@H](C)CO1	ZINC000853926817	GD	On-Demand	Anodyne	ACE	28	40
C[C@@H]1CN(CCNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)[C@H](C)CO1	ZINC000853926817	GD	On-Demand	Anodyne	MME	21	40
C[C@@H]1CN(CCNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)[C@H](C)CO1	ZINC000853926820	GD	On-Demand	Anodyne	ACE	28	40
C[C@@H]1CN(CCNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)[C@H](C)CO1	ZINC000853926820	GD	On-Demand	Anodyne	MME	21	40
O=C(OCc1nnc2n1CCOCC2)c1nnn(-c2ccccc2)c1C(F)F	ZINC000853926835	GD	On-Demand	Anodyne	SLC5A1	17	43
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926854	FF	On-Demand	Anodyne	F2	20	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926854	FF	On-Demand	Anodyne	ACE	46	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926854	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926854	FF	On-Demand	Anodyne	SAP2	33	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926855	FF	On-Demand	Anodyne	F2	20	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926855	FF	On-Demand	Anodyne	ACE	46	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926855	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@H](CCF)C1	ZINC000853926855	FF	On-Demand	Anodyne	SAP2	33	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926856	FF	On-Demand	Anodyne	F2	20	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926856	FF	On-Demand	Anodyne	ACE	46	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926856	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926856	FF	On-Demand	Anodyne	SAP2	33	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926857	FF	On-Demand	Anodyne	F2	20	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926857	FF	On-Demand	Anodyne	ACE	46	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926857	FF	On-Demand	Anodyne	MME	23	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CCC[C@@H](CCF)C1	ZINC000853926857	FF	On-Demand	Anodyne	SAP2	33	41
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC(Cc2ccccc2C)C1	ZINC000853926862	EF	On-Demand	Bother	WDR5	32	41
C[C@@H](CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926865	ED	On-Demand	Anodyne	ACE	57	43
C[C@@H](CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926865	ED	On-Demand	Anodyne	MME	33	43
C[C@@H](CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926865	ED	On-Demand	Anodyne	BIRC2	58	40
C[C@@H](CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926865	ED	On-Demand	Anodyne	BIRC8	41	31
C[C@@H](CCNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926865	ED	On-Demand	Anodyne	SAP2	40	36
C[C@@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926867	ED	On-Demand	Anodyne	ACE	57	43
C[C@@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926867	ED	On-Demand	Anodyne	MME	33	43
C[C@@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926867	ED	On-Demand	Anodyne	BIRC2	58	40
C[C@@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926867	ED	On-Demand	Anodyne	BIRC8	41	31
C[C@@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926867	ED	On-Demand	Anodyne	SAP2	40	36
C[C@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926868	ED	On-Demand	Anodyne	ACE	57	43
C[C@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926868	ED	On-Demand	Anodyne	MME	33	43
C[C@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926868	ED	On-Demand	Anodyne	BIRC2	58	40
C[C@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926868	ED	On-Demand	Anodyne	BIRC8	41	31
C[C@H](CCNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)N(C)C	ZINC000853926868	ED	On-Demand	Anodyne	SAP2	40	36
C=CCC1(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926869	FG	On-Demand	Mild	ACE	24	41
C=CCC1(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926869	FG	On-Demand	Mild	MME	17	41
C=CCC1(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926870	FG	On-Demand	Mild	ACE	24	41
C=CCC1(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CCCC1	ZINC000853926870	FG	On-Demand	Mild	MME	17	41
C[C@@H]1CC[C@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CS1(=O)=O	ZINC000853926873	GD	On-Demand	Anodyne	ACE	31	42
C[C@@H]1CC[C@H](NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)CS1(=O)=O	ZINC000853926873	GD	On-Demand	Anodyne	MME	19	42
C[C@@H]1CC[C@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CS1(=O)=O	ZINC000853926875	GD	On-Demand	Anodyne	ACE	31	42
C[C@@H]1CC[C@H](NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)CS1(=O)=O	ZINC000853926875	GD	On-Demand	Anodyne	MME	19	42
O=C(OCc1ncsc1Br)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926893	GG	On-Demand	Anodyne	LTA4H	18	42
O=C(OCc1ncsc1Br)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853926893	GG	On-Demand	Anodyne	SIGMAR1	37	41
O=C(OCc1ncsc1Br)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926894	GG	On-Demand	Anodyne	LTA4H	18	42
O=C(OCc1ncsc1Br)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853926894	GG	On-Demand	Anodyne	SIGMAR1	37	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853926957	ED	On-Demand	Anodyne	ACE	40	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853926957	ED	On-Demand	Anodyne	MME	23	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853926958	ED	On-Demand	Anodyne	ACE	40	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853926958	ED	On-Demand	Anodyne	MME	23	41
C/C(=C/c1ccccn1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853926981	DD	On-Demand	Anodyne	Q59401_ENTCL	47	34
C/C(=C\c1ccccn1)C(=O)OCc1nnc2n1CCOCC2	ZINC000853926982	DD	On-Demand	Anodyne	Q59401_ENTCL	47	34
O=C(CCCc1cccnc1)OCCOC(F)F	ZINC000853926988	CE	On-Demand	Anodyne	TBXAS1	46	51
O=C(CCCc1cccnc1)OCCOC(F)F	ZINC000853926988	CE	On-Demand	Anodyne	PTAFR	36	40
CC[C@H](C)N(CC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926992	EG	On-Demand	Anodyne	ACE	64	45
CC[C@H](C)N(CC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926992	EG	On-Demand	Anodyne	MME	34	45
CC[C@H](C)N(CC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926992	EG	On-Demand	Anodyne	XIAP	59	38
CC[C@H](C)N(CC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926992	EG	On-Demand	Anodyne	BIRC3	40	38
CC[C@H](C)N(CC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926992	EG	On-Demand	Anodyne	BIRC2	59	39
CC[C@H](C)N(CC)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926992	EG	On-Demand	Anodyne	BIRC8	40	32
CC[C@H](C)N(CC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926994	EG	On-Demand	Anodyne	ACE	64	45
CC[C@H](C)N(CC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926994	EG	On-Demand	Anodyne	MME	34	45
CC[C@H](C)N(CC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926994	EG	On-Demand	Anodyne	XIAP	59	38
CC[C@H](C)N(CC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926994	EG	On-Demand	Anodyne	BIRC3	40	38
CC[C@H](C)N(CC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926994	EG	On-Demand	Anodyne	BIRC2	59	39
CC[C@H](C)N(CC)C(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853926994	EG	On-Demand	Anodyne	BIRC8	40	32
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853927000	GD	On-Demand	Anodyne	CALCRL	28	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](Cn2ccnn2)C1	ZINC000853927001	GD	On-Demand	Anodyne	CALCRL	28	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](Cn2ccnn2)C1	ZINC000853927002	GD	On-Demand	Anodyne	CALCRL	28	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](Cn2ccnn2)C1	ZINC000853927003	GD	On-Demand	Anodyne	CALCRL	28	40
O=C1CCC2=C(CCN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)C2)N1	ZINC000853927009	GD	On-Demand	Anodyne	ACE	34	41
O=C1CCC2=C(CCN(C(=O)N[C@@H]3CCCN(Cc4ccccc4)C3=O)C2)N1	ZINC000853927009	GD	On-Demand	Anodyne	MME	22	41
O=C1CCC2=C(CCN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)C2)N1	ZINC000853927010	GD	On-Demand	Anodyne	ACE	34	41
O=C1CCC2=C(CCN(C(=O)N[C@H]3CCCN(Cc4ccccc4)C3=O)C2)N1	ZINC000853927010	GD	On-Demand	Anodyne	MME	22	41
CO[C@]1(CO)CCCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853927011	GD	On-Demand	Anodyne	SLC12A5	44	34
CO[C@]1(CO)CCCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2=O)C1	ZINC000853927014	GD	On-Demand	Anodyne	SLC12A5	44	34
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927018	FD	On-Demand	Anodyne	PRSS1	20	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927018	FD	On-Demand	Anodyne	ACE	31	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927018	FD	On-Demand	Anodyne	F10	17	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927018	FD	On-Demand	Anodyne	MME	19	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927019	FD	On-Demand	Anodyne	PRSS1	20	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927019	FD	On-Demand	Anodyne	ACE	31	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927019	FD	On-Demand	Anodyne	F10	17	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](O)C(F)(F)C1	ZINC000853927019	FD	On-Demand	Anodyne	MME	19	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927020	FD	On-Demand	Anodyne	PRSS1	20	41
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927020	FD	On-Demand	Anodyne	ACE	31	42
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927020	FD	On-Demand	Anodyne	F10	17	40
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927020	FD	On-Demand	Anodyne	MME	19	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927021	FD	On-Demand	Anodyne	PRSS1	20	41
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927021	FD	On-Demand	Anodyne	ACE	31	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927021	FD	On-Demand	Anodyne	F10	17	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](O)C(F)(F)C1	ZINC000853927021	FD	On-Demand	Anodyne	MME	19	42
CCCC[C@@](C)(F)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853927032	FG	On-Demand	Anodyne	MMP1	15	41
CCCC[C@@](C)(F)C(=O)O[C@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853927032	FG	On-Demand	Anodyne	PROKR1	46	30
CCCC[C@@](C)(F)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853927033	FG	On-Demand	Anodyne	MMP1	15	41
CCCC[C@@](C)(F)C(=O)O[C@@H]1CCN(Cc2ccc(OC)cc2)C1=O	ZINC000853927033	FG	On-Demand	Anodyne	PROKR1	46	30
O=C1[C@@H](NC(=O)N(CCOCCO)C2CCC2)CCCN1Cc1ccccc1	ZINC000853927038	GD	On-Demand	Anodyne	ACE	30	42
O=C1[C@@H](NC(=O)N(CCOCCO)C2CCC2)CCCN1Cc1ccccc1	ZINC000853927038	GD	On-Demand	Anodyne	MME	21	42
O=C1[C@H](NC(=O)N(CCOCCO)C2CCC2)CCCN1Cc1ccccc1	ZINC000853927039	GD	On-Demand	Anodyne	ACE	30	42
O=C1[C@H](NC(=O)N(CCOCCO)C2CCC2)CCCN1Cc1ccccc1	ZINC000853927039	GD	On-Demand	Anodyne	MME	21	42
O=C1[C@@H](NC(=O)N2CC[C@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927053	GG	On-Demand	Anodyne	ACE	44	44
O=C1[C@@H](NC(=O)N2CC[C@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927053	GG	On-Demand	Anodyne	MME	25	44
O=C1[C@@H](NC(=O)N2CC[C@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927053	GG	On-Demand	Anodyne	SIGMAR1	23	43
O=C1[C@H](NC(=O)N2CC[C@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927054	GG	On-Demand	Anodyne	ACE	44	44
O=C1[C@H](NC(=O)N2CC[C@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927054	GG	On-Demand	Anodyne	MME	25	44
O=C1[C@H](NC(=O)N2CC[C@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927054	GG	On-Demand	Anodyne	SIGMAR1	23	43
O=C1[C@@H](NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927055	GG	On-Demand	Anodyne	ACE	44	44
O=C1[C@@H](NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927055	GG	On-Demand	Anodyne	MME	25	44
O=C1[C@@H](NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927055	GG	On-Demand	Anodyne	SIGMAR1	23	43
O=C1[C@H](NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927056	GG	On-Demand	Anodyne	ACE	44	44
O=C1[C@H](NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927056	GG	On-Demand	Anodyne	MME	25	44
O=C1[C@H](NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CCCN1Cc1ccccc1	ZINC000853927056	GG	On-Demand	Anodyne	SIGMAR1	23	43
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927059	GF	On-Demand	Anodyne	ACE	42	45
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927059	GF	On-Demand	Anodyne	MME	26	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853927060	GF	On-Demand	Anodyne	ACE	42	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853927060	GF	On-Demand	Anodyne	MME	26	45
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927061	GF	On-Demand	Anodyne	ACE	42	45
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927061	GF	On-Demand	Anodyne	MME	26	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853927062	GF	On-Demand	Anodyne	ACE	42	45
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853927062	GF	On-Demand	Anodyne	MME	26	45
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccccn1	ZINC000853927064	FF	On-Demand	Anodyne	ACE	39	41
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccccn1	ZINC000853927064	FF	On-Demand	Anodyne	MME	23	41
O=C(NC/C=C\CO)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927082	DD	On-Demand	Anodyne	ACE	34	44
O=C(NC/C=C\CO)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927082	DD	On-Demand	Anodyne	MME	22	44
O=C(NC/C=C/CO)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927083	DD	On-Demand	Anodyne	ACE	34	44
O=C(NC/C=C/CO)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927083	DD	On-Demand	Anodyne	MME	22	44
O=C(NC/C=C/CO)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927084	DD	On-Demand	Anodyne	ACE	34	44
O=C(NC/C=C/CO)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927084	DD	On-Demand	Anodyne	MME	22	44
O=C(NC/C=C\CO)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927085	DD	On-Demand	Anodyne	ACE	34	44
O=C(NC/C=C\CO)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927085	DD	On-Demand	Anodyne	MME	22	44
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853927110	GD	On-Demand	Anodyne	BIRC8	41	34
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853927111	GD	On-Demand	Anodyne	BIRC8	41	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853927112	GD	On-Demand	Anodyne	BIRC8	41	34
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853927113	GD	On-Demand	Anodyne	BIRC8	41	34
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	F2	27	42
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	PRSS1	29	42
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	ACE	45	43
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	F10	22	41
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	MME	27	43
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	NPY1R	25	40
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	APP	18	45
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	XIAP	42	41
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	BIRC2	42	38
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	BIRC8	40	31
C[C@@H](CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)S(N)(=O)=O	ZINC000853927116	FC	On-Demand	Anodyne	TMPRSS11D	50	34
COCCN(CCF)C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927124	FD	On-Demand	Anodyne	ACE	45	39
CC(C)(CO)[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853927129	FE	On-Demand	Anodyne	ACE	52	44
CC(C)(CO)[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853927129	FE	On-Demand	Anodyne	MME	36	44
CC(C)(CO)[C@H](NC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853927129	FE	On-Demand	Anodyne	BIRC2	44	36
CC(C)(CO)[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853927131	FE	On-Demand	Anodyne	ACE	52	44
CC(C)(CO)[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853927131	FE	On-Demand	Anodyne	MME	36	44
CC(C)(CO)[C@H](NC(=O)N[C@H]1CCCN(Cc2ccccc2)C1=O)C1CC1	ZINC000853927131	FE	On-Demand	Anodyne	BIRC2	44	36
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853927141	GD	On-Demand	Anodyne	PRSS1	21	42
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853927141	GD	On-Demand	Anodyne	ACE	26	40
O=C(N[C@H]1CCCN(Cc2ccccc2)C1=O)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853927141	GD	On-Demand	Anodyne	MME	17	40
O=C(N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927142	GD	On-Demand	Anodyne	PRSS1	21	42
O=C(N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927142	GD	On-Demand	Anodyne	ACE	26	40
O=C(N[C@H]1C[C@@H](O)[C@@H]1n1cccn1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927142	GD	On-Demand	Anodyne	MME	17	40
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927158	GG	On-Demand	Reactive	SIGMAR1	23	41
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927158	GG	On-Demand	Reactive	NPY1R	26	40
O=C(NNc1cc(F)cc(Cl)c1)N[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927158	GG	On-Demand	Reactive	APP	15	40
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927159	GG	On-Demand	Reactive	SIGMAR1	23	41
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927159	GG	On-Demand	Reactive	NPY1R	26	40
O=C(NNc1cc(F)cc(Cl)c1)N[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853927159	GG	On-Demand	Reactive	APP	15	40
O=C(OCCN1CCOCC1)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853927248	FE	On-Demand	Anodyne	HTR4	16	40
O=C(OCCN1CCOCC1)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853927249	FE	On-Demand	Anodyne	HTR4	16	40
NC(=O)c1ccc(/C=C/C(=O)OCCCN2CCOCC2)o1	ZINC000853927560	DC	On-Demand	Anodyne	EPHX2	15	40
O=C(NCc1noc(C2CC2)n1)NNc1nc2ccc(Cl)cc2s1	ZINC000853927605	FG	On-Demand	Reactive	CSNK1D	28	41
O=C(OCc1noc(C2CC2)n1)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853927615	FG	On-Demand	Anodyne	ETHR	42	36
O=C(OCc1noc(C2CC2)n1)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853927616	FG	On-Demand	Anodyne	ETHR	42	36
O=C(OCCF)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853927651	CF	On-Demand	Anodyne	PTGS2	15	46
O=C(OCCF)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853927652	CF	On-Demand	Anodyne	PTGS2	15	46
NC(=O)c1ccc(/C=C\C(=O)OCCCN2CCOCC2)o1	ZINC000853927661	DC	On-Demand	Anodyne	EPHX2	15	40
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)NCC2(c3ccccc3)CC2)o1	ZINC000853927743	FD	On-Demand	Anodyne	KCNA3	42	35
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)NCC2(c3ccccc3)CC2)o1	ZINC000853927743	FD	On-Demand	Anodyne	NPFFR1	28	42
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)NCC2(c3ccccc3)CC2)o1	ZINC000853927744	FD	On-Demand	Anodyne	KCNA3	42	35
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)NCC2(c3ccccc3)CC2)o1	ZINC000853927744	FD	On-Demand	Anodyne	NPFFR1	28	42
C[C@H](CO)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853927796	DF	On-Demand	Anodyne	PTGS2	15	43
C[C@H](CO)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853927797	DF	On-Demand	Anodyne	PTGS2	15	43
C[C@@H](CO)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853927798	DF	On-Demand	Anodyne	PTGS2	15	43
C[C@@H](CO)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853927799	DF	On-Demand	Anodyne	PTGS2	15	43
CCC(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853927800	DF	On-Demand	Anodyne	PTGS2	15	44
CCC(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853927801	DF	On-Demand	Anodyne	PTGS2	15	44
CON(C)CCNC(=O)N[C@H](C)Cn1ncc2ccccc2c1=O	ZINC000853927806	EC	On-Demand	Anodyne	POLR1A	42	34
CON(C)CCNC(=O)N[C@@H](C)Cn1ncc2ccccc2c1=O	ZINC000853927807	EC	On-Demand	Anodyne	POLR1A	42	34
O=C(OCCCn1ccnc1)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853927861	FG	On-Demand	Anodyne	TBXAS1	40	43
O=C(OCCCn1ccnc1)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853927863	FG	On-Demand	Anodyne	TBXAS1	40	43
COc1ccc2c(NCC(C)(C)[C@]3(O)CCCOC3)ccnc2c1	ZINC000853927883	EG	On-Demand	Anodyne	HRP1_PLAFA	71	40
COc1ccc2c(NCC(C)(C)[C@]3(O)CCCOC3)ccnc2c1	ZINC000853927883	EG	On-Demand	Anodyne	HNMT	60	35
COc1ccc2c(NCC(C)(C)[C@@]3(O)CCCOC3)ccnc2c1	ZINC000853927884	EG	On-Demand	Anodyne	HRP1_PLAFA	71	40
COc1ccc2c(NCC(C)(C)[C@@]3(O)CCCOC3)ccnc2c1	ZINC000853927884	EG	On-Demand	Anodyne	HNMT	60	35
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc3ccccc3n2)C1	ZINC000853927913	GG	On-Demand	Anodyne	CYSLTR1	42	37
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc3ccccc3n2)C1	ZINC000853927913	GG	On-Demand	Anodyne	ALOX5AP	40	35
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc3ccccc3n2)C1	ZINC000853927914	GG	On-Demand	Anodyne	CYSLTR1	42	37
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc3ccccc3n2)C1	ZINC000853927914	GG	On-Demand	Anodyne	ALOX5AP	40	35
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)Nc2ccccc2F)C1	ZINC000853927919	GE	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)Nc2ccccc2F)C1	ZINC000853927920	GE	On-Demand	Anodyne	GPR119	21	41
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)N2CCC(Cc3ccccc3)CC2)o1	ZINC000853927943	GE	On-Demand	Anodyne	GRIN2B	65	47
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)N2CCC(Cc3ccccc3)CC2)o1	ZINC000853927945	GE	On-Demand	Anodyne	GRIN2B	65	47
C[C@H](NC(=O)COC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853927946	GC	On-Demand	Anodyne	DPP7	43	34
C[C@@H](NC(=O)COC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853927947	GC	On-Demand	Anodyne	DPP7	43	34
C[C@H](NC(=O)COC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853927949	GC	On-Demand	Anodyne	DPP7	43	34
C[C@@H](NC(=O)COC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853927951	GC	On-Demand	Anodyne	DPP7	43	34
CC(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853928124	DF	On-Demand	Anodyne	PTGS2	15	48
CC(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853928125	DF	On-Demand	Anodyne	PTGS2	15	48
O=C(COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F)NC(=O)NC1CC1	ZINC000853928127	GD	On-Demand	Anodyne	EPHX2	42	37
O=C(COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F)NC(=O)NC1CC1	ZINC000853928128	GD	On-Demand	Anodyne	EPHX2	42	37
C[C@@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCc2ccccc2C1	ZINC000853928233	FD	On-Demand	Anodyne	DPP8	21	43
C[C@@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCc2ccccc2C1	ZINC000853928235	FD	On-Demand	Anodyne	DPP8	21	43
C[C@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCc2ccccc2C1	ZINC000853928237	FD	On-Demand	Anodyne	DPP8	21	43
C[C@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCc2ccccc2C1	ZINC000853928239	FD	On-Demand	Anodyne	DPP8	21	43
O=C(OCC(F)(F)F)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853928248	EG	On-Demand	Anodyne	PTGS2	15	47
O=C(OCC(F)(F)F)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853928249	EG	On-Demand	Anodyne	PTGS2	15	47
C[Si](C)(C)c1ccc(CNC(=O)NCc2noc(C3CC3)n2)cc1	ZINC000853928268	EE	On-Demand	Anodyne	SPHK1	17	41
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCN(c2ccccc2F)C1	ZINC000853928501	GD	On-Demand	Anodyne	SLC6A1	41	33
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCN(c2ccccc2F)C1	ZINC000853928502	GD	On-Demand	Anodyne	SLC6A1	41	33
C[C@@H](O)C1(Nc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000853928519	FE	On-Demand	Bother	COLA	42	33
COc1c(C)ncnc1NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853928526	EG	On-Demand	Anodyne	PDE6A	42	32
COc1c(C)ncnc1NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853928527	EG	On-Demand	Anodyne	PDE6A	42	32
CC[C@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(CSc2ccccc2)cc1	ZINC000853928533	FI	On-Demand	Anodyne	CAPN2	49	32
CC[C@H](C)NC(=O)[C@H](C)OC(=O)c1ccc(CSc2ccccc2)cc1	ZINC000853928533	FI	On-Demand	Anodyne	ACE2	47	34
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc(CSc2ccccc2)cc1	ZINC000853928535	FI	On-Demand	Anodyne	CAPN2	49	32
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)c1ccc(CSc2ccccc2)cc1	ZINC000853928535	FI	On-Demand	Anodyne	ACE2	47	34
COc1cccc(OC(F)(F)F)c1C(=O)OCCOC(F)F	ZINC000853928543	EF	On-Demand	Anodyne	KCNK3	19	40
COc1cccc(OC(F)(F)F)c1C(=O)OCCOC(F)F	ZINC000853928543	EF	On-Demand	Anodyne	KCNK9	24	40
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853928583	FE	On-Demand	Mild	ADRA1A	45	36
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853928584	FE	On-Demand	Mild	ADRA1A	45	36
C#CCCN(CCOC)C(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853928585	FE	On-Demand	Mild	ADRA1A	45	36
C#CCCN(CCOC)C(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853928586	FE	On-Demand	Mild	ADRA1A	45	36
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)NC23CC4CC(CC(C4)C2)C3)o1	ZINC000853928611	FE	On-Demand	Anodyne	EPHX2	47	40
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)NC23CC4CC(CC(C4)C2)C3)o1	ZINC000853928612	FE	On-Demand	Anodyne	EPHX2	47	40
NC(=O)c1ccc(/C=C/C(=O)OCc2nc(N)c3c4c(sc3n2)CCCC4)o1	ZINC000853928617	GF	On-Demand	Anodyne	EEF2K	55	34
NC(=O)c1ccc(/C=C\C(=O)OCc2nc(N)c3c4c(sc3n2)CCCC4)o1	ZINC000853928618	GF	On-Demand	Anodyne	EEF2K	55	34
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)c2ccccc2F)C1	ZINC000853928659	GE	On-Demand	Anodyne	GPR119	20	42
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)c2ccccc2F)C1	ZINC000853928660	GE	On-Demand	Anodyne	GPR119	20	42
C[C@@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853928810	GE	On-Demand	Mild	VIPR1	29	45
C[C@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853928811	GE	On-Demand	Mild	VIPR1	29	45
C[C@@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853928812	GE	On-Demand	Mild	VIPR1	29	45
C[C@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853928813	GE	On-Demand	Mild	VIPR1	29	45
CCOC(=O)c1csc(NC[C@@H](O)c2ccc(Cl)c(Cl)c2)n1	ZINC000853928907	FH	On-Demand	Anodyne	DHODH	15	41
CCOC(=O)c1csc(NC[C@H](O)c2ccc(Cl)c(Cl)c2)n1	ZINC000853928908	FH	On-Demand	Anodyne	DHODH	15	41
C[C@@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853928981	GG	On-Demand	Anodyne	PTGS2	15	41
C[C@@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853928981	GG	On-Demand	Anodyne	CPT1A	86	37
C[C@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853928983	GG	On-Demand	Anodyne	PTGS2	15	41
C[C@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853928983	GG	On-Demand	Anodyne	CPT1A	86	37
C[C@@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853928985	GG	On-Demand	Anodyne	PTGS2	15	41
C[C@@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853928985	GG	On-Demand	Anodyne	CPT1A	86	37
C[C@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853928987	GG	On-Demand	Anodyne	PTGS2	15	41
C[C@H]1CCCCN1C(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853928987	GG	On-Demand	Anodyne	CPT1A	86	37
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)c2cccc(F)c2)C1	ZINC000853929000	GE	On-Demand	Anodyne	GPR119	22	43
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)c2cccc(F)c2)C1	ZINC000853929002	GE	On-Demand	Anodyne	GPR119	22	43
NC(=O)c1ccc(/C=C\C(=O)O[C@@H]2CCOC2=O)o1	ZINC000853929060	CC	On-Demand	Anodyne	TRAR	46	31
CNC(=O)CC1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853929117	EF	On-Demand	Bother	GSTM2	114	42
CNC(=O)CC1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853929117	EF	On-Demand	Bother	GSTP1	71	41
NC(=O)c1ccc(/C=C/C(=O)O[C@@H]2CCOC2=O)o1	ZINC000853929189	CC	On-Demand	Anodyne	TRAR	46	31
NC(=O)c1ccc(/C=C/C(=O)O[C@H]2CCOC2=O)o1	ZINC000853929191	CC	On-Demand	Anodyne	TRAR	46	31
NC(=O)c1ccc(/C=C\C(=O)O[C@H]2CCOC2=O)o1	ZINC000853929193	CC	On-Demand	Anodyne	TRAR	46	31
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)c2cc(F)ccc2F)C1	ZINC000853929194	GF	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)c2cc(F)ccc2F)C1	ZINC000853929197	GF	On-Demand	Anodyne	GPR119	21	43
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(C#N)cc2F)C1	ZINC000853929266	GF	On-Demand	Mild	GPR119	29	42
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(C#N)cc2F)C1	ZINC000853929268	GF	On-Demand	Mild	GPR119	29	42
NC(=O)c1ccc(/C=C/C(=O)O[C@@H](C(=O)N2CCCCC2)c2ccccc2)o1	ZINC000853929360	GF	On-Demand	Anodyne	DPP7	43	34
O=C(OCCO)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853929385	CD	On-Demand	Anodyne	PTGS2	15	46
O=C(OCCO)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853929386	CD	On-Demand	Anodyne	PTGS2	15	46
O[C@@H](CNc1nccc(N[C@@H]2CCCOC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929389	GH	On-Demand	Anodyne	MAPK1	64	36
O[C@H](CNc1nccc(N[C@@H]2CCCOC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929390	GH	On-Demand	Anodyne	MAPK1	64	36
O[C@H](CNc1nccc(N[C@H]2CCCOC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929391	GH	On-Demand	Anodyne	MAPK1	64	36
O[C@@H](CNc1nccc(N[C@H]2CCCOC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929392	GH	On-Demand	Anodyne	MAPK1	64	36
CCOC(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853929437	EE	On-Demand	Anodyne	PTGS2	15	48
CCOC(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853929438	EE	On-Demand	Anodyne	PTGS2	15	48
NC(=O)c1ccc(/C=C\C(=O)O[C@@H](C(=O)N2CCCCC2)c2ccccc2)o1	ZINC000853929471	GF	On-Demand	Anodyne	DPP7	43	34
NC(=O)c1ccc(/C=C/C(=O)O[C@H](C(=O)N2CCCCC2)c2ccccc2)o1	ZINC000853929473	GF	On-Demand	Anodyne	DPP7	43	34
NC(=O)c1ccc(/C=C\C(=O)O[C@H](C(=O)N2CCCCC2)c2ccccc2)o1	ZINC000853929475	GF	On-Demand	Anodyne	DPP7	43	34
C[C@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853929510	FE	On-Demand	Anodyne	TPP2	55	36
C[C@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853929512	FE	On-Demand	Anodyne	TPP2	55	36
C[C@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853929514	FE	On-Demand	Anodyne	TPP2	55	36
C[C@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1c2ccccc2C[C@@H]1C	ZINC000853929516	FE	On-Demand	Anodyne	TPP2	55	36
C[C@@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853929726	DD	On-Demand	Anodyne	DPP7	55	36
C[C@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853929727	DD	On-Demand	Anodyne	DPP7	55	36
C[C@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853929728	DD	On-Demand	Anodyne	DPP7	55	36
C[C@@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCCCC1	ZINC000853929729	DD	On-Demand	Anodyne	DPP7	55	36
O[C@@H](CNc1nccc(N2CCCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929787	FH	On-Demand	Anodyne	SORD	60	39
O[C@@H](CNc1nccc(N2CCCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929787	FH	On-Demand	Anodyne	MRGPRX1	40	34
O[C@H](CNc1nccc(N2CCCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929788	FH	On-Demand	Anodyne	SORD	60	39
O[C@H](CNc1nccc(N2CCCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853929788	FH	On-Demand	Anodyne	MRGPRX1	40	34
C[C@@H](O)C1(Nc2ccc3c(c2)S(=O)(=O)N=C3Cl)CC1	ZINC000853929816	DD	On-Demand	Anodyne	ABCC8	47	35
COCCN(CCF)C(=O)N[C@@H]1CCCN(c2ccccc2F)C1	ZINC000853929827	EE	On-Demand	Anodyne	ACKR3	65	35
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)/C=C\c1ccc(C(N)=O)o1	ZINC000853929913	GC	On-Demand	Anodyne	FKBP1A	66	38
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)/C=C/c1ccc(C(N)=O)o1	ZINC000853929914	GC	On-Demand	Anodyne	FKBP1A	66	38
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)o1	ZINC000853930009	GD	On-Demand	Anodyne	STAT6	65	37
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)o1	ZINC000853930011	GD	On-Demand	Anodyne	STAT6	65	37
NC(=O)c1ccc(/C=C\C(=O)OCc2ccc(CN3CCCCC3)cc2)o1	ZINC000853930097	FG	On-Demand	Anodyne	HRH3	15	42
NC(=O)c1ccc(/C=C/C(=O)OCc2ccc(CN3CCCCC3)cc2)o1	ZINC000853930099	FG	On-Demand	Anodyne	HRH3	15	42
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)o1	ZINC000853930115	EB	On-Demand	Anodyne	CPT2	40	34
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)o1	ZINC000853930117	EB	On-Demand	Anodyne	CPT2	40	34
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)o1	ZINC000853930119	EB	On-Demand	Anodyne	CPT2	40	34
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)o1	ZINC000853930121	EB	On-Demand	Anodyne	CPT2	40	34
CON(C)CCNC(=O)N[C@@H]1CCCN(c2ccccc2F)C1	ZINC000853930163	DD	On-Demand	Anodyne	KCNQ2	53	35
CON(C)CCNC(=O)N[C@H]1CCCN(c2ccccc2F)C1	ZINC000853930164	DD	On-Demand	Anodyne	KCNQ2	53	35
COCCOC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853930309	DF	On-Demand	Anodyne	PTGS2	15	48
COCCOC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853930311	DF	On-Demand	Anodyne	PTGS2	15	48
O=C(OCCCN1CCOCC1)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853930421	FF	On-Demand	Anodyne	CASR	29	40
O=C(OCCCN1CCOCC1)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853930421	FF	On-Demand	Anodyne	EPHX2	22	45
O=C(OCCCN1CCOCC1)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853930423	FF	On-Demand	Anodyne	CASR	29	40
O=C(OCCCN1CCOCC1)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853930423	FF	On-Demand	Anodyne	EPHX2	22	45
NC(=O)c1ccc(/C=C\C(=O)OCC[C@@H]2CCOC2=O)o1	ZINC000853930468	CC	On-Demand	Anodyne	TRAR	53	34
NC(=O)c1ccc(/C=C/C(=O)OCC[C@@H]2CCOC2=O)o1	ZINC000853930470	CC	On-Demand	Anodyne	TRAR	53	34
NC(=O)c1ccc(/C=C/C(=O)OCC[C@H]2CCOC2=O)o1	ZINC000853930472	CC	On-Demand	Anodyne	TRAR	53	34
NC(=O)c1ccc(/C=C\C(=O)OCC[C@H]2CCOC2=O)o1	ZINC000853930474	CC	On-Demand	Anodyne	TRAR	53	34
CCN(C)C(=O)COC(=O)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853930499	EE	On-Demand	Anodyne	PTGS2	15	44
CCN(C)C(=O)COC(=O)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853930502	EE	On-Demand	Anodyne	PTGS2	15	44
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)NCC2(c3ccccc3)CCCC2)o1	ZINC000853930576	GF	On-Demand	Anodyne	KCNA3	40	35
NC(=O)c1ccc(/C=C\C(=O)OCC(=O)NCC2(c3ccccc3)CCCC2)o1	ZINC000853930576	GF	On-Demand	Anodyne	NPFFR1	26	41
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)NCC2(c3ccccc3)CCCC2)o1	ZINC000853930577	GF	On-Demand	Anodyne	KCNA3	40	35
NC(=O)c1ccc(/C=C/C(=O)OCC(=O)NCC2(c3ccccc3)CCCC2)o1	ZINC000853930577	GF	On-Demand	Anodyne	NPFFR1	26	41
C[C@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCCCCC1	ZINC000853930580	ED	On-Demand	Anodyne	DPP7	55	36
C[C@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCCCCC1	ZINC000853930581	ED	On-Demand	Anodyne	DPP7	55	36
C[C@@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)N1CCCCCC1	ZINC000853930582	ED	On-Demand	Anodyne	DPP7	55	36
C[C@@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)N1CCCCCC1	ZINC000853930583	ED	On-Demand	Anodyne	DPP7	55	36
COC(=O)C1CCN(C(=O)COC(=O)/C=C/c2ccc(C(N)=O)o2)CC1	ZINC000853930624	FC	On-Demand	Anodyne	PTR1	43	30
COC(=O)C1CCN(C(=O)COC(=O)/C=C\c2ccc(C(N)=O)o2)CC1	ZINC000853930625	FC	On-Demand	Anodyne	PTR1	43	30
O=C(NC1CCCC1)c1ccc(NC[C@H](O)c2ccc(Cl)c(Cl)c2)nn1	ZINC000853930659	GH	On-Demand	Anodyne	CNR1	17	40
O=C(NC1CCCC1)c1ccc(NC[C@H](O)c2ccc(Cl)c(Cl)c2)nn1	ZINC000853930659	GH	On-Demand	Anodyne	CNR2	16	40
O=C(NC1CCCC1)c1ccc(NC[C@@H](O)c2ccc(Cl)c(Cl)c2)nn1	ZINC000853930660	GH	On-Demand	Anodyne	CNR1	17	40
O=C(NC1CCCC1)c1ccc(NC[C@@H](O)c2ccc(Cl)c(Cl)c2)nn1	ZINC000853930660	GH	On-Demand	Anodyne	CNR2	16	40
O[C@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)c(Cl)c1	ZINC000853930699	FH	On-Demand	Anodyne	ADORA1	59	45
O[C@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)c(Cl)c1	ZINC000853930699	FH	On-Demand	Anodyne	ADORA3	63	43
O[C@@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)c(Cl)c1	ZINC000853930700	FH	On-Demand	Anodyne	ADORA1	59	45
O[C@@H](CNc1ncnc2c1ncn2C1CC1)c1ccc(Cl)c(Cl)c1	ZINC000853930700	FH	On-Demand	Anodyne	ADORA3	63	43
NC(=O)c1ccc(/C=C\C(=O)OCCCN2CCCC2)o1	ZINC000853930763	CD	On-Demand	Anodyne	HRH3	32	42
NC(=O)c1ccc(/C=C/C(=O)OCCCN2CCCC2)o1	ZINC000853930764	CD	On-Demand	Anodyne	HRH3	32	42
CC(C)(C)OC(=O)N1CCC(CCOC(=O)/C=C\c2ccc(C(N)=O)o2)CC1	ZINC000853930797	GF	On-Demand	Anodyne	GPR119	46	45
CC(C)(C)OC(=O)N1CCC(CCOC(=O)/C=C/c2ccc(C(N)=O)o2)CC1	ZINC000853930798	GF	On-Demand	Anodyne	GPR119	46	45
O=C(OCCn1ccnc1)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853930910	EF	On-Demand	Anodyne	TBXAS1	33	40
O=C(OCCn1ccnc1)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853930911	EF	On-Demand	Anodyne	TBXAS1	33	40
O=C(OCC(F)F)C1=Cc2ccccc2O[C@H]1C(F)(F)F	ZINC000853930920	DG	On-Demand	Anodyne	PTGS2	15	45
O=C(OCC(F)F)C1=Cc2ccccc2O[C@@H]1C(F)(F)F	ZINC000853930921	DG	On-Demand	Anodyne	PTGS2	15	45
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2cc(F)ccc2F)C1	ZINC000853930961	FF	On-Demand	Anodyne	GPR119	26	49
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2cc(F)ccc2F)C1	ZINC000853930963	FF	On-Demand	Anodyne	GPR119	26	49
C[C@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853930975	GE	On-Demand	Anodyne	EPHX2	38	40
C[C@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853930976	GE	On-Demand	Anodyne	EPHX2	38	40
C[C@@H](OC(=O)/C=C\c1ccc(C(N)=O)o1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853930977	GE	On-Demand	Anodyne	EPHX2	38	40
C[C@@H](OC(=O)/C=C/c1ccc(C(N)=O)o1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853930978	GE	On-Demand	Anodyne	EPHX2	38	40
CN(C)S(=O)(=O)c1ccccc1NC[C@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853931067	GG	On-Demand	Anodyne	ADRB3	21	45
CN(C)S(=O)(=O)c1ccccc1NC[C@@H](O)c1ccc(Cl)c(Cl)c1	ZINC000853931068	GG	On-Demand	Anodyne	ADRB3	21	45
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931093	FF	On-Demand	Anodyne	MAPK1	58	34
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931093	FF	On-Demand	Anodyne	SORD	42	37
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931093	FF	On-Demand	Anodyne	EPHB4	76	39
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931093	FF	On-Demand	Anodyne	MRGPRX1	40	37
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931093	FF	On-Demand	Anodyne	SMG1	31	44
O[C@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931094	FF	On-Demand	Anodyne	MAPK1	58	34
O[C@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931094	FF	On-Demand	Anodyne	SORD	42	37
O[C@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931094	FF	On-Demand	Anodyne	EPHB4	76	39
O[C@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931094	FF	On-Demand	Anodyne	MRGPRX1	40	37
O[C@H](CNc1nccc(N2CCOCC2)n1)c1ccc(Cl)c(Cl)c1	ZINC000853931094	FF	On-Demand	Anodyne	SMG1	31	44
CON(C)CCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853931272	ED	On-Demand	Anodyne	ADRA1D	28	41
CON(C)CCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853931272	ED	On-Demand	Anodyne	ADRA1A	51	41
CON(C)CCNC(=O)N[C@@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853931272	ED	On-Demand	Anodyne	ADRA1B	32	41
CON(C)CCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853931274	ED	On-Demand	Anodyne	ADRA1D	28	41
CON(C)CCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853931274	ED	On-Demand	Anodyne	ADRA1A	51	41
CON(C)CCNC(=O)N[C@H]1CCN(C)[C@H]1c1ccc(F)c(F)c1	ZINC000853931274	ED	On-Demand	Anodyne	ADRA1B	32	41
CON(C)CCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853931276	ED	On-Demand	Anodyne	ADRA1D	28	41
CON(C)CCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853931276	ED	On-Demand	Anodyne	ADRA1A	51	41
CON(C)CCNC(=O)N[C@@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853931276	ED	On-Demand	Anodyne	ADRA1B	32	41
CON(C)CCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853931278	ED	On-Demand	Anodyne	ADRA1D	28	41
CON(C)CCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853931278	ED	On-Demand	Anodyne	ADRA1A	51	41
CON(C)CCNC(=O)N[C@H]1CCN(C)[C@@H]1c1ccc(F)c(F)c1	ZINC000853931278	ED	On-Demand	Anodyne	ADRA1B	32	41
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)Nc2cccc(F)c2)C1	ZINC000853931297	GE	On-Demand	Anodyne	GPR119	18	42
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)Nc2cccc(F)c2)C1	ZINC000853931299	GE	On-Demand	Anodyne	GPR119	18	42
CNC(=O)CC1(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCCC1	ZINC000853931346	FG	On-Demand	Bother	NMBR	60	32
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)c2ccc(F)cc2F)C1	ZINC000853931361	GF	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)c2ccc(F)cc2F)C1	ZINC000853931363	GF	On-Demand	Anodyne	GPR119	21	41
CN1CCCC[C@H]1CCOC(=O)/C=C\c1ccc(C(N)=O)o1	ZINC000853931417	DD	On-Demand	Anodyne	CHRNA10	47	32
CN1CCCC[C@H]1CCOC(=O)/C=C\c1ccc(C(N)=O)o1	ZINC000853931417	DD	On-Demand	Anodyne	ACKR3	63	33
CN1CCCC[C@@H]1CCOC(=O)/C=C/c1ccc(C(N)=O)o1	ZINC000853931419	DD	On-Demand	Anodyne	CHRNA10	47	32
CN1CCCC[C@@H]1CCOC(=O)/C=C/c1ccc(C(N)=O)o1	ZINC000853931419	DD	On-Demand	Anodyne	ACKR3	63	33
CN1CCCC[C@H]1CCOC(=O)/C=C/c1ccc(C(N)=O)o1	ZINC000853931421	DD	On-Demand	Anodyne	CHRNA10	47	32
CN1CCCC[C@H]1CCOC(=O)/C=C/c1ccc(C(N)=O)o1	ZINC000853931421	DD	On-Demand	Anodyne	ACKR3	63	33
CN1CCCC[C@@H]1CCOC(=O)/C=C\c1ccc(C(N)=O)o1	ZINC000853931422	DD	On-Demand	Anodyne	CHRNA10	47	32
CN1CCCC[C@@H]1CCOC(=O)/C=C\c1ccc(C(N)=O)o1	ZINC000853931422	DD	On-Demand	Anodyne	ACKR3	63	33
NC(=O)c1ccc(/C=C/C(=O)OCCCN2CCCCC2)o1	ZINC000853931614	DD	On-Demand	Anodyne	HRH3	43	44
NC(=O)c1ccc(/C=C\C(=O)OCCCN2CCCCC2)o1	ZINC000853931616	DD	On-Demand	Anodyne	HRH3	43	44
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCCCC(=O)c2ccccc2)C1	ZINC000853931692	GG	On-Demand	Anodyne	CYP2J2	47	35
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCCCC(=O)c2ccccc2)C1	ZINC000853931695	GG	On-Demand	Anodyne	CYP2J2	47	35
O=C(NC1CC1)c1ccc(NC[C@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931836	FG	On-Demand	Anodyne	ADRB3	21	44
O=C(NC1CC1)c1ccc(NC[C@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931836	FG	On-Demand	Anodyne	MAPK11	19	40
O=C(NC1CC1)c1ccc(NC[C@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931836	FG	On-Demand	Anodyne	MAPK14	28	40
O=C(NC1CC1)c1ccc(NC[C@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931836	FG	On-Demand	Anodyne	MAPK13	42	34
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931837	FG	On-Demand	Anodyne	ADRB3	21	44
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931837	FG	On-Demand	Anodyne	MAPK11	19	40
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931837	FG	On-Demand	Anodyne	MAPK14	28	40
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2ccc(Cl)c(Cl)c2)nc1	ZINC000853931837	FG	On-Demand	Anodyne	MAPK13	42	34
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)COc2ccccc2)C1	ZINC000853931970	GE	On-Demand	Anodyne	CPT1A	97	41
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)COc2ccccc2)C1	ZINC000853931970	GE	On-Demand	Anodyne	CPT2	40	34
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)COc2ccccc2)C1	ZINC000853931972	GE	On-Demand	Anodyne	CPT1A	97	41
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)COc2ccccc2)C1	ZINC000853931972	GE	On-Demand	Anodyne	CPT2	40	34
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2cccc(F)c2F)C1	ZINC000853932025	FF	On-Demand	Anodyne	GPR119	24	49
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2cccc(F)c2F)C1	ZINC000853932026	FF	On-Demand	Anodyne	GPR119	24	49
CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)/C=C\c1ccc(C(N)=O)o1	ZINC000853932057	GH	On-Demand	Anodyne	SOAT1	44	39
CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)/C=C/c1ccc(C(N)=O)o1	ZINC000853932058	GH	On-Demand	Anodyne	SOAT1	44	39
Cc1ccc(C(=O)COC(=O)[C@@H]2COCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000853932063	GF	On-Demand	Anodyne	GPR119	23	43
Cc1ccc(C(=O)COC(=O)[C@H]2COCCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000853932064	GF	On-Demand	Anodyne	GPR119	23	43
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(F)cc2C#N)C1	ZINC000853932219	GF	On-Demand	Mild	GPR119	26	42
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(F)cc2C#N)C1	ZINC000853932220	GF	On-Demand	Mild	GPR119	26	42
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(F)cc2F)C1	ZINC000853932283	FF	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(F)cc2F)C1	ZINC000853932284	FF	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(F)c(C#N)c2)C1	ZINC000853932323	GF	On-Demand	Mild	GPR119	31	40
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(F)c(C#N)c2)C1	ZINC000853932324	GF	On-Demand	Mild	GPR119	31	40
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@@H](Oc2ccccc2)C1)C1CC1	ZINC000853932371	GG	On-Demand	Anodyne	REN	48	35
CC(C)(C)OC(=O)N[C@@H](CNC(=O)N1CC[C@@H](Oc2ccccc2)C1)C1CC1	ZINC000853932371	GG	On-Demand	Anodyne	EPHX2	17	42
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2cc(F)ccc2C#N)C1	ZINC000853932395	GF	On-Demand	Mild	GPR119	26	40
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2cc(F)ccc2C#N)C1	ZINC000853932396	GF	On-Demand	Mild	GPR119	26	40
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ncc(C#N)cn2)C1	ZINC000853932432	FD	On-Demand	Mild	GPR119	30	45
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ncc(C#N)cn2)C1	ZINC000853932433	FD	On-Demand	Mild	GPR119	30	45
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853932484	GF	On-Demand	Bother	GPR119	22	40
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853932485	GF	On-Demand	Bother	GPR119	22	40
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2cccc3nsnc23)C1	ZINC000853932494	GF	On-Demand	Anodyne	LIPA	40	34
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2cccc3nsnc23)C1	ZINC000853932495	GF	On-Demand	Anodyne	LIPA	40	34
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2c(F)cccc2[N+](=O)[O-])C1	ZINC000853932623	GF	On-Demand	Bother	GPR119	20	40
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2c(F)cccc2[N+](=O)[O-])C1	ZINC000853932624	GF	On-Demand	Bother	GPR119	20	40
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932668	GF	On-Demand	Anodyne	PGC	53	36
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932668	GF	On-Demand	Anodyne	PAPA1_CARPA	40	44
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932668	GF	On-Demand	Anodyne	CCKAR	42	38
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932668	GF	On-Demand	Anodyne	TACR3	15	41
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932668	GF	On-Demand	Anodyne	REN	72	43
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932668	GF	On-Demand	Anodyne	FPR1	51	42
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932669	GF	On-Demand	Anodyne	PGC	53	36
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932669	GF	On-Demand	Anodyne	PAPA1_CARPA	40	44
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932669	GF	On-Demand	Anodyne	CCKAR	42	38
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932669	GF	On-Demand	Anodyne	TACR3	15	41
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932669	GF	On-Demand	Anodyne	REN	72	43
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@@H](CO)Cc1ccccc1	ZINC000853932669	GF	On-Demand	Anodyne	FPR1	51	42
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932670	GF	On-Demand	Anodyne	PGC	53	36
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932670	GF	On-Demand	Anodyne	PAPA1_CARPA	40	44
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932670	GF	On-Demand	Anodyne	CCKAR	42	38
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932670	GF	On-Demand	Anodyne	TACR3	15	41
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932670	GF	On-Demand	Anodyne	REN	72	43
CN(C(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932670	GF	On-Demand	Anodyne	FPR1	51	42
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932671	GF	On-Demand	Anodyne	PGC	53	36
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932671	GF	On-Demand	Anodyne	PAPA1_CARPA	40	44
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932671	GF	On-Demand	Anodyne	CCKAR	42	38
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932671	GF	On-Demand	Anodyne	TACR3	15	41
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932671	GF	On-Demand	Anodyne	REN	72	43
CN(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1)[C@H](CO)Cc1ccccc1	ZINC000853932671	GF	On-Demand	Anodyne	FPR1	51	42
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccncc2C#N)C1	ZINC000853932726	FD	On-Demand	Mild	GPR119	38	57
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccncc2C#N)C1	ZINC000853932727	FD	On-Demand	Mild	GPR119	38	57
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2cnc(Cl)cn2)C1	ZINC000853932743	FE	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2cnc(Cl)cn2)C1	ZINC000853932744	FE	On-Demand	Anodyne	GPR119	38	40
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCCc2ccc3c(c2)CCO3)C1	ZINC000853932747	GF	On-Demand	Anodyne	GPR119	16	41
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCCc2ccc3c(c2)CCO3)C1	ZINC000853932748	GF	On-Demand	Anodyne	GPR119	16	41
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(C#N)c(F)c2)C1	ZINC000853932798	GF	On-Demand	Mild	GPR119	30	40
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(C#N)c(F)c2)C1	ZINC000853932799	GF	On-Demand	Mild	GPR119	30	40
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(OCC#N)cc2)C1	ZINC000853932810	GF	On-Demand	Mild	GPR119	25	46
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(OCC#N)cc2)C1	ZINC000853932811	GF	On-Demand	Mild	GPR119	25	46
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(F)cn2)C1	ZINC000853932925	FE	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(F)cn2)C1	ZINC000853932926	FE	On-Demand	Anodyne	GPR119	39	43
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccncc2)C1	ZINC000853932948	EE	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccncc2)C1	ZINC000853932949	EE	On-Demand	Anodyne	GPR119	35	47
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCC(=O)c2cnccn2)C1	ZINC000853933026	FD	On-Demand	Anodyne	GPR119	21	44
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCC(=O)c2cnccn2)C1	ZINC000853933027	FD	On-Demand	Anodyne	GPR119	21	44
CC(C)(C)OC(=O)N1CCOC[C@H](C(=O)OCc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000853933049	GF	On-Demand	Bother	GPR119	19	40
CC(C)(C)OC(=O)N1CCOC[C@@H](C(=O)OCc2ccc(F)cc2[N+](=O)[O-])C1	ZINC000853933050	GF	On-Demand	Bother	GPR119	19	40
CC[C@@H](O)CNC(=O)NC[C@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000853933193	DD	On-Demand	Anodyne	CTSK	15	40
CC[C@@H](O)CNC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000853933194	DD	On-Demand	Anodyne	CTSK	15	40
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	CHRM2	15	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	DRD2	19	52
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	DRD4	49	52
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	ACHE	30	44
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	DRD3	16	51
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	CHRM3	20	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	SIGMAR1	42	47
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	CCR3	32	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	UTS2R	22	40
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	CCR2	16	40
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	MCHR1	29	48
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933208	GG	On-Demand	Anodyne	BIRC2	41	45
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	CHRM2	15	43
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	DRD2	19	52
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	DRD4	49	52
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	ACHE	30	44
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	DRD3	16	51
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	CHRM3	20	43
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	SIGMAR1	42	47
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	CCR3	32	43
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	UTS2R	22	40
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	CCR2	16	40
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	MCHR1	29	48
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933209	GG	On-Demand	Anodyne	BIRC2	41	45
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	CHRM2	15	43
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	DRD2	19	52
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	DRD4	49	52
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	ACHE	30	44
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	DRD3	16	51
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	CHRM3	20	43
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	SIGMAR1	42	47
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	CCR3	32	43
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	UTS2R	22	40
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	CCR2	16	40
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	MCHR1	29	48
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853933210	GG	On-Demand	Anodyne	BIRC2	41	45
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	CHRM2	15	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	DRD2	19	52
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	DRD4	49	52
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	ACHE	30	44
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	DRD3	16	51
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	CHRM3	20	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	SIGMAR1	42	47
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	CCR3	32	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	UTS2R	22	40
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	CCR2	16	40
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	MCHR1	29	48
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853933211	GG	On-Demand	Anodyne	BIRC2	41	45
COC[C@H](NC(=O)NCc1ccn(C)n1)c1cccc(OC)c1	ZINC000853933350	DD	On-Demand	Anodyne	DRD4	41	32
COC[C@@H](NC(=O)NCc1ccn(C)n1)c1cccc(OC)c1	ZINC000853933351	DD	On-Demand	Anodyne	DRD4	41	32
O=C(OCCCn1ccnc1)c1ccsc1Cl	ZINC000853933398	CF	On-Demand	Anodyne	TBXAS1	65	48
O=C(OCCCn1ccnc1)c1ccsc1Cl	ZINC000853933398	CF	On-Demand	Anodyne	HMOX1	24	42
O=C(OCCCn1ccnc1)c1ccsc1Cl	ZINC000853933398	CF	On-Demand	Anodyne	HMOX2	54	42
O=C(OCCCn1ccnc1)c1ccsc1Cl	ZINC000853933398	CF	On-Demand	Anodyne	QPCT	41	39
O=S(=O)(c1cc(F)ccc1N1CC[C@@H]2COC[C@H]2C1)C(F)(F)F	ZINC000853933441	FF	On-Demand	Anodyne	HSD11B1	15	41
O=S(=O)(c1cc(F)ccc1N1CC[C@H]2COC[C@@H]2C1)C(F)(F)F	ZINC000853933443	FF	On-Demand	Anodyne	HSD11B1	15	41
O=S(=O)(c1cc(F)ccc1N1CC[C@H]2COC[C@H]2C1)C(F)(F)F	ZINC000853933445	FF	On-Demand	Anodyne	HSD11B1	15	41
O=S(=O)(c1cc(F)ccc1N1CC[C@@H]2COC[C@@H]2C1)C(F)(F)F	ZINC000853933447	FF	On-Demand	Anodyne	HSD11B1	15	41
CS(=O)(=O)N1CC[C@@H](COC(=O)c2ccsc2Cl)C1	ZINC000853933487	DD	On-Demand	Anodyne	HTR4	45	38
CS(=O)(=O)N1CC[C@H](COC(=O)c2ccsc2Cl)C1	ZINC000853933492	DD	On-Demand	Anodyne	HTR4	45	38
O=C(OCC(=O)N1CCC(OCc2ccccc2)CC1)c1ccsc1Cl	ZINC000853933511	GH	On-Demand	Anodyne	GRIN2B	22	43
O=C(OCCCN1CCOCC1)c1ccsc1Cl	ZINC000853933543	CE	On-Demand	Anodyne	HTR4	48	47
O=C(OCCCN1CCOCC1)c1ccsc1Cl	ZINC000853933543	CE	On-Demand	Anodyne	EPHX2	22	46
O=C(OCCN1C[C@@H]2CC[C@H](C1)O2)c1ccsc1Cl	ZINC000853933576	DE	On-Demand	Anodyne	HTR4	44	43
CCN1CC[C@@H](N(CC)C(=O)NCc2ccn(C)n2)C1	ZINC000853933595	CD	On-Demand	Anodyne	CCR5	23	50
CCN1CC[C@H](N(CC)C(=O)NCc2ccn(C)n2)C1	ZINC000853933596	CD	On-Demand	Anodyne	CCR5	23	50
COCCOc1ccc(CNC(=O)COC(=O)c2ccsc2Cl)cc1	ZINC000853933697	GF	On-Demand	Anodyne	CA9	18	41
COc1cccc(C2(NC(=O)NCc3ccn(C)n3)CCC2)c1	ZINC000853933727	DE	On-Demand	Anodyne	DRD4	43	33
C#CCNC(=O)c1ccc(N2CC[C@H]3COC[C@@H]3C2)nc1	ZINC000853933736	CC	On-Demand	Mild	HPGDS	18	41
C#CCNC(=O)c1ccc(N2CC[C@@H]3COC[C@@H]3C2)nc1	ZINC000853933738	CC	On-Demand	Mild	HPGDS	18	41
C#CCNC(=O)c1ccc(N2CC[C@H]3COC[C@H]3C2)nc1	ZINC000853933741	CC	On-Demand	Mild	HPGDS	18	41
C#CCNC(=O)c1ccc(N2CC[C@@H]3COC[C@H]3C2)nc1	ZINC000853933743	CC	On-Demand	Mild	HPGDS	18	41
O=C(OCCN1CCOCC1)c1ccsc1Cl	ZINC000853933748	CD	On-Demand	Anodyne	HTR4	51	55
O=C(OCCN1CCOCC1)c1ccsc1Cl	ZINC000853933748	CD	On-Demand	Anodyne	EPHX2	20	40
O=C(OCC[C@H]1CCOC1=O)c1ccsc1Cl	ZINC000853933771	CF	On-Demand	Anodyne	TRAR	40	34
O=C(OCC[C@@H]1CCOC1=O)c1ccsc1Cl	ZINC000853933772	CF	On-Demand	Anodyne	TRAR	40	34
Cn1nc(C(C)(C)C)cc1NC(=O)COC(=O)c1ccsc1Cl	ZINC000853933780	FG	On-Demand	Anodyne	MAPK14	16	45
c1ccc2c(N3CC[C@@H]4COC[C@@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933781	EG	On-Demand	Anodyne	PIK3CA	35	42
c1ccc2c(N3CC[C@@H]4COC[C@@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933781	EG	On-Demand	Anodyne	MTOR	51	37
c1ccc2c(N3CC[C@@H]4COC[C@@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933781	EG	On-Demand	Anodyne	PIK3CG	17	42
c1ccc2c(N3CC[C@H]4COC[C@@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933782	EG	On-Demand	Anodyne	PIK3CA	35	42
c1ccc2c(N3CC[C@H]4COC[C@@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933782	EG	On-Demand	Anodyne	MTOR	51	37
c1ccc2c(N3CC[C@H]4COC[C@@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933782	EG	On-Demand	Anodyne	PIK3CG	17	42
c1ccc2c(N3CC[C@@H]4COC[C@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933783	EG	On-Demand	Anodyne	PIK3CA	35	42
c1ccc2c(N3CC[C@@H]4COC[C@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933783	EG	On-Demand	Anodyne	MTOR	51	37
c1ccc2c(N3CC[C@@H]4COC[C@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933783	EG	On-Demand	Anodyne	PIK3CG	17	42
c1ccc2c(N3CC[C@H]4COC[C@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933784	EG	On-Demand	Anodyne	PIK3CA	35	42
c1ccc2c(N3CC[C@H]4COC[C@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933784	EG	On-Demand	Anodyne	MTOR	51	37
c1ccc2c(N3CC[C@H]4COC[C@H]4C3)nc(-c3ccncc3)nc2c1	ZINC000853933784	EG	On-Demand	Anodyne	PIK3CG	17	42
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCc1ccn(C)n1	ZINC000853933795	FH	On-Demand	Anodyne	MME	41	36
c1cncc(-c2nc(N3CC[C@@H]4COC[C@@H]4C3)c3ccccc3n2)c1	ZINC000853933862	EG	On-Demand	Anodyne	PIK3CA	27	43
c1cncc(-c2nc(N3CC[C@H]4COC[C@@H]4C3)c3ccccc3n2)c1	ZINC000853933863	EG	On-Demand	Anodyne	PIK3CA	27	43
c1cncc(-c2nc(N3CC[C@@H]4COC[C@H]4C3)c3ccccc3n2)c1	ZINC000853933864	EG	On-Demand	Anodyne	PIK3CA	27	43
c1cncc(-c2nc(N3CC[C@H]4COC[C@H]4C3)c3ccccc3n2)c1	ZINC000853933865	EG	On-Demand	Anodyne	PIK3CA	27	43
C[C@H](OC(=O)c1cccnc1Sc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853933873	IK	On-Demand	Anodyne	PRNP	52	38
O=C(OCCN1CCCCC1)c1ccsc1Cl	ZINC000853933974	CG	On-Demand	Anodyne	SLC6A1	54	35
O=C(OCCN1CCCCC1)c1ccsc1Cl	ZINC000853933974	CG	On-Demand	Anodyne	HTR4	59	53
O=C(OCCN1CCCCC1)c1ccsc1Cl	ZINC000853933974	CG	On-Demand	Anodyne	HRH3	30	42
O=C(OCCN1CCCCC1)c1ccsc1Cl	ZINC000853933974	CG	On-Demand	Anodyne	PSMB1	42	37
NC(=O)c1cc(N2CC[C@@H]3COC[C@H]3C2)ccn1	ZINC000853934085	BC	On-Demand	Anodyne	CHRNA3	43	35
NC(=O)c1cc(N2CC[C@H]3COC[C@@H]3C2)ccn1	ZINC000853934086	BC	On-Demand	Anodyne	CHRNA3	43	35
NC(=O)c1cc(N2CC[C@H]3COC[C@H]3C2)ccn1	ZINC000853934088	BC	On-Demand	Anodyne	CHRNA3	43	35
NC(=O)c1cc(N2CC[C@@H]3COC[C@@H]3C2)ccn1	ZINC000853934090	BC	On-Demand	Anodyne	CHRNA3	43	35
O=C(COC(=O)c1ccsc1Cl)NCCOc1ccc2c(c1)OCO2	ZINC000853934120	GE	On-Demand	Anodyne	BMP1	42	34
O=C(COC(=O)c1ccsc1Cl)NCCCN1CCCCCC1=O	ZINC000853934121	FE	On-Demand	Anodyne	TYRO3	19	40
O=C(OCCCN1CCCCC1)c1ccsc1Cl	ZINC000853934303	CG	On-Demand	Anodyne	HTR4	54	55
O=C(OCCCN1CCCCC1)c1ccsc1Cl	ZINC000853934303	CG	On-Demand	Anodyne	HRH3	67	44
CC(C)(C)C(=O)N1CCC(COC(=O)c2ccsc2Cl)CC1	ZINC000853934310	EH	On-Demand	Anodyne	HTR4	41	43
CON(C)CCNC(=O)NCC(C)(C)C1CCCCC1	ZINC000853934349	CE	On-Demand	Anodyne	AMY2	47	33
CCCOc1cccc(CNC(=O)COC(=O)c2ccsc2Cl)c1	ZINC000853934353	FH	On-Demand	Anodyne	MTNR1A	28	42
CCCOc1cccc(CNC(=O)COC(=O)c2ccsc2Cl)c1	ZINC000853934353	FH	On-Demand	Anodyne	PDS	64	37
O=C(OCCCN1CCCC1)c1ccsc1Cl	ZINC000853934385	CG	On-Demand	Anodyne	HTR4	56	53
O=C(OCCCN1CCCC1)c1ccsc1Cl	ZINC000853934385	CG	On-Demand	Anodyne	HRH3	59	43
O=C(OCCCN1CCCC1)c1ccsc1Cl	ZINC000853934385	CG	On-Demand	Anodyne	SIGMAR1	18	40
O=C(COC(=O)c1ccsc1Cl)NC1CCCCCC1	ZINC000853934427	DG	On-Demand	Anodyne	EPHX2	15	44
O=C(COC(=O)c1ccsc1Cl)NC12CC3CC(CC(C3)C1)C2	ZINC000853934447	FH	On-Demand	Anodyne	EPHX2	88	40
CCOC(=O)C1CCN(C(=O)COC(=O)c2ccsc2Cl)CC1	ZINC000853934477	FE	On-Demand	Anodyne	PTR1	43	32
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000853934481	GH	On-Demand	Anodyne	KCNQ2	22	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@H](C)c1ccc2c(c1)OCCO2	ZINC000853934482	GH	On-Demand	Anodyne	KCNQ2	22	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N[C@@H](C)c1ccc2c(c1)OCCO2	ZINC000853934483	GH	On-Demand	Anodyne	KCNQ2	22	43
C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccsc1Cl)c1ccc2c(c1)OCCO2	ZINC000853934486	GH	On-Demand	Anodyne	KCNQ2	22	43
O=C(COC(=O)c1ccsc1Cl)NCC1(c2ccccc2)CC1	ZINC000853934488	EG	On-Demand	Anodyne	KCNA3	47	39
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2ccn(C)n2)cc1	ZINC000853934514	FC	On-Demand	Anodyne	ADRB2	36	52
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2ccn(C)n2)cc1	ZINC000853934514	FC	On-Demand	Anodyne	ADRB1	72	52
COCCc1ccc(OC[C@@H](O)CNC(=O)NCc2ccn(C)n2)cc1	ZINC000853934514	FC	On-Demand	Anodyne	ADRB3	45	41
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2ccn(C)n2)cc1	ZINC000853934515	FC	On-Demand	Anodyne	ADRB2	36	52
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2ccn(C)n2)cc1	ZINC000853934515	FC	On-Demand	Anodyne	ADRB1	72	52
COCCc1ccc(OC[C@H](O)CNC(=O)NCc2ccn(C)n2)cc1	ZINC000853934515	FC	On-Demand	Anodyne	ADRB3	45	41
c1cc(N2CCCC2)nc(N2CC[C@@H]3COC[C@H]3C2)n1	ZINC000853934593	CD	On-Demand	Anodyne	SORD	75	36
c1cc(N2CCCC2)nc(N2CC[C@@H]3COC[C@@H]3C2)n1	ZINC000853934594	CD	On-Demand	Anodyne	SORD	75	36
c1cc(N2CCCC2)nc(N2CC[C@H]3COC[C@H]3C2)n1	ZINC000853934595	CD	On-Demand	Anodyne	SORD	75	36
c1cc(N2CCCC2)nc(N2CC[C@H]3COC[C@@H]3C2)n1	ZINC000853934596	CD	On-Demand	Anodyne	SORD	75	36
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	ALOX5	15	46
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	ACHE	15	46
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	HRH2	26	40
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	MAOB	46	40
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	LTA4H	24	41
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	PTGER3	40	33
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	MTNR1A	63	45
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	MTNR1B	53	45
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	FAAH	16	41
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	FFAR1	39	46
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	ABCG2	19	41
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	CRTM	54	38
CON(C)CCNC(=O)NCCc1cccc(OCc2ccccc2)c1	ZINC000853934607	FF	On-Demand	Anodyne	PDS	63	38
CC(=O)c1ccc(N2CC[C@@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000853934616	CE	On-Demand	Bother	TAAR1	20	47
CC(=O)c1ccc(N2CC[C@@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000853934617	CE	On-Demand	Bother	TAAR1	20	47
CC(=O)c1ccc(N2CC[C@H]3COC[C@H]3C2)c([N+](=O)[O-])c1	ZINC000853934619	CE	On-Demand	Bother	TAAR1	20	47
CC(=O)c1ccc(N2CC[C@H]3COC[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000853934622	CE	On-Demand	Bother	TAAR1	20	47
O=C(COC(=O)c1ccsc1Cl)NCC1(c2ccccc2)CCOCC1	ZINC000853934648	GG	On-Demand	Anodyne	KCNA3	44	39
O=C(COC(=O)c1ccsc1Cl)Nc1ccc(CN2CCOCC2)cc1	ZINC000853934682	GG	On-Demand	Anodyne	EPHX2	18	45
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@H]3C2)cc1	ZINC000853934698	BE	On-Demand	Bother	CHRNA3	15	42
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@H]3C2)cc1	ZINC000853934698	BE	On-Demand	Bother	KCNJ1	20	40
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@@H]3C2)cc1	ZINC000853934699	BE	On-Demand	Bother	CHRNA3	15	42
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@@H]3C2)cc1	ZINC000853934699	BE	On-Demand	Bother	KCNJ1	20	40
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@@H]3C2)cc1	ZINC000853934700	BE	On-Demand	Bother	CHRNA3	15	42
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@@H]3C2)cc1	ZINC000853934700	BE	On-Demand	Bother	KCNJ1	20	40
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@H]3C2)cc1	ZINC000853934701	BE	On-Demand	Bother	CHRNA3	15	42
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@H]3C2)cc1	ZINC000853934701	BE	On-Demand	Bother	KCNJ1	20	40
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@@H]3C2)c2nonc12	ZINC000853934719	CD	On-Demand	Bother	GSTM2	112	41
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@@H]3C2)c2nonc12	ZINC000853934719	CD	On-Demand	Bother	GSTP1	68	41
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@H]3C2)c2nonc12	ZINC000853934721	CD	On-Demand	Bother	GSTM2	112	41
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@H]3C2)c2nonc12	ZINC000853934721	CD	On-Demand	Bother	GSTP1	68	41
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@@H]3C2)c2nonc12	ZINC000853934723	CD	On-Demand	Bother	GSTM2	112	41
O=[N+]([O-])c1ccc(N2CC[C@H]3COC[C@@H]3C2)c2nonc12	ZINC000853934723	CD	On-Demand	Bother	GSTP1	68	41
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@H]3C2)c2nonc12	ZINC000853934725	CD	On-Demand	Bother	GSTM2	112	41
O=[N+]([O-])c1ccc(N2CC[C@@H]3COC[C@H]3C2)c2nonc12	ZINC000853934725	CD	On-Demand	Bother	GSTP1	68	41
O=C(OCc1noc(C2CC2)n1)c1ccsc1Cl	ZINC000853934737	CG	On-Demand	Anodyne	ETHR	44	37
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N1CCCCCC1	ZINC000853934764	DG	On-Demand	Anodyne	DPP7	59	38
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N1CCCCCC1	ZINC000853934766	DG	On-Demand	Anodyne	DPP7	59	38
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853934784	FF	On-Demand	Anodyne	FKBP1A	59	39
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853934784	FF	On-Demand	Anodyne	CPT1A	44	38
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853934784	FF	On-Demand	Anodyne	CPT2	43	38
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853934827	GG	On-Demand	Anodyne	MC4R	54	39
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853934829	GG	On-Demand	Anodyne	MC4R	54	39
Cn1c(S)nnc1CCNC(=O)NCC1(c2ccc(F)cc2Cl)CC1	ZINC000853934860	GE	On-Demand	Anodyne	P2RX7	42	36
Fc1cccc2oc(N3CC[C@@H]4COC[C@H]4C3)nc12	ZINC000853934929	CE	On-Demand	Anodyne	HTR3A	21	42
Fc1cccc2oc(N3CC[C@H]4COC[C@@H]4C3)nc12	ZINC000853934930	CE	On-Demand	Anodyne	HTR3A	21	42
Fc1cccc2oc(N3CC[C@H]4COC[C@H]4C3)nc12	ZINC000853934931	CE	On-Demand	Anodyne	HTR3A	21	42
Fc1cccc2oc(N3CC[C@@H]4COC[C@@H]4C3)nc12	ZINC000853934932	CE	On-Demand	Anodyne	HTR3A	21	42
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)NC1CCCCC1	ZINC000853935070	DG	On-Demand	Anodyne	EPHX2	17	40
C[C@H](OC(=O)c1ccsc1Cl)C(=O)NC1CCCCC1	ZINC000853935072	DG	On-Demand	Anodyne	EPHX2	17	40
CCCOc1ccc(COC(=O)c2nccnc2C)cc1	ZINC000853935073	CF	On-Demand	Anodyne	PLA2G4B	62	36
CC(=O)c1cccc(NC(=O)[C@@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935088	GI	On-Demand	Anodyne	KCNK3	56	33
CC(=O)c1cccc(NC(=O)[C@@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935088	GI	On-Demand	Anodyne	KCNK9	48	32
CC(=O)c1cccc(NC(=O)[C@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935090	GI	On-Demand	Anodyne	KCNK3	56	33
CC(=O)c1cccc(NC(=O)[C@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935090	GI	On-Demand	Anodyne	KCNK9	48	32
CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1ccsc1Cl	ZINC000853935205	GK	On-Demand	Anodyne	SOAT1	53	41
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)NC(=O)NC1CCCCC1	ZINC000853935280	FG	On-Demand	Anodyne	EPHX2	20	42
C[C@H](OC(=O)c1ccsc1Cl)C(=O)NC(=O)NC1CCCCC1	ZINC000853935283	FG	On-Demand	Anodyne	EPHX2	20	42
O=C(COC(=O)c1ccsc1Cl)Nc1ccc(N2CCCCC2)nc1	ZINC000853935330	GH	On-Demand	Anodyne	DGAT1	31	40
CCCOc1cccc(CNC(=O)COC(=O)c2nccnc2C)c1	ZINC000853935378	EE	On-Demand	Anodyne	HRH2	26	42
CCCOc1cccc(CNC(=O)COC(=O)c2nccnc2C)c1	ZINC000853935378	EE	On-Demand	Anodyne	ROCK1	19	40
CCCOc1cccc(CNC(=O)COC(=O)c2nccnc2C)c1	ZINC000853935378	EE	On-Demand	Anodyne	MTNR1A	35	42
CCCOc1cccc(CNC(=O)COC(=O)c2nccnc2C)c1	ZINC000853935378	EE	On-Demand	Anodyne	PDS	56	38
COc1ccccc1N1CC[C@H](OC(=O)c2nccnc2C)C1=O	ZINC000853935394	ED	On-Demand	Anodyne	HTR1A	43	39
COc1ccccc1N1CC[C@@H](OC(=O)c2nccnc2C)C1=O	ZINC000853935395	ED	On-Demand	Anodyne	HTR1A	43	39
C[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935561	DF	On-Demand	Anodyne	CPT1A	64	39
C[C@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935563	DF	On-Demand	Anodyne	CPT1A	64	39
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N1CCCCC1	ZINC000853935605	DF	On-Demand	Anodyne	DPP7	59	38
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N1CCCCC1	ZINC000853935606	DF	On-Demand	Anodyne	DPP7	59	38
CCOC(=O)N1CCC(NC(=O)COC(=O)c2ccsc2Cl)CC1	ZINC000853935624	FE	On-Demand	Anodyne	CCR8	44	45
O=C(O[C@@H]1CCOC1=O)c1ccsc1Cl	ZINC000853935671	BD	On-Demand	Anodyne	TRAR	57	36
CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935678	GI	On-Demand	Anodyne	KCNK3	52	34
CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935678	GI	On-Demand	Anodyne	KCNK9	53	34
CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935679	GI	On-Demand	Anodyne	KCNK3	52	34
CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)c2ccsc2Cl)C(C)C)c1	ZINC000853935679	GI	On-Demand	Anodyne	KCNK9	53	34
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)c2ccsc2Cl)C1	ZINC000853935687	FE	On-Demand	Anodyne	FDFT1	19	41
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935691	ED	On-Demand	Anodyne	CPT1A	54	40
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935691	ED	On-Demand	Anodyne	CPT2	48	40
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935691	ED	On-Demand	Anodyne	PREP	42	34
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935692	ED	On-Demand	Anodyne	CPT1A	54	40
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935692	ED	On-Demand	Anodyne	CPT2	48	40
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853935692	ED	On-Demand	Anodyne	PREP	42	34
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)c2ccsc2Cl)C1	ZINC000853935704	FF	On-Demand	Anodyne	DPP7	45	34
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)c2ccsc2Cl)C1	ZINC000853935707	FF	On-Demand	Anodyne	DPP7	45	34
COc1cccc(OCCOC(=O)c2nccnc2C)c1	ZINC000853935711	CE	On-Demand	Anodyne	MTNR1A	53	51
COc1cccc(OCCOC(=O)c2nccnc2C)c1	ZINC000853935711	CE	On-Demand	Anodyne	MTNR1B	53	51
COCCOc1ccc(CNC(=O)COC(=O)c2nccnc2C)cc1	ZINC000853935753	FD	On-Demand	Anodyne	CA9	18	42
COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1ccsc1Cl)CC2	ZINC000853935853	GG	On-Demand	Anodyne	ABCB1	22	50
O=C(OCC(=O)N1CCN(c2ccc(F)cc2)CC1)c1ccsc1Cl	ZINC000853935888	GG	On-Demand	Anodyne	CCR1	17	42
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853935889	GI	On-Demand	Mild	VIPR1	30	47
C[C@H](OC(=O)c1ccsc1Cl)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853935890	GI	On-Demand	Mild	VIPR1	30	47
Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)c1ccsc1Cl	ZINC000853935905	EH	On-Demand	Anodyne	AMP1_PLAFQ	17	43
Cc1ccccc1CNC(=O)[C@H](C)OC(=O)c1ccsc1Cl	ZINC000853935907	EH	On-Demand	Anodyne	AMP1_PLAFQ	17	43
O=C(COC(=O)c1ccsc1Cl)NC(=O)NC1CCCCC1	ZINC000853935911	EF	On-Demand	Anodyne	EPHX2	23	40
COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853935945	DD	On-Demand	Anodyne	PPARA	16	40
COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853935945	DD	On-Demand	Anodyne	MME	49	39
COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853935945	DD	On-Demand	Anodyne	CAPN2	53	31
COC(=O)[C@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853935947	DD	On-Demand	Anodyne	PPARA	16	40
COC(=O)[C@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853935947	DD	On-Demand	Anodyne	MME	49	39
COC(=O)[C@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853935947	DD	On-Demand	Anodyne	CAPN2	53	31
CN1CCCC[C@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935978	CG	On-Demand	Anodyne	HRH1	23	42
CN1CCCC[C@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935978	CG	On-Demand	Anodyne	HTR4	41	38
CN1CCCC[C@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935978	CG	On-Demand	Anodyne	CHRNA10	59	39
CN1CCCC[C@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935978	CG	On-Demand	Anodyne	ACKR3	63	32
CN1CCCC[C@@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935980	CG	On-Demand	Anodyne	HRH1	23	42
CN1CCCC[C@@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935980	CG	On-Demand	Anodyne	HTR4	41	38
CN1CCCC[C@@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935980	CG	On-Demand	Anodyne	CHRNA10	59	39
CN1CCCC[C@@H]1CCOC(=O)c1ccsc1Cl	ZINC000853935980	CG	On-Demand	Anodyne	ACKR3	63	32
CC(=O)Nc1ccc(S(=O)(=O)CCCOC(=O)c2nccnc2C)cc1	ZINC000853936061	GD	On-Demand	Anodyne	CA2	17	43
CC(=O)Nc1ccc(S(=O)(=O)CCCOC(=O)c2nccnc2C)cc1	ZINC000853936061	GD	On-Demand	Anodyne	CA12	15	43
CC(=O)Nc1ccc(S(=O)(=O)CCCOC(=O)c2nccnc2C)cc1	ZINC000853936061	GD	On-Demand	Anodyne	CA9	15	43
CCCCCCCCOC(=O)c1nccnc1C	ZINC000853936167	CG	On-Demand	Mild	PLA2G4B	79	35
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2ccsc2Cl)CC1	ZINC000853936173	FE	On-Demand	Anodyne	P2RY12	48	38
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2ccsc2Cl)CC1	ZINC000853936175	FE	On-Demand	Anodyne	P2RY12	48	38
O=C(COC(=O)c1ccsc1Cl)Nc1ccc(N2CCOCC2)cc1	ZINC000853936177	GG	On-Demand	Anodyne	STAT6	60	36
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N1CCCc2ccccc21	ZINC000853936191	EH	On-Demand	Anodyne	AVPR2	39	41
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N1CCCc2ccccc21	ZINC000853936192	EH	On-Demand	Anodyne	AVPR2	39	41
O=C(COC(=O)c1ccsc1Cl)NCCCSc1ccccc1	ZINC000853936197	FH	On-Demand	Anodyne	FAS	34	43
CC(C)c1ccccc1NC(=O)COC(=O)c1ccsc1Cl	ZINC000853936201	EI	On-Demand	Anodyne	FAS	47	35
O=C(COC(=O)c1ccsc1Cl)NCCCN1CCCC1=O	ZINC000853936236	ED	On-Demand	Anodyne	TYRO3	20	41
O=C(COC(=O)c1ccsc1Cl)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853936243	GG	On-Demand	Anodyne	EPHX2	101	42
CCN(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)c1ccsc1Cl	ZINC000853936255	FH	On-Demand	Anodyne	PDS	17	41
CCN(Cc1ccccc1)C(=O)[C@H](C)OC(=O)c1ccsc1Cl	ZINC000853936256	FH	On-Demand	Anodyne	PDS	17	41
C[C@H](OC(=O)c1ccsc1Cl)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853936263	FI	On-Demand	Anodyne	EPHX2	73	40
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853936265	FI	On-Demand	Anodyne	EPHX2	73	40
COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccsc2Cl)cc1OC	ZINC000853936279	FH	On-Demand	Anodyne	ENPP1	68	34
COc1ccc(CNC(=O)[C@H](C)OC(=O)c2ccsc2Cl)cc1OC	ZINC000853936287	GG	On-Demand	Anodyne	MT-ND1	19	40
COc1ccc(CNC(=O)[C@H](C)OC(=O)c2ccsc2Cl)cc1OC	ZINC000853936287	GG	On-Demand	Anodyne	DRTS_TRYCR	44	31
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N1CCc2ccccc2C1	ZINC000853936302	EH	On-Demand	Anodyne	DPP8	20	43
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N1CCc2ccccc2C1	ZINC000853936303	EH	On-Demand	Anodyne	DPP8	20	43
Cc1cccc(CNC(=O)COC(=O)c2nccnc2C)c1	ZINC000853936330	CD	On-Demand	Anodyne	ROCK2	17	42
CCOC(=O)[C@@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853936350	DE	On-Demand	Anodyne	PPARA	25	41
CCCCCOC(=O)c1nccnc1C	ZINC000853936414	BE	On-Demand	Anodyne	PLA2G4B	65	33
COC(=O)C1CCN(C(=O)COC(=O)c2ccsc2Cl)CC1	ZINC000853936498	ED	On-Demand	Anodyne	PTR1	49	34
CCC(=O)N1CCc2cc(C(=O)COC(=O)c3ccsc3Cl)ccc21	ZINC000853936506	GH	On-Demand	Anodyne	EIF2AK3	48	34
CC[C@H](OC(=O)c1ccsc1Cl)C(=O)NCc1ccccc1	ZINC000853936530	EH	On-Demand	Anodyne	CAPN2	41	36
CC[C@H](OC(=O)c1ccsc1Cl)C(=O)NCc1ccccc1	ZINC000853936530	EH	On-Demand	Anodyne	PDS	77	42
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)c1ccsc1Cl	ZINC000853936592	GF	On-Demand	Anodyne	SIGMAR1	48	42
O=C(OCC(=O)N1CCN(Cc2ccccc2)CC1)c1ccsc1Cl	ZINC000853936592	GF	On-Demand	Anodyne	FAAH	22	42
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N1CCC[C@H](C(N)=O)C1	ZINC000853936600	ED	On-Demand	Anodyne	DPP7	45	34
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N1CCC[C@@H](C(N)=O)C1	ZINC000853936601	ED	On-Demand	Anodyne	DPP7	45	34
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N1CCC[C@H](C(N)=O)C1	ZINC000853936602	ED	On-Demand	Anodyne	DPP7	45	34
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N1CCC[C@@H](C(N)=O)C1	ZINC000853936603	ED	On-Demand	Anodyne	DPP7	45	34
O=C(COC(=O)c1ccsc1Cl)N[C@@H]1CCOc2ccccc21	ZINC000853936606	FG	On-Demand	Anodyne	LUXR	62	35
O=C(COC(=O)c1ccsc1Cl)N[C@@H]1CCOc2ccccc21	ZINC000853936606	FG	On-Demand	Anodyne	TRAR	78	40
O=C(COC(=O)c1ccsc1Cl)N[C@H]1CCOc2ccccc21	ZINC000853936607	FG	On-Demand	Anodyne	LUXR	62	35
O=C(COC(=O)c1ccsc1Cl)N[C@H]1CCOc2ccccc21	ZINC000853936607	FG	On-Demand	Anodyne	TRAR	78	40
CCCCCCC(=O)COC(=O)c1nccnc1C	ZINC000853936732	CE	On-Demand	Anodyne	PLA2G4B	74	35
CCCCCCC(=O)COC(=O)c1nccnc1C	ZINC000853936732	CE	On-Demand	Anodyne	CQSS	53	34
COc1cccc(OC)c1OCCCCOC(=O)c1nccnc1C	ZINC000853936749	EF	On-Demand	Anodyne	GSG2	15	41
C[C@H](OC(=O)c1ccsc1Cl)C(=O)N(C)Cc1cccc(F)c1	ZINC000853936851	FH	On-Demand	Anodyne	HSD17B2	21	40
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)N(C)Cc1cccc(F)c1	ZINC000853936853	FH	On-Demand	Anodyne	HSD17B2	21	40
O=C(OCc1ccc(S(=O)(=O)N2CCCC2)o1)c1ccsc1Cl	ZINC000853936860	GG	On-Demand	Anodyne	LPL	46	38
COc1cccc(SCCOC(=O)c2nccnc2C)c1	ZINC000853936899	DF	On-Demand	Anodyne	MTNR1A	23	51
COc1cccc(SCCOC(=O)c2nccnc2C)c1	ZINC000853936899	DF	On-Demand	Anodyne	MTNR1B	23	51
CCOc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2ccsc2Cl)cc1	ZINC000853936906	GI	On-Demand	Anodyne	CPT1A	105	39
CC[C@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853936918	DG	On-Demand	Anodyne	CPT1A	49	36
CC[C@@H]1CCCCN1C(=O)COC(=O)c1ccsc1Cl	ZINC000853936919	DG	On-Demand	Anodyne	CPT1A	49	36
CCCCCNC(=O)COC(=O)c1ccsc1Cl	ZINC000853936924	CF	On-Demand	Anodyne	ASAH1	61	33
N#Cc1c(NC(=O)COC(=O)c2ccsc2Cl)sc2c1CCCCC2	ZINC000853936936	GI	On-Demand	Mild	VIPR1	35	55
O=C(COC(=O)c1ccsc1Cl)NCCCc1ccccc1	ZINC000853936941	EG	On-Demand	Anodyne	CRTM	39	43
C[C@@H](OC(=O)c1ccsc1Cl)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853936948	GG	On-Demand	Anodyne	STAT6	52	35
C[C@H](OC(=O)c1ccsc1Cl)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853936949	GG	On-Demand	Anodyne	STAT6	52	35
CCCCCNC(=O)[C@@H](C)OC(=O)c1ccsc1Cl	ZINC000853936974	DG	On-Demand	Anodyne	ASAH1	51	33
CCCCCNC(=O)[C@H](C)OC(=O)c1ccsc1Cl	ZINC000853936975	DG	On-Demand	Anodyne	ASAH1	51	33
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853937041	CD	On-Demand	Anodyne	MME	63	38
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853937041	CD	On-Demand	Anodyne	TIMP3	45	37
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)c1nccnc1C	ZINC000853937041	CD	On-Demand	Anodyne	CAPN2	53	30
Cc1ccccc1CN1CCC(NC(=O)COC(=O)c2nccnc2C)CC1	ZINC000853937083	GE	On-Demand	Anodyne	DRD4	18	51
Cc1ccccc1CN1CCC(NC(=O)COC(=O)c2nccnc2C)CC1	ZINC000853937083	GE	On-Demand	Anodyne	SIGMAR1	18	47
Cc1ccccc1CN1CCC(NC(=O)COC(=O)c2nccnc2C)CC1	ZINC000853937083	GE	On-Demand	Anodyne	SSTR5	53	37
Cc1ccccc1CN1CCC(NC(=O)COC(=O)c2nccnc2C)CC1	ZINC000853937083	GE	On-Demand	Anodyne	MCHR1	26	41
Cc1ccccc1CN1CCC(NC(=O)COC(=O)c2nccnc2C)CC1	ZINC000853937083	GE	On-Demand	Anodyne	CCR8	60	38
COc1ccc([C@@H]2CCCCCN2C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853937174	GG	On-Demand	Anodyne	CPT1A	125	45
Cc1ccc(NC(=O)COC(=O)c2nccnc2C)cc1S(=O)(=O)N(C)C	ZINC000853937181	GD	On-Demand	Anodyne	SMG1	37	42
CC(=O)NCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853937198	FD	On-Demand	Anodyne	SCNN1A	45	36
CC(=O)NCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853937198	FD	On-Demand	Anodyne	MTNR1A	18	40
CC(=O)NCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853937198	FD	On-Demand	Anodyne	MTNR1B	21	40
CCOC(=O)[C@@H]1CCCN(C(=O)[C@@H](C)OC(=O)c2nccnc2C)C1	ZINC000853937205	ED	On-Demand	Anodyne	DPP7	55	33
CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)OC(=O)c2nccnc2C)C1	ZINC000853937207	ED	On-Demand	Anodyne	DPP7	55	33
CCCCCNC(=O)[C@@H](C)OC(=O)c1nccnc1C	ZINC000853937227	CD	On-Demand	Anodyne	ASAH1	59	31
CCCCCNC(=O)[C@H](C)OC(=O)c1nccnc1C	ZINC000853937228	CD	On-Demand	Anodyne	ASAH1	59	31
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853937256	EE	On-Demand	Anodyne	BDKRB1	46	38
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CC[C@H](N2CCOC2=O)C1	ZINC000853937257	EE	On-Demand	Anodyne	BDKRB1	46	38
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CC[C@H](N2CCOC2=O)C1	ZINC000853937258	EE	On-Demand	Anodyne	BDKRB1	46	38
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853937259	EE	On-Demand	Anodyne	BDKRB1	46	38
CCCOc1ccc(OCCOC(=O)c2nccnc2C)cc1	ZINC000853937284	DF	On-Demand	Anodyne	PLA2G4B	69	33
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853937292	EE	On-Demand	Anodyne	BDKRB1	40	34
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000853937293	EE	On-Demand	Anodyne	BDKRB1	40	34
Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1nccnc1C	ZINC000853937297	EG	On-Demand	Anodyne	SOAT1	41	39
CCOC(=O)N1CCN(C(=O)[C@@H](C)OC(=O)c2nccnc2C)CC1	ZINC000853937450	FC	On-Demand	Anodyne	P2RY12	45	36
CCOC(=O)N1CCN(C(=O)[C@H](C)OC(=O)c2nccnc2C)CC1	ZINC000853937451	FC	On-Demand	Anodyne	P2RY12	45	36
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3COc4cc(OC)ccc4C3)C2)cc1	ZINC000853937518	GF	On-Demand	Clean	MTNR1A	20	51
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3COc4cc(OC)ccc4C3)C2)cc1	ZINC000853937518	GF	On-Demand	Clean	MTNR1B	20	51
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3COc4cc(OC)ccc4C3)C2)cc1	ZINC000853937520	GF	On-Demand	Clean	MTNR1A	20	51
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3COc4cc(OC)ccc4C3)C2)cc1	ZINC000853937520	GF	On-Demand	Clean	MTNR1B	20	51
CCCCC[C@@H](C)NC(=O)COC(=O)c1nccnc1C	ZINC000853937545	CE	On-Demand	Anodyne	NOD1	64	34
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1nccnc1C	ZINC000853937558	FD	On-Demand	Bother	KCNMA1	20	47
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1nccnc1C	ZINC000853937560	FD	On-Demand	Bother	KCNMA1	20	47
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)c2nccnc2C)c1	ZINC000853937578	GE	On-Demand	Anodyne	CPT1A	99	42
c1ccc2c(CCNc3nccc(N4CCCC4)n3)nsc2c1	ZINC000853937604	EG	On-Demand	Anodyne	SORD	33	50
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CCn2ncc(Br)c2C1	ZINC000853937633	GG	On-Demand	Anodyne	BDKRB1	45	36
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CCn2ncc(Br)c2C1	ZINC000853937634	GG	On-Demand	Anodyne	BDKRB1	45	36
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853937643	EH	On-Demand	Anodyne	BDKRB1	46	39
O=C(N[C@@H]1CCCc2cc(F)ccc21)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853937644	EH	On-Demand	Anodyne	BDKRB1	46	39
O=C(N[C@@H]1CCCc2cc(F)ccc21)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853937645	EH	On-Demand	Anodyne	BDKRB1	46	39
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853937646	EH	On-Demand	Anodyne	BDKRB1	46	39
O=C1CCC2=C(CCN(C(=O)N[C@H]3CCCc4cc(F)ccc43)C2)N1	ZINC000853937647	EF	On-Demand	Anodyne	BDKRB1	43	36
O=C1CCC2=C(CCN(C(=O)N[C@@H]3CCCc4cc(F)ccc43)C2)N1	ZINC000853937648	EF	On-Demand	Anodyne	BDKRB1	43	36
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853937667	GH	On-Demand	Clean	BDKRB1	60	41
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CCCc2cc(F)ccc21	ZINC000853937668	GH	On-Demand	Clean	BDKRB1	60	41
COCCN(CCF)C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853937670	DF	On-Demand	Anodyne	BDKRB1	53	39
CCOc1ccc(OCCOC(=O)c2nccnc2C)cc1	ZINC000853937703	DE	On-Demand	Anodyne	CACNA2D1	44	38
CCOc1ccc(OCCOC(=O)c2nccnc2C)cc1	ZINC000853937703	DE	On-Demand	Anodyne	PLA2G4B	53	31
COc1ccc(NC(=O)[C@H](C)OC(=O)c2nccnc2C)cc1OC	ZINC000853937731	ED	On-Demand	Anodyne	PDGFRA	40	33
COc1ccc(NC(=O)[C@H](C)OC(=O)c2nccnc2C)cc1OC	ZINC000853937731	ED	On-Demand	Anodyne	ENPP1	76	40
CCOC(=O)N1CCC(NC(=O)COC(=O)c2nccnc2C)CC1	ZINC000853937748	FC	On-Demand	Anodyne	CCR8	28	44
CON(C)CCNC(=O)N[C@@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000853937752	FF	On-Demand	Anodyne	UTS2	42	32
CON(C)CCNC(=O)N[C@H](Cc1ccc(Cl)cc1)c1ccccn1	ZINC000853937753	FF	On-Demand	Anodyne	UTS2	42	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	OPRM1	48	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	OPRD1	44	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	MME	71	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	ANPEP	44	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CMA1	49	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CTRA_BOVIN	50	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	FCER2	61	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CTSB	41	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	PAPA1_CARPA	47	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CYSP_TRYCR	59	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	TPH1	68	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CAPNS1	58	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	HLA-DRB1	66	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CAPN1	72	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CTRC	40	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CAPN2	54	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	ACE2	60	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	MMP1	17	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	CTRB_BOVIN	45	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	PLM2_PLAFA	47	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	BLA1_STEMA	51	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	NPFFR1	47	31
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937764	ED	On-Demand	Anodyne	GPR142	46	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	OPRM1	48	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	OPRD1	44	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	MME	71	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	ANPEP	44	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CMA1	49	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CTRA_BOVIN	50	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	FCER2	61	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CTSB	41	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	PAPA1_CARPA	47	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CYSP_TRYCR	59	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	TPH1	68	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CAPNS1	58	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	HLA-DRB1	66	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CAPN1	72	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CTRC	40	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CAPN2	54	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	ACE2	60	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	MMP1	17	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	CTRB_BOVIN	45	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	PLM2_PLAFA	47	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	BLA1_STEMA	51	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	NPFFR1	47	31
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)c1nccnc1C	ZINC000853937765	ED	On-Demand	Anodyne	GPR142	46	37
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2ccc(F)cc2)o1	ZINC000853937769	FG	On-Demand	Anodyne	LEF	69	40
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2ccc(F)cc2)o1	ZINC000853937771	FG	On-Demand	Anodyne	LEF	69	40
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)o1	ZINC000853937799	FG	On-Demand	Bother	CACNA1C	49	41
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)o1	ZINC000853937799	FG	On-Demand	Bother	CACNA1D	78	35
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)o1	ZINC000853937800	FG	On-Demand	Bother	CACNA1C	49	41
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)o1	ZINC000853937800	FG	On-Demand	Bother	CACNA1D	78	35
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1oc(SC)cc1C	ZINC000853937809	FE	On-Demand	Anodyne	FKBP1A	40	35
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1oc(SC)cc1C	ZINC000853937809	FE	On-Demand	Anodyne	CPT2	40	35
CCC(=O)N1CCc2cc(C(=O)COC(=O)c3nccnc3C)ccc21	ZINC000853937858	FE	On-Demand	Anodyne	EIF2AK3	76	35
CSc1cc(C)c(C(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)o1	ZINC000853937868	GF	On-Demand	Anodyne	STAT6	54	34
CCC[C@H](NC(=O)COC(=O)c1nccnc1C)c1ccccc1	ZINC000853937886	EF	On-Demand	Anodyne	TACR3	23	41
CCOC(=O)C1=C(COC(=O)c2nccnc2C)NC(=O)N[C@H]1c1ccccc1	ZINC000853937894	GD	On-Demand	Anodyne	CACNA1C	49	37
CCOC(=O)C1=C(COC(=O)c2nccnc2C)NC(=O)N[C@H]1c1ccccc1	ZINC000853937894	GD	On-Demand	Anodyne	CACNA1D	36	40
CCOC(=O)C1=C(COC(=O)c2nccnc2C)NC(=O)N[C@H]1c1ccccc1	ZINC000853937894	GD	On-Demand	Anodyne	SLC27A4	78	36
CCOC(=O)C1=C(COC(=O)c2nccnc2C)NC(=O)N[C@@H]1c1ccccc1	ZINC000853937897	GD	On-Demand	Anodyne	CACNA1C	49	37
CCOC(=O)C1=C(COC(=O)c2nccnc2C)NC(=O)N[C@@H]1c1ccccc1	ZINC000853937897	GD	On-Demand	Anodyne	CACNA1D	36	40
CCOC(=O)C1=C(COC(=O)c2nccnc2C)NC(=O)N[C@@H]1c1ccccc1	ZINC000853937897	GD	On-Demand	Anodyne	SLC27A4	78	36
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCc2ccccc2)o1	ZINC000853937912	EG	On-Demand	Anodyne	PDS	55	38
CCOC(=O)C1CCN(C(=O)COC(=O)c2nccnc2C)CC1	ZINC000853937913	EC	On-Demand	Anodyne	PTR1	43	33
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCc2ccccc2)o1	ZINC000853937914	EG	On-Demand	Anodyne	PDS	55	38
CCOc1ccc(-n2c(C)cc(C(=O)COC(=O)c3nccnc3C)c2C)cc1	ZINC000853937923	GH	On-Demand	Clean	CACNA2D1	81	44
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2nccnc2C)c(OC)c1	ZINC000853937928	GE	On-Demand	Anodyne	CPT1A	101	40
CSc1cc(C)c(C(=O)OCC(=O)NC23CC4CC(CC(C4)C2)C3)o1	ZINC000853937938	FH	On-Demand	Anodyne	EPHX2	63	38
C[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1cccc(F)c1F	ZINC000853937950	GF	On-Demand	Anodyne	MAPK1	44	37
CSc1cc(C)c(C(=O)OCC(=O)NCCc2ccc(F)cc2)o1	ZINC000853938060	FF	On-Demand	Anodyne	LEF	42	39
Cc1cc(OCCOC(=O)c2nccnc2C)ccc1C(C)C	ZINC000853938062	DG	On-Demand	Anodyne	PPARD	23	41
CC(=O)c1ccc(NCC2SCCS2)c(I)c1	ZINC000853938070	GH	On-Demand	Anodyne	AKR1C3	15	40
CSc1cc(C)c(C(=O)OCC(=O)NCCCc2ccccc2)o1	ZINC000853938099	EG	On-Demand	Anodyne	MTNR1A	34	42
CSc1cc(C)c(C(=O)OCC(=O)NCCCc2ccccc2)o1	ZINC000853938099	EG	On-Demand	Anodyne	MTNR1B	37	42
CSc1cc(C)c(C(=O)OCC(=O)NCCCc2ccccc2)o1	ZINC000853938099	EG	On-Demand	Anodyne	FAAH	33	41
CSc1cc(C)c(C(=O)OCC(=O)NCCCc2ccccc2)o1	ZINC000853938099	EG	On-Demand	Anodyne	AMP1_PLAFQ	23	40
CSc1cc(C)c(C(=O)OCC(=O)NCCCc2ccccc2)o1	ZINC000853938099	EG	On-Demand	Anodyne	CRTM	41	42
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1oc(SC)cc1C	ZINC000853938110	GG	On-Demand	Bother	KCNMA1	19	45
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1oc(SC)cc1C	ZINC000853938111	GG	On-Demand	Bother	KCNMA1	19	45
c1ccc(-c2nccnc2NCC2SCCS2)cc1	ZINC000853938114	CG	On-Demand	Anodyne	TNK2	15	40
CCOc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938191	FF	On-Demand	Anodyne	CPT1A	111	39
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])o1	ZINC000853938213	FG	On-Demand	Bother	COLA	71	34
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])o1	ZINC000853938214	FG	On-Demand	Bother	COLA	71	34
O=[N+]([O-])c1ccc2nc(NCC3SCCS3)nc(O)c2c1	ZINC000853938223	DE	On-Demand	Bother	VCP	20	41
COc1ccc(-c2ccnc(NCC3SCCS3)n2)cc1	ZINC000853938225	DG	On-Demand	Anodyne	CLK4	29	55
COc1ccc(-c2ccnc(NCC3SCCS3)n2)cc1	ZINC000853938225	DG	On-Demand	Anodyne	DYRK1B	17	57
C#CCCN(CCOC)C(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000853938227	DF	On-Demand	Mild	BDKRB1	40	37
C#CCCN(CCOC)C(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853938228	DF	On-Demand	Mild	BDKRB1	40	37
Fc1ccc2c(c1)[nH]c1ncnc(NCC3SCCS3)c12	ZINC000853938238	DG	On-Demand	Anodyne	TNK2	17	42
CCOc1ccc(-c2nc(COC(=O)c3nccnc3C)cs2)cc1OC	ZINC000853938271	GH	On-Demand	Anodyne	DCK	38	44
CCOc1ccc(-c2nc(COC(=O)c3nccnc3C)cs2)cc1OC	ZINC000853938271	GH	On-Demand	Anodyne	PPARD	19	44
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853938278	GE	On-Demand	Anodyne	BDKRB1	54	37
O=C(NCCS(=O)(=O)CC(F)(F)F)N[C@H]1CCCc2cc(F)ccc21	ZINC000853938279	GE	On-Demand	Anodyne	BDKRB1	54	37
c1ccc(-c2cnc(NCC3SCCS3)cn2)cc1	ZINC000853938305	CG	On-Demand	Anodyne	TPH1	29	42
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	ADORA1	173	76
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	SLC29A1	142	64
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	ADORA2A	60	67
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	ADORA2B	19	66
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	ADK	70	58
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	AHCY	63	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	CDA	42	34
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	P2RX4	36	43
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	P2RX1	48	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	P2RY1	36	43
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	AMD1	37	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	ITPR1	35	41
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	P2RY2	16	43
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	ADORA3	138	67
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	OXGR1	123	42
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	RNASE1	43	34
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	DNMT3B	75	45
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	Q4VQ11_PIG	90	66
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	GPR17	58	46
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	HSPA5	43	38
OC[C@H]1O[C@@H](n2cnc3c(NCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853938373	GB	On-Demand	Anodyne	DOT1L	91	44
Oc1cccc2c(NCC3SCCS3)ccnc12	ZINC000853938401	CG	On-Demand	Anodyne	HRP1_PLAFA	40	36
O=[N+]([O-])c1ccc2c(NCC3SCCS3)ccnc2c1	ZINC000853938423	DG	On-Demand	Bother	HRP1_PLAFA	102	43
CCOc1ccccc1COC(=O)c1nccnc1C	ZINC000853938434	CF	On-Demand	Anodyne	PPIA	24	42
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	INHA	85	38
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	RARB	15	44
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	PLA2G4A	34	44
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	S1PR4	42	38
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	PLA2G4B	51	33
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	FAAH	49	42
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	S1PR2	51	40
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	CES1	40	34
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	S1PR1	22	40
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	SPHK1	15	40
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	S1PR5	41	38
CCCCCCc1ccc(C(=O)COC(=O)c2nccnc2C)cc1	ZINC000853938439	EH	On-Demand	Anodyne	CES1D	43	31
CSc1cc(C)c(C(=O)OCC(=O)NC(=O)CCSc2ccccc2)o1	ZINC000853938452	GG	On-Demand	Anodyne	FAS	36	41
COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1nccnc1C)CC2	ZINC000853938459	FD	On-Demand	Anodyne	ABCB1B	56	32
COc1cc2c(cc1OC)CN(C(=O)COC(=O)c1nccnc1C)CC2	ZINC000853938459	FD	On-Demand	Anodyne	ABCB1	18	48
O=[N+]([O-])c1ccc(-c2csc(NCC3SCCS3)n2)cc1	ZINC000853938463	EH	On-Demand	Bother	MAOB	17	54
N#Cc1cnc2c(Br)cccc2c1NCC1SCCS1	ZINC000853938466	FI	On-Demand	Mild	MAP3K8	42	34
Oc1nc(NCC2SCCS2)nc2ccccc12	ZINC000853938498	CF	On-Demand	Anodyne	TNKS	40	31
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)c2nccnc2C)CC1	ZINC000853938503	EC	On-Demand	Anodyne	PTR1	43	31
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)c2nccnc2C)CC1	ZINC000853938504	EC	On-Demand	Anodyne	PTR1	43	31
CON(C)CCNC(=O)N[C@H]1CCCc2cc(F)ccc21	ZINC000853938562	CD	On-Demand	Anodyne	BDKRB1	46	35
CON(C)CCNC(=O)N[C@@H]1CCCc2cc(F)ccc21	ZINC000853938563	CD	On-Demand	Anodyne	BDKRB1	46	35
CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)c2nccnc2C)C(C)C)c1	ZINC000853938590	FF	On-Demand	Anodyne	KCNK3	49	33
CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)c2nccnc2C)C(C)C)c1	ZINC000853938590	FF	On-Demand	Anodyne	KCNK9	42	31
CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)c2nccnc2C)C(C)C)c1	ZINC000853938591	FF	On-Demand	Anodyne	KCNK3	49	33
CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)c2nccnc2C)C(C)C)c1	ZINC000853938591	FF	On-Demand	Anodyne	KCNK9	42	31
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1nccnc1C	ZINC000853938621	EC	On-Demand	Anodyne	FKBP1A	62	38
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1nccnc1C	ZINC000853938621	EC	On-Demand	Anodyne	CPT1A	59	40
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)c1nccnc1C	ZINC000853938621	EC	On-Demand	Anodyne	CPT2	42	38
N#Cc1cnc2c(Cl)cccc2c1NCC1SCCS1	ZINC000853938626	DH	On-Demand	Mild	MAP3K8	103	38
CSc1cc(C)c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C)o1	ZINC000853938645	FG	On-Demand	Bother	CACNA1D	43	32
CCCCCNC(=O)COC(=O)c1nccnc1C	ZINC000853938646	CD	On-Demand	Anodyne	ASAH1	61	36
CSc1cc(C)c(C(=O)OCC(=O)NCc2ccc3c(c2)OCO3)o1	ZINC000853938651	FF	On-Demand	Anodyne	BMP1	40	35
CSc1cc(C)c(C(=O)OCC(=O)NCc2ccc3c(c2)OCO3)o1	ZINC000853938651	FF	On-Demand	Anodyne	NOS2	89	37
c1ccc2c(c1)[nH]c1ncnc(NCC3SCCS3)c12	ZINC000853938653	DG	On-Demand	Anodyne	UTS2R	23	52
c1ccc2c(c1)[nH]c1ncnc(NCC3SCCS3)c12	ZINC000853938653	DG	On-Demand	Anodyne	TNK2	46	49
CCn1c(=O)c(NCC2SCCS2)nc2ccccc21	ZINC000853938659	DF	On-Demand	Anodyne	PYGM	21	44
COc1ccc(-c2noc(NCC3SCCS3)n2)cc1	ZINC000853938668	DF	On-Demand	Anodyne	LUCI_PHOPE	15	40
c1nc(NCC2SCCS2)c2ncn(C3CC3)c2n1	ZINC000853938683	CE	On-Demand	Anodyne	ADORA1	50	47
c1nc(NCC2SCCS2)c2ncn(C3CC3)c2n1	ZINC000853938683	CE	On-Demand	Anodyne	ADORA3	47	41
COc1ccc(NC(=O)[C@H](C)OC(=O)c2nccnc2C)c([N+](=O)[O-])c1	ZINC000853938690	FD	On-Demand	Bother	TAAR1	18	40
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	MME	89	38
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	ANPEP	62	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	CTRA_BOVIN	44	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	FCER2	86	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	PAPA1_CARPA	46	36
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	CYSP_TRYCR	55	36
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	CAPNS1	58	32
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	HLA-DRB1	58	41
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	CAPN1	51	37
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	CAPN2	44	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	ACE2	51	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	MMP1	19	42
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	FPR1	52	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	BLA1_STEMA	41	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	PSMB8	46	37
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938753	GF	On-Demand	Anodyne	NPFFR1	49	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	MME	89	38
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	ANPEP	62	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	CTRA_BOVIN	44	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	FCER2	86	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	PAPA1_CARPA	46	36
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	CYSP_TRYCR	55	36
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	CAPNS1	58	32
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	HLA-DRB1	58	41
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	CAPN1	51	37
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	CAPN2	44	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	ACE2	51	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	MMP1	19	42
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	FPR1	52	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	BLA1_STEMA	41	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	PSMB8	46	37
CSc1cc(C)c(C(=O)OCC(=O)N[C@H](Cc2ccccc2)C(C)=O)o1	ZINC000853938755	GF	On-Demand	Anodyne	NPFFR1	49	35
Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2nccnc2C)c1	ZINC000853938842	CE	On-Demand	Anodyne	KCNK3	70	40
Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2nccnc2C)c1	ZINC000853938842	CE	On-Demand	Anodyne	KCNK9	60	38
Cc1cccc(NC(=O)[C@H](C)OC(=O)c2nccnc2C)c1	ZINC000853938843	CE	On-Demand	Anodyne	KCNK3	70	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)c2nccnc2C)c1	ZINC000853938843	CE	On-Demand	Anodyne	KCNK9	60	38
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)c2nccnc2C)cc1OC	ZINC000853938844	GE	On-Demand	Anodyne	CPT1A	91	40
CC(=O)c1cccc(NC(=O)[C@@H](OC(=O)c2nccnc2C)C(C)C)c1	ZINC000853938893	FF	On-Demand	Anodyne	KCNK3	56	35
CC(=O)c1cccc(NC(=O)[C@H](OC(=O)c2nccnc2C)C(C)C)c1	ZINC000853938894	FF	On-Demand	Anodyne	KCNK3	56	35
COc1ccc(OCCCOC(=O)c2nccnc2C)cc1	ZINC000853938895	DE	On-Demand	Anodyne	PPARD	18	40
COC(=O)N(C)CCNC(=O)N[C@H]1COc2cc(OC)ccc2C1	ZINC000853938951	EC	On-Demand	Anodyne	MTNR1A	38	45
COC(=O)N(C)CCNC(=O)N[C@@H]1COc2cc(OC)ccc2C1	ZINC000853938953	EC	On-Demand	Anodyne	MTNR1A	38	45
O=C(N[C@H]1CCCc2cc(F)ccc21)N1CCC(N2CCOC2=O)CC1	ZINC000853939001	FF	On-Demand	Anodyne	BDKRB1	47	38
O=C(N[C@@H]1CCCc2cc(F)ccc21)N1CCC(N2CCOC2=O)CC1	ZINC000853939003	FF	On-Demand	Anodyne	BDKRB1	47	38
CC[C@@H]1CCCCN1C(=O)COC(=O)c1nccnc1C	ZINC000853939005	CD	On-Demand	Anodyne	CPT1A	64	35
CC[C@H]1CCCCN1C(=O)COC(=O)c1nccnc1C	ZINC000853939006	CD	On-Demand	Anodyne	CPT1A	64	35
COc1ccc(CNC(=O)[C@H](C)OC(=O)c2nccnc2C)cc1OC	ZINC000853939039	FD	On-Demand	Anodyne	TRPV1	15	40
COc1ccc(CNC(=O)[C@H](C)OC(=O)c2nccnc2C)cc1OC	ZINC000853939039	FD	On-Demand	Anodyne	MT-ND1	19	40
COc1ccc(CNC(=O)[C@H](C)OC(=O)c2nccnc2C)cc1OC	ZINC000853939039	FD	On-Demand	Anodyne	DRTS_TRYCR	45	31
CCOc1ccccc1NC(=O)[C@@H](C)OC(=O)c1nccnc1C	ZINC000853939050	EE	On-Demand	Anodyne	PPIA	15	42
CCOc1ccccc1NC(=O)[C@H](C)OC(=O)c1nccnc1C	ZINC000853939051	EE	On-Demand	Anodyne	PPIA	15	42
COc1ccc(NC(=O)[C@H](C)OC(=O)c2nccnc2C)cc1	ZINC000853939087	DD	On-Demand	Anodyne	IMDH_CRYPV	21	41
CCOc1ccccc1NC(=O)COC(=O)c1nccnc1C	ZINC000853939090	DD	On-Demand	Anodyne	PPIA	24	43
Cc1ccc(NC(=O)COC(=O)c2nccnc2C)cc1C	ZINC000853939104	CE	On-Demand	Anodyne	ENPP1	70	36
Cc1ccccc1CNC(=O)COC(=O)c1nccnc1C	ZINC000853939113	CD	On-Demand	Anodyne	P2RX7	25	50
CSc1cc(C)c(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)o1	ZINC000853939163	FG	On-Demand	Bother	CACNA1D	43	32
Fc1ccc2c(NCC3SCCS3)ccnc2c1	ZINC000853939174	CH	On-Demand	Anodyne	HRP1_PLAFA	105	40
Fc1ccc2c(NCC3SCCS3)ccnc2c1	ZINC000853939174	CH	On-Demand	Anodyne	HNMT	48	36
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(C(C)=O)c2)o1	ZINC000853939184	FH	On-Demand	Anodyne	KCNK3	46	32
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(C(C)=O)c2)o1	ZINC000853939185	FH	On-Demand	Anodyne	KCNK3	46	32
CSc1cc(C)c(C(=O)OCC(=O)NCC2(c3ccccc3)CC2)o1	ZINC000853939193	FG	On-Demand	Anodyne	KCNA3	46	39
O=S(=O)(c1ccc(NCC2SCCS2)nc1)N1CCCC1	ZINC000853939207	EE	On-Demand	Anodyne	TGM2	17	40
Fc1cccc2ncnc(NCC3SCCS3)c12	ZINC000853939217	CF	On-Demand	Anodyne	TNK2	15	40
COC(=O)c1sccc1NC(=O)COC(=O)c1oc(SC)cc1C	ZINC000853939268	FF	On-Demand	Anodyne	FAS	55	49
NS(=O)(=O)c1ccc(NCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853939308	ED	On-Demand	Bother	CA2	23	46
O=C(NC1CC1)c1ccc(NCC2SCCS2)nc1	ZINC000853939312	CE	On-Demand	Anodyne	MAPK11	27	40
O=C(NC1CC1)c1ccc(NCC2SCCS2)nc1	ZINC000853939312	CE	On-Demand	Anodyne	MAPK14	25	40
O=C(NC1CC1)c1ccc(NCC2SCCS2)nc1	ZINC000853939312	CE	On-Demand	Anodyne	SSTR5	22	41
O=C(NC1CC1)c1ccc(NCC2SCCS2)nc1	ZINC000853939312	CE	On-Demand	Anodyne	MAPK13	44	33
FC(F)(F)c1cc(NCC2SCCS2)nc(-c2cccnc2)n1	ZINC000853939354	FH	On-Demand	Anodyne	ROS1	40	34
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	CA2	47	46
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	CA1	39	46
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	CA7	49	46
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	CA4	31	42
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	CA12	33	46
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	CA9	35	46
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	MTCA1	15	43
CSc1cc(C)c(C(=O)OCCOc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853939379	FE	On-Demand	Anodyne	P96878_MYCTU	21	43
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H]2CCOc3ccccc32)o1	ZINC000853939405	FG	On-Demand	Anodyne	LUXR	55	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@@H]2CCOc3ccccc32)o1	ZINC000853939405	FG	On-Demand	Anodyne	TRAR	59	35
CSc1cc(C)c(C(=O)OCC(=O)N[C@H]2CCOc3ccccc32)o1	ZINC000853939406	FG	On-Demand	Anodyne	LUXR	55	34
CSc1cc(C)c(C(=O)OCC(=O)N[C@H]2CCOc3ccccc32)o1	ZINC000853939406	FG	On-Demand	Anodyne	TRAR	59	35
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	TACR1	18	46
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	NQO2	20	40
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	CCKAR	35	44
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	BRS3	27	43
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	NMBR	28	46
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	MTNR1A	20	40
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	GRPR	55	32
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	MMP11	49	32
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	MMP9	18	45
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939407	GH	On-Demand	Anodyne	KISS1R	54	30
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	TACR1	18	46
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	NQO2	20	40
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	CCKAR	35	44
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	BRS3	27	43
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	NMBR	28	46
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	MTNR1A	20	40
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	GRPR	55	32
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	MMP11	49	32
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	MMP9	18	45
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)o1	ZINC000853939408	GH	On-Demand	Anodyne	KISS1R	54	30
CSc1cc(C)c(C(=O)OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)o1	ZINC000853939430	GF	On-Demand	Anodyne	KCNK3	45	32
c1cc(N2CCOCC2)nc(NCC2SCCS2)n1	ZINC000853939434	CD	On-Demand	Anodyne	EPHB4	60	33
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)cn2)o1	ZINC000853939442	FH	On-Demand	Anodyne	F10	48	32
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(Cl)cn2)o1	ZINC000853939444	FH	On-Demand	Anodyne	F10	48	32
CSc1cc(C)c(C(=O)OCC(=O)Nc2ccccc2N2CCCC2=O)o1	ZINC000853939446	GG	On-Demand	Anodyne	KCNQ2	59	35
CSc1cc(C)c(C(=O)OCC[C@H]2CCCCN2C)o1	ZINC000853939451	CG	On-Demand	Anodyne	CHRNA10	52	34
CSc1cc(C)c(C(=O)OCC[C@H]2CCCCN2C)o1	ZINC000853939451	CG	On-Demand	Anodyne	ACKR3	62	31
CSc1cc(C)c(C(=O)OCC[C@@H]2CCCCN2C)o1	ZINC000853939452	CG	On-Demand	Anodyne	CHRNA10	52	34
CSc1cc(C)c(C(=O)OCC[C@@H]2CCCCN2C)o1	ZINC000853939452	CG	On-Demand	Anodyne	ACKR3	62	31
COc1ccc2c(NCC3SCCS3)ccnc2c1	ZINC000853939477	CG	On-Demand	Anodyne	HRP1_PLAFA	121	43
COc1ccc2c(NCC3SCCS3)ccnc2c1	ZINC000853939477	CG	On-Demand	Anodyne	HNMT	61	36
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)o1	ZINC000853939511	GG	On-Demand	Anodyne	KCNK3	43	32
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)o1	ZINC000853939511	GG	On-Demand	Anodyne	KCNK9	43	31
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)o1	ZINC000853939512	GG	On-Demand	Anodyne	KCNK3	43	32
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)o1	ZINC000853939512	GG	On-Demand	Anodyne	KCNK9	43	31
Nc1nc(NCC2SCCS2)ncc1[N+](=O)[O-]	ZINC000853939565	CD	On-Demand	Bother	PRKCQ	30	40
O=C(NC1CC1)c1ccc(NCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853939567	EF	On-Demand	Bother	TAAR1	17	40
Cc1nc(NCC2SCCS2)cc(-c2cccnc2)n1	ZINC000853939579	DG	On-Demand	Anodyne	CYP2E1	46	38
Cc1nc(NCC2SCCS2)cc(-c2cccnc2)n1	ZINC000853939579	DG	On-Demand	Anodyne	ROS1	54	36
Cc1nc(NCC2SCCS2)cc(-c2cccnc2)n1	ZINC000853939579	DG	On-Demand	Anodyne	VCP	22	41
Ic1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939581	GG	On-Demand	Anodyne	DYRK1A	19	41
Ic1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939581	GG	On-Demand	Anodyne	CLK1	19	41
Ic1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939581	GG	On-Demand	Anodyne	CLK2	22	41
Ic1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939581	GG	On-Demand	Anodyne	CLK4	65	41
Ic1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939581	GG	On-Demand	Anodyne	CD38	81	40
Ic1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939581	GG	On-Demand	Anodyne	DYRK1B	18	41
CCCCCNC(=O)[C@@H](C)OC(=O)c1oc(SC)cc1C	ZINC000853939588	DG	On-Demand	Anodyne	ASAH1	41	31
CCCCCNC(=O)[C@H](C)OC(=O)c1oc(SC)cc1C	ZINC000853939589	DG	On-Demand	Anodyne	ASAH1	41	31
c1ccc(-c2csc(NCC3SCCS3)n2)cc1	ZINC000853939595	CI	On-Demand	Anodyne	MAOB	20	47
c1ccc(-c2csc(NCC3SCCS3)n2)cc1	ZINC000853939595	CI	On-Demand	Anodyne	SPHK2	47	31
c1ccc(-c2csc(NCC3SCCS3)n2)cc1	ZINC000853939595	CI	On-Demand	Anodyne	NPY5R	15	43
c1ccc(-c2csc(NCC3SCCS3)n2)cc1	ZINC000853939595	CI	On-Demand	Anodyne	SPHK1	45	39
c1ccc(-c2csc(NCC3SCCS3)n2)cc1	ZINC000853939595	CI	On-Demand	Anodyne	VCP	30	46
O=C(c1cnc(NCC2SCCS2)c(Cl)c1)N1CCOCC1	ZINC000853939614	FE	On-Demand	Anodyne	LRRK2	32	42
CC(=O)c1ccc(NCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853939643	CG	On-Demand	Bother	TAAR1	19	42
CC(=O)c1ccc(NCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853939643	CG	On-Demand	Bother	AKR1C3	15	45
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NC(=O)NCc2ccccc2)o1	ZINC000853939645	GF	On-Demand	Anodyne	PDS	49	35
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NC(=O)NCc2ccccc2)o1	ZINC000853939646	GF	On-Demand	Anodyne	PDS	49	35
C=CCNC(=O)c1ccc(NCC2SCCS2)nc1	ZINC000853939648	CE	On-Demand	Mild	HCAR3	15	51
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccnc2Cl)o1	ZINC000853939686	FH	On-Demand	Anodyne	G2YM83_BOTF4	63	32
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccnc2Cl)o1	ZINC000853939688	FH	On-Demand	Anodyne	G2YM83_BOTF4	63	32
CS(=O)(=O)c1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939692	EE	On-Demand	Anodyne	CLK4	63	38
CS(=O)(=O)c1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939692	EE	On-Demand	Anodyne	CD38	52	41
COc1ccc(NC(=O)[C@H](C)OC(=O)c2oc(SC)cc2C)cc1OC	ZINC000853939756	GH	On-Demand	Anodyne	ENPP1	70	35
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939767	GE	On-Demand	Anodyne	CA2	26	49
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939767	GE	On-Demand	Anodyne	CA1	21	42
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939767	GE	On-Demand	Anodyne	CA4	24	49
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939767	GE	On-Demand	Anodyne	CA12	15	42
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939767	GE	On-Demand	Anodyne	CA9	16	42
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939769	GE	On-Demand	Anodyne	CA2	26	49
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939769	GE	On-Demand	Anodyne	CA1	21	42
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939769	GE	On-Demand	Anodyne	CA4	24	49
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939769	GE	On-Demand	Anodyne	CA12	15	42
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)o1	ZINC000853939769	GE	On-Demand	Anodyne	CA9	16	42
CSc1cc(C)c(C(=O)OCCCn2cnc3c(N)ncnc32)o1	ZINC000853939788	EE	On-Demand	Anodyne	AHCY	45	39
CSc1cc(C)c(C(=O)OCCCn2cnc3c(N)ncnc32)o1	ZINC000853939788	EE	On-Demand	Anodyne	OXGR1	77	33
CSc1cc(C)c(C(=O)OCc2ccc(S(=O)(=O)N3CCCC3)o2)o1	ZINC000853939794	GG	On-Demand	Anodyne	LPL	52	41
CSc1cc(C)c(C(=O)OCc2ccc(S(=O)(=O)N3CCCC3)o2)o1	ZINC000853939794	GG	On-Demand	Anodyne	LIPG	21	41
c1nc(NCC2SCCS2)nc(NCC2SCCS2)c1C1CC1	ZINC000853939818	GH	On-Demand	Anodyne	TBK1	53	34
CCCCNC(=O)COC(=O)c1cc(CN2C(=O)c3ccccc3C2=O)c(C)o1	ZINC000853939866	GE	On-Demand	Anodyne	AGTR1B	41	36
O=C(N[C@@H]1CN(c2ncnc3[nH]ccc23)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853939880	GF	On-Demand	Anodyne	AKT2	51	48
O=C(N[C@@H]1CN(c2ncnc3[nH]ccc23)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853939880	GF	On-Demand	Anodyne	AKT3	32	42
O=C(N[C@@H]1CN(c2ncnc3[nH]ccc23)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853939880	GF	On-Demand	Anodyne	JAK3	16	43
O=C(N[C@@H]1CN(c2ncnc3[nH]ccc23)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853939880	GF	On-Demand	Anodyne	AKT1	20	42
O=c1c(Cl)c(NCC2SCCS2)cnn1Cc1ccccc1	ZINC000853939920	FG	On-Demand	Anodyne	NPBWR1	15	40
Fc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939923	CF	On-Demand	Anodyne	CLK1	19	41
Fc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939923	CF	On-Demand	Anodyne	CLK2	22	41
Fc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939923	CF	On-Demand	Anodyne	CLK4	66	41
Fc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939923	CF	On-Demand	Anodyne	CD38	70	38
Fc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853939923	CF	On-Demand	Anodyne	DYRK1B	24	41
O=C(NC1CC1)c1cc(NCC2SCCS2)nc2ccccc12	ZINC000853939956	EG	On-Demand	Anodyne	ACACB	15	41
O=C(NC1CC1)c1cc(NCC2SCCS2)nc2ccccc12	ZINC000853939956	EG	On-Demand	Anodyne	METG	40	32
O=C(NC1CC1)c1cc(NCC2SCCS2)nc2ccccc12	ZINC000853939956	EG	On-Demand	Anodyne	TNKS	58	33
c1ccc(-c2nccc(NCC3SCCS3)n2)cc1	ZINC000853939990	CG	On-Demand	Anodyne	PKNB	40	36
COC(=O)[C@@H](C)NC(=O)c1ccc(NCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853940032	GE	On-Demand	Bother	TAAR1	20	43
CCC(=O)N1CCc2cc(C(=O)COC(=O)c3oc(SC)cc3C)ccc21	ZINC000853940072	GH	On-Demand	Anodyne	EIF2AK3	46	33
CSc1cc(C)c(C(=O)OCC(=O)Nc2ccc(N3CCCCC3)nc2)o1	ZINC000853940093	GG	On-Demand	Anodyne	DGAT1	40	44
COC(=O)C1CCN(C(=O)COC(=O)c2oc(SC)cc2C)CC1	ZINC000853940134	FD	On-Demand	Anodyne	PTR1	42	29
c1ccc2nc(N3CCOCC3)c(NCC3SCCS3)nc2c1	ZINC000853940158	EF	On-Demand	Anodyne	PIK3CA	15	43
Ic1cccc2ncnc(NCC3SCCS3)c12	ZINC000853940168	GG	On-Demand	Anodyne	TNK2	15	41
O=C(Cc1cscn1)OCc1ccc(CN2CCOCC2)cc1	ZINC000853940260	EE	On-Demand	Anodyne	SCN5A	42	35
COC(=O)c1ccc([N+](=O)[O-])c(COC(=O)c2oc(SC)cc2C)c1	ZINC000853940262	FG	On-Demand	Bother	CACNA1D	62	36
O=C(N[C@@H]1CN(c2ncccn2)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853940272	FF	On-Demand	Anodyne	EPHX2	19	40
CSc1cc(C)c(C(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)o1	ZINC000853940317	ED	On-Demand	Anodyne	CPT2	40	33
CSc1cc(C)c(C(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)o1	ZINC000853940319	ED	On-Demand	Anodyne	CPT2	40	33
CC(C)(C)OC(=O)N1CCC(CCCOC(=O)Cc2cscn2)CC1	ZINC000853940354	FH	On-Demand	Anodyne	GPR119	48	48
C[C@H]1C[C@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)C[C@@H](C)O1	ZINC000853940387	FH	On-Demand	Reactive	LCK	21	40
C[C@H]1C[C@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)C[C@@H](C)O1	ZINC000853940387	FH	On-Demand	Reactive	CSNK1D	29	40
C[C@@H]1CC(NC(=O)NNc2nc3ccc(Cl)cc3s2)C[C@@H](C)O1	ZINC000853940389	FH	On-Demand	Reactive	LCK	21	40
C[C@@H]1CC(NC(=O)NNc2nc3ccc(Cl)cc3s2)C[C@@H](C)O1	ZINC000853940389	FH	On-Demand	Reactive	CSNK1D	29	40
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	CA2	64	53
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	CA1	59	46
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	CA7	31	49
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	CA4	51	45
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	CA14	29	49
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	CA12	46	45
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	CA9	47	53
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	MTCA1	47	43
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940400	GE	On-Demand	Anodyne	P96878_MYCTU	59	43
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	CA2	64	53
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	CA1	59	46
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	CA7	31	49
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	CA4	51	45
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	CA14	29	49
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	CA12	46	45
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	CA9	47	53
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	MTCA1	47	43
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940401	GE	On-Demand	Anodyne	P96878_MYCTU	59	43
Brc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853940406	EH	On-Demand	Anodyne	EGFR	67	41
Brc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853940406	EH	On-Demand	Anodyne	DYRK1A	20	41
Brc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853940406	EH	On-Demand	Anodyne	CLK1	19	41
Brc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853940406	EH	On-Demand	Anodyne	CLK2	23	41
Brc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853940406	EH	On-Demand	Anodyne	CLK4	66	41
Brc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853940406	EH	On-Demand	Anodyne	CD38	70	38
Brc1ccc2ncnc(NCC3SCCS3)c2c1	ZINC000853940406	EH	On-Demand	Anodyne	DYRK1B	19	41
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)o1	ZINC000853940431	GH	On-Demand	Mild	VIPR1	27	43
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2sc3c(c2C#N)CCC3)o1	ZINC000853940432	GH	On-Demand	Mild	VIPR1	27	43
NS(=O)(=O)c1ccc(NCC2SCCS2)c(C(F)(F)F)c1	ZINC000853940434	FF	On-Demand	Anodyne	CA2	26	43
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	CA2	88	54
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	CA1	78	43
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	CA7	59	43
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	CA4	58	54
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	CA5A	40	35
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	CA12	59	40
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	CA9	68	40
CSc1cc(C)c(C(=O)OCCc2ccc(S(N)(=O)=O)cc2)o1	ZINC000853940446	FE	On-Demand	Anodyne	NCE103	18	41
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)o1	ZINC000853940451	EH	On-Demand	Anodyne	KCNK3	58	36
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)o1	ZINC000853940451	EH	On-Demand	Anodyne	KCNK9	46	36
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(C)c2)o1	ZINC000853940453	EH	On-Demand	Anodyne	KCNK3	58	36
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)Nc2cccc(C)c2)o1	ZINC000853940453	EH	On-Demand	Anodyne	KCNK9	46	36
CSc1cc(C)c(C(=O)OCCCn2ccnc2)o1	ZINC000853940462	CF	On-Demand	Anodyne	TBXAS1	49	41
CSc1cc(C)c(C(=O)OCCCn2ccnc2)o1	ZINC000853940462	CF	On-Demand	Anodyne	HMOX2	48	38
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853940465	EF	On-Demand	Anodyne	MME	61	39
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853940465	EF	On-Demand	Anodyne	FCER2	47	33
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853940465	EF	On-Demand	Anodyne	TIMP3	19	41
CSc1cc(C)c(C(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)o1	ZINC000853940494	GF	On-Demand	Anodyne	CA2	21	40
CSc1cc(C)c(C(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)o1	ZINC000853940494	GF	On-Demand	Anodyne	CA4	17	40
CSc1cc(C)c(C(=O)O[C@H](C)C(=O)NCc2ccc(F)cc2)o1	ZINC000853940548	FG	On-Demand	Anodyne	LEF	74	37
CSc1cc(C)c(C(=O)O[C@@H](C)C(=O)NCc2ccc(F)cc2)o1	ZINC000853940550	FG	On-Demand	Anodyne	LEF	74	37
O=C(c1cccnc1NCC1SCCS1)N1CCc2ccccc21	ZINC000853940593	FH	On-Demand	Anodyne	AVPR2	56	38
O=C(c1cccnc1NCC1SCCS1)N1CCc2ccccc21	ZINC000853940593	FH	On-Demand	Anodyne	GPBAR1	15	41
CO[C@@H](COC(=O)c1oc(SC)cc1C)c1ccccc1	ZINC000853940624	DH	On-Demand	Anodyne	F9	40	32
O=C(c1ccc(NCC2SCCS2)nc1)N1CCc2ccccc21	ZINC000853940627	FH	On-Demand	Anodyne	AVPR2	100	44
O=C(c1ccc(NCC2SCCS2)nc1)N1CCc2ccccc21	ZINC000853940627	FH	On-Demand	Anodyne	AVPR1A	63	44
CSc1cc(C)c(C(=O)OCCN2CCOCC2)o1	ZINC000853940639	CD	On-Demand	Anodyne	HTR4	21	46
Cc1ccc(NC(=O)c2ccc(NCC3SCCS3)nc2)cc1	ZINC000853940644	EH	On-Demand	Anodyne	PRNP	49	33
CSc1cc(C)c(C(=O)OCC(=O)c2cn(CCC#N)c3ccccc23)o1	ZINC000853940657	GI	On-Demand	Mild	CNR2	16	41
NC(=O)c1cnccc1N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853940677	GE	On-Demand	Anodyne	LIPG	44	34
Cc1nc(N2CC[C@H](c3ccccc3)[C@H](NC(=O)C(F)(F)F)C2)ccc1C#N	ZINC000853940684	GG	On-Demand	Mild	P2RY12	15	41
NC(=O)c1cc(Cl)nnc1NC[C@H]1CN(Cc2ccccc2)CC12CCC2	ZINC000853940767	GF	On-Demand	Anodyne	NPFFR1	40	36
CSc1cc(C)c(C(=O)OCCCN2CCCC2)o1	ZINC000853940800	CF	On-Demand	Anodyne	HTR4	17	43
CSc1cc(C)c(C(=O)OCCCN2CCCC2)o1	ZINC000853940800	CF	On-Demand	Anodyne	HRH3	30	41
c1ccc(-c2cncnc2NCC2SCCS2)cc1	ZINC000853940849	CG	On-Demand	Anodyne	TNK2	25	45
CN1CCN(c2nc3ccccc3nc2NCC2SCCS2)CC1	ZINC000853940889	FF	On-Demand	Anodyne	HTR3A	30	50
CN1CCN(c2nc3ccccc3nc2NCC2SCCS2)CC1	ZINC000853940889	FF	On-Demand	Anodyne	HRH4	46	50
COC(=O)[C@@H](OC(=O)c1oc(SC)cc1C)c1ccc(F)cc1	ZINC000853940959	EH	On-Demand	Anodyne	LEF	46	33
NC(=O)c1cc(Cl)nnc1NC[C@@H]1CN(Cc2ccccc2)CC12CCC2	ZINC000853940968	GF	On-Demand	Anodyne	NPFFR1	40	36
O=C(N[C@@H]1CN(c2ccccn2)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853941019	EG	On-Demand	Anodyne	EBP	21	40
COc1c(C)ncnc1N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853941037	GF	On-Demand	Anodyne	PDE3A	40	38
COc1c(C)ncnc1N1CC[C@H](c2ccccc2)[C@H](NC(=O)C(F)(F)F)C1	ZINC000853941037	GF	On-Demand	Anodyne	PDE3B	43	36
Nc1nc(NCC2SCCS2)cc(-n2cccn2)n1	ZINC000853941075	CD	On-Demand	Anodyne	HRH4	15	40
N#Cc1cnc2c(F)cc(F)cc2c1NCC1SCCS1	ZINC000853941089	DH	On-Demand	Mild	MAP3K8	96	36
CCCNC(=O)c1ccc(NCC2SCCS2)nc1	ZINC000853941092	CE	On-Demand	Anodyne	IKBKB	15	41
COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853941172	EG	On-Demand	Anodyne	MME	74	39
COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853941172	EG	On-Demand	Anodyne	ANPEP	57	33
COC(=O)[C@@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853941172	EG	On-Demand	Anodyne	CAPN2	43	30
COC(=O)[C@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853941173	EG	On-Demand	Anodyne	MME	74	39
COC(=O)[C@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853941173	EG	On-Demand	Anodyne	ANPEP	57	33
COC(=O)[C@H](Cc1ccccc1)OC(=O)c1oc(SC)cc1C	ZINC000853941173	EG	On-Demand	Anodyne	CAPN2	43	30
CSc1cc(C)c(C(=O)OCC(=O)COc2ccccc2)o1	ZINC000853941197	DG	On-Demand	Anodyne	PLA2G4B	70	36
COC(=O)c1cccc(NC[C@@H]2CN(Cc3ccccc3)CC23CCC3)n1	ZINC000853941260	FH	On-Demand	Anodyne	SIGMAR1	20	41
COC(=O)c1cccc(NC[C@H]2CN(Cc3ccccc3)CC23CCC3)n1	ZINC000853941261	FH	On-Demand	Anodyne	SIGMAR1	20	41
NC(=O)c1ccc(N2CC[C@H](c3ccccc3)[C@H](NC(=O)C(F)(F)F)C2)nn1	ZINC000853941275	GD	On-Demand	Anodyne	SCD1	52	48
O=C(N[C@@H]1CN(c2ncc(Cl)s2)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853941280	GH	On-Demand	Anodyne	MLYCD	61	42
O=C(N[C@@H]1CN(c2ncc(Cl)s2)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC000853941280	GH	On-Demand	Anodyne	PARE	54	38
CSc1cc(C)c(C(=O)O[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000853941313	GG	On-Demand	Bother	CACNA1C	41	38
CSc1cc(C)c(C(=O)O[C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000853941313	GG	On-Demand	Bother	CACNA1D	61	33
CSc1cc(C)c(C(=O)O[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000853941314	GG	On-Demand	Bother	CACNA1C	41	38
CSc1cc(C)c(C(=O)O[C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)o1	ZINC000853941314	GG	On-Demand	Bother	CACNA1D	61	33
CSc1cc(C)c(C(=O)OCCN2CCCCC2)o1	ZINC000853941329	CF	On-Demand	Anodyne	HTR4	31	43
CSc1cc(C)c(C(=O)OCc2ccc(NS(C)(=O)=O)cc2)o1	ZINC000853941339	FG	On-Demand	Anodyne	TRPV1	15	41
CSc1cc(C)c(C(=O)OCc2ccc(NS(C)(=O)=O)cc2)o1	ZINC000853941339	FG	On-Demand	Anodyne	PTPRB	41	33
COC(=O)[C@@H](Cc1ccc(F)cc1)OC(=O)c1oc(SC)cc1C	ZINC000853941345	FG	On-Demand	Anodyne	LEF	69	35
CSc1cc(C)c(C(=O)O[C@H](Cc2ccc(F)cc2)C(N)=O)o1	ZINC000853941347	EF	On-Demand	Anodyne	LEF	43	34
CSc1cc(C)c(C(=O)O[C@@H](Cc2ccc(F)cc2)C(N)=O)o1	ZINC000853941348	EF	On-Demand	Anodyne	LEF	43	34
CSc1cc(C)c(C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)o1	ZINC000853941353	GE	On-Demand	Anodyne	CA2	20	42
CSc1cc(C)c(C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)o1	ZINC000853941353	GE	On-Demand	Anodyne	CA1	19	40
CSc1cc(C)c(C(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)o1	ZINC000853941353	GE	On-Demand	Anodyne	CA4	15	42
CSc1cc(C)c(C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)o1	ZINC000853941359	GE	On-Demand	Anodyne	CA2	57	42
CSc1cc(C)c(C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)o1	ZINC000853941359	GE	On-Demand	Anodyne	CA1	54	42
CSc1cc(C)c(C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)o1	ZINC000853941359	GE	On-Demand	Anodyne	CA5B	62	38
CSc1cc(C)c(C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)o1	ZINC000853941359	GE	On-Demand	Anodyne	CA4	55	42
CSc1cc(C)c(C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)o1	ZINC000853941359	GE	On-Demand	Anodyne	CA5A	66	38
CSc1cc(C)c(C(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)o1	ZINC000853941359	GE	On-Demand	Anodyne	CA9	40	37
CSc1cc(C)c(C(=O)OCC(=O)COc2ccc(F)cc2)o1	ZINC000853941457	EG	On-Demand	Anodyne	PLA2G4B	44	31
CSc1cc(C)c(C(=O)O[C@H](C)c2ccc(S(C)(=O)=O)cc2)o1	ZINC000853941507	FH	On-Demand	Anodyne	O49150_SOLTU	42	36
CSc1cc(C)c(C(=O)O[C@@H](C)c2ccc(S(C)(=O)=O)cc2)o1	ZINC000853941509	FH	On-Demand	Anodyne	O49150_SOLTU	42	36
O=C(Cc1cscn1)O[C@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000853941521	GG	On-Demand	Anodyne	SCN5A	24	44
O=C(Cc1cscn1)O[C@@H]1CCCN(Cc2cccc(C(F)(F)F)c2)C1=O	ZINC000853941524	GG	On-Demand	Anodyne	SCN5A	24	44
O=[N+]([O-])c1ccc(NCC2SCCS2)c(S(=O)(=O)N2CCCC2)c1	ZINC000853941529	GF	On-Demand	Bother	TBXA2R	15	40
O=[N+]([O-])c1ccc(N2CCC(c3ccon3)CC2)c2nonc12	ZINC000853941542	DF	On-Demand	Bother	GSTM2	108	40
O=[N+]([O-])c1ccc(N2CCC(c3ccon3)CC2)c2nonc12	ZINC000853941542	DF	On-Demand	Bother	GSTP1	64	40
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cscn1	ZINC000853941566	DD	On-Demand	Anodyne	BMP1	16	42
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cscn1	ZINC000853941566	DD	On-Demand	Anodyne	TIMP3	29	41
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cscn1	ZINC000853941566	DD	On-Demand	Anodyne	GPR142	62	46
CSc1cc(C)c(C(=O)OCCOc2ccc(S(C)(=O)=O)cc2)o1	ZINC000853941568	FF	On-Demand	Anodyne	O49150_SOLTU	42	32
O=C(CCc1ccccc1)COC(=O)Cc1cscn1	ZINC000853941588	CE	On-Demand	Anodyne	FAAH	26	40
O=C(Cc1cscn1)OCc1ccc(CN2CCCCC2)cc1	ZINC000853941591	EG	On-Demand	Anodyne	HRH3	24	47
O=C(Cc1cscn1)OCCN1CCCCC1	ZINC000853941606	CD	On-Demand	Anodyne	ESR1	40	35
O=C(Cc1cscn1)OCCN1CCCCC1	ZINC000853941606	CD	On-Demand	Anodyne	LTA4H	38	55
O=C(Cc1cscn1)OCCN1CCCCC1	ZINC000853941606	CD	On-Demand	Anodyne	PSMB1	43	38
COC(=O)c1cccc(N2CCC[C@@H](C3CCC3)C2)n1	ZINC000853941614	CF	On-Demand	Anodyne	HSD11B1	15	43
COC(=O)c1cccc(N2CCC[C@H](C3CCC3)C2)n1	ZINC000853941615	CF	On-Demand	Anodyne	HSD11B1	15	43
O=C(Cc1cscn1)OCc1cccc(CN2CCOCC2)c1	ZINC000853941621	EE	On-Demand	Anodyne	SCN5A	45	40
Cc1cc(N2CC[C@H](c3ccccc3)[C@H](NC(=O)C(F)(F)F)C2)nc(C)n1	ZINC000853941637	GG	On-Demand	Anodyne	EPHX2	18	41
Cc1nnc(N2CC[C@H](c3ccccc3)[C@H](NC(=O)C(F)(F)F)C2)s1	ZINC000853941646	FF	On-Demand	Anodyne	PARE	83	33
O=C(Cc1cscn1)OCCCN1CCCCC1	ZINC000853941703	CE	On-Demand	Anodyne	LTA4H	22	50
O=C(Cc1cscn1)OCCCN1CCCCC1	ZINC000853941703	CE	On-Demand	Anodyne	HRH3	71	44
O=C(Cc1cscn1)OCCCN1CCCCC1	ZINC000853941703	CE	On-Demand	Anodyne	HNMT	59	33
CC(C)c1cccc(COC(=O)Cc2cscn2)c1	ZINC000853941707	CH	On-Demand	Anodyne	BMP1	15	40
CC(C)(C)OC(=O)N1CCC(CCOC(=O)Cc2cscn2)CC1	ZINC000853941774	FG	On-Demand	Anodyne	GPR119	51	44
COC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cscn1	ZINC000853941805	DE	On-Demand	Anodyne	BMP1	16	43
COC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cscn1	ZINC000853941805	DE	On-Demand	Anodyne	GPR142	58	44
COC(=O)[C@H](Cc1ccccc1)OC(=O)Cc1cscn1	ZINC000853941806	DE	On-Demand	Anodyne	BMP1	16	43
COC(=O)[C@H](Cc1ccccc1)OC(=O)Cc1cscn1	ZINC000853941806	DE	On-Demand	Anodyne	GPR142	58	44
COC(=O)[C@@H](Cc1ccc(F)cc1)OC(=O)Cc1cscn1	ZINC000853941836	DE	On-Demand	Anodyne	GPR142	44	37
O=C(Cc1cscn1)OCCCN1CCOCC1	ZINC000853941863	CC	On-Demand	Anodyne	HRH3	18	44
O=C(Cc1cscn1)OCCCN1CCOCC1	ZINC000853941863	CC	On-Demand	Anodyne	EPHX2	19	43
Nc1nc(Cl)cc(N2CCC(c3ccon3)CC2)n1	ZINC000853941903	CE	On-Demand	Anodyne	HRH4	49	42
O=C(Cc1cscn1)O[C@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853941906	EE	On-Demand	Anodyne	SCN5A	32	40
O=C(Cc1cscn1)O[C@@H]1CCCN(Cc2ccccc2)C1=O	ZINC000853941907	EE	On-Demand	Anodyne	SCN5A	32	40
CCCCCCC(=O)COC(=O)Cc1cscn1	ZINC000853941927	CF	On-Demand	Anodyne	PLA2G4B	64	33
COc1cccc(OCCOC(=O)Cc2cscn2)c1	ZINC000853941943	CE	On-Demand	Anodyne	MTNR1A	43	46
COc1cccc(OCCOC(=O)Cc2cscn2)c1	ZINC000853941943	CE	On-Demand	Anodyne	MTNR1B	41	46
O=C(Cc1cscn1)OCCCn1ccnc1	ZINC000853941990	CD	On-Demand	Anodyne	TBXAS1	50	50
O=C(Cc1cscn1)OCCCn1ccnc1	ZINC000853941990	CD	On-Demand	Anodyne	HMOX1	19	44
O=C(Cc1cscn1)OCCCn1ccnc1	ZINC000853941990	CD	On-Demand	Anodyne	HMOX2	50	43
C#CCNC(=O)c1ccc(N2CCC[C@H](C3CCC3)C2)nc1	ZINC000853942005	CE	On-Demand	Mild	HPGDS	16	45
C#CCNC(=O)c1ccc(N2CCC[C@@H](C3CCC3)C2)nc1	ZINC000853942006	CE	On-Demand	Mild	HPGDS	16	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	DRD4	35	47
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	CHRM3	18	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	LTA4H	15	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	SIGMAR1	32	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	SSTR5	42	35
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	CCR3	38	44
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	SCN5A	46	38
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	MCHR1	27	48
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853942057	FE	On-Demand	Anodyne	BIRC2	42	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	DRD4	35	47
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	CHRM3	18	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	LTA4H	15	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	SIGMAR1	32	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	SSTR5	42	35
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	CCR3	38	44
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	SCN5A	46	38
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	MCHR1	27	48
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853942060	FE	On-Demand	Anodyne	BIRC2	42	45
CN(CCOC(=O)Cc1cscn1)Cc1ccccc1	ZINC000853942071	CE	On-Demand	Anodyne	LTA4H	22	40
COc1ccccc1N1CC[C@H](OC(=O)Cc2cscn2)C1=O	ZINC000853942108	EE	On-Demand	Anodyne	HTR1A	45	37
COc1ccccc1N1CC[C@@H](OC(=O)Cc2cscn2)C1=O	ZINC000853942109	EE	On-Demand	Anodyne	HTR1A	45	37
O=C(Cc1cscn1)OCCCN1CCCC1	ZINC000853942152	CD	On-Demand	Anodyne	LTA4H	21	51
O=C(Cc1cscn1)OCCCN1CCCC1	ZINC000853942152	CD	On-Demand	Anodyne	HRH3	62	42
Cc1ccccc1CN1CCC(NC(=O)COC(=O)Cc2cscn2)CC1	ZINC000853942161	GE	On-Demand	Anodyne	SIGMAR1	17	44
Cc1ccccc1CN1CCC(NC(=O)COC(=O)Cc2cscn2)CC1	ZINC000853942161	GE	On-Demand	Anodyne	SSTR5	44	35
Cc1ccccc1CN1CCC(NC(=O)COC(=O)Cc2cscn2)CC1	ZINC000853942161	GE	On-Demand	Anodyne	SCN5A	42	37
Cc1ccccc1CN1CCC(NC(=O)COC(=O)Cc2cscn2)CC1	ZINC000853942161	GE	On-Demand	Anodyne	MCHR1	21	40
C#CCCN(CCOC)C(=O)NCCc1cccc(C(=O)OC)c1	ZINC000853942162	ED	On-Demand	Mild	CRTM	43	32
c1cc(N2CCCC2)nc(N2CCC[C@H](C3CCC3)C2)n1	ZINC000853942264	CG	On-Demand	Anodyne	SORD	60	37
c1cc(N2CCCC2)nc(N2CCC[C@@H](C3CCC3)C2)n1	ZINC000853942265	CG	On-Demand	Anodyne	SORD	60	37
C[C@H](NC(=O)[C@@H](C)OC(=O)Cc1cscn1)c1ccccc1	ZINC000853942271	DE	On-Demand	Anodyne	BMP1	19	42
C[C@H](NC(=O)[C@@H](C)OC(=O)Cc1cscn1)c1ccccc1	ZINC000853942271	DE	On-Demand	Anodyne	CAPN2	44	32
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H](C)c1ccccc1	ZINC000853942273	DE	On-Demand	Anodyne	BMP1	19	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H](C)c1ccccc1	ZINC000853942273	DE	On-Demand	Anodyne	CAPN2	44	32
CCCOc1ccc(OCCOC(=O)Cc2cscn2)cc1	ZINC000853942278	DG	On-Demand	Anodyne	PLA2G4B	72	34
C#CCNC(=O)c1ccc(N2CCC3(CCc4ccccc4O3)CC2)nc1	ZINC000853942285	FF	On-Demand	Mild	HDAC1	19	47
C#CCNC(=O)c1ccc(N2CCC3(CCc4ccccc4O3)CC2)nc1	ZINC000853942285	FF	On-Demand	Mild	SCD1	37	42
C#CCNC(=O)c1ccc(N2CCC3(CCc4ccccc4O3)CC2)nc1	ZINC000853942285	FF	On-Demand	Mild	SCD	63	51
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853942289	FF	On-Demand	Mild	VIPR1	28	43
CCOC(=O)C1CCN(C(=O)COC(=O)Cc2cscn2)CC1	ZINC000853942314	ED	On-Demand	Anodyne	PTR1	46	35
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)Cc1cscn1	ZINC000853942365	CD	On-Demand	Anodyne	BMP1	19	41
CC[C@H](C)NC(=O)[C@H](C)OC(=O)Cc1cscn1	ZINC000853942366	CD	On-Demand	Anodyne	BMP1	19	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)N1c2ccccc2CC[C@H]1C	ZINC000853942388	EF	On-Demand	Anodyne	TPP2	53	34
C[C@H]1CCc2ccccc2N1C(=O)[C@@H](C)OC(=O)Cc1cscn1	ZINC000853942390	EF	On-Demand	Anodyne	TPP2	53	34
O=S(=O)(c1ccccc1N1CCC2(CCc3ccccc3O2)CC1)C(F)F	ZINC000853942412	GI	On-Demand	Anodyne	SCD1	20	40
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA2	87	55
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA6	21	42
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA1	77	55
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA7	56	54
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA13	26	42
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA5B	58	54
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA4	57	53
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA5A	59	54
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA14	43	42
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA12	57	55
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CA9	61	55
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	CYNT	19	42
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	NCE103	23	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	P96878_MYCTU	21	48
NS(=O)(=O)c1ccc(CCNC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942421	GC	On-Demand	Anodyne	A6YCJ1_9METZ	24	47
CC(=O)N1CCc2cc(C(=O)[C@@H](C)OC(=O)Cc3cscn3)ccc21	ZINC000853942431	FE	On-Demand	Anodyne	EIF2AK3	47	33
CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)Cc3cscn3)ccc21	ZINC000853942432	FE	On-Demand	Anodyne	EIF2AK3	47	33
Cc1cc(OCCOC(=O)Cc2cscn2)ccc1C(C)C	ZINC000853942442	DH	On-Demand	Anodyne	PPARD	16	41
c1ccc2c(c1)CCC1(CCN(c3nccc(N4CCCC4)n3)CC1)O2	ZINC000853942456	FG	On-Demand	Anodyne	SORD	47	37
c1ccc2c(c1)CCC1(CCN(c3nccc(N4CCCC4)n3)CC1)O2	ZINC000853942456	FG	On-Demand	Anodyne	SCD	49	43
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1cccc(N2CCCC2=O)c1	ZINC000853942465	FE	On-Demand	Anodyne	GPR142	34	40
NC(=O)c1cc(N2CCC3(CCc4ccccc4O3)CC2)ccn1	ZINC000853942467	DF	On-Demand	Anodyne	SCD1	32	47
NC(=O)c1cc(N2CCC3(CCc4ccccc4O3)CC2)ccn1	ZINC000853942467	DF	On-Demand	Anodyne	SCD	50	47
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853942468	EF	On-Demand	Anodyne	EPHX2	67	40
O=C(Cc1cscn1)OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000853942511	GH	On-Demand	Anodyne	CPT1A	92	40
O=C(Cc1cscn1)OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000853942512	GH	On-Demand	Anodyne	CPT1A	92	40
CCOc1ccc(-c2nc(COC(=O)Cc3cscn3)cs2)cc1OC	ZINC000853942516	GH	On-Demand	Anodyne	DCK	33	44
CCOc1ccc(-c2nc(COC(=O)Cc3cscn3)cs2)cc1OC	ZINC000853942516	GH	On-Demand	Anodyne	PPARD	19	44
COc1ccc([C@@H]2CCCCCN2C(=O)COC(=O)Cc2cscn2)cc1	ZINC000853942518	GG	On-Demand	Anodyne	CPT1A	119	44
C#C[C@H](NC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1)C1CCOCC1	ZINC000853942531	GE	On-Demand	Mild	DGAT1	24	41
C#C[C@@H](NC(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1)C1CCOCC1	ZINC000853942532	GE	On-Demand	Mild	DGAT1	24	41
O=C(Cc1cscn1)OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000853942533	GE	On-Demand	Anodyne	FAAH	26	45
O=C(Cc1cscn1)OCC(=O)N1CCN(Cc2cccc(Cl)c2)CC1	ZINC000853942533	GE	On-Demand	Anodyne	SCN5A	27	43
O=C(Cc1cscn1)OCCCCOc1cccc(C(F)(F)F)c1	ZINC000853942556	FI	On-Demand	Anodyne	GALR3	49	32
O=C(Cc1cscn1)OCCCCOc1cccc(C(F)(F)F)c1	ZINC000853942556	FI	On-Demand	Anodyne	PDS	43	45
C#CCCN(CCOC)C(=O)NC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000853942557	FE	On-Demand	Mild	DGAT1	22	40
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc2c(c1)OCCO2	ZINC000853942579	GD	On-Demand	Anodyne	BMP1	46	34
O=C(Cc1cscn1)OCC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCO2	ZINC000853942638	GE	On-Demand	Anodyne	CPT1A	70	45
O=C(Cc1cscn1)OCC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCO2	ZINC000853942639	GE	On-Demand	Anodyne	CPT1A	70	45
Cc1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cscn2)c1	ZINC000853942644	DF	On-Demand	Anodyne	GPR142	40	44
Cc1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cscn2)c1	ZINC000853942644	DF	On-Demand	Anodyne	KCNK3	48	35
Cc1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cscn2)c1	ZINC000853942644	DF	On-Demand	Anodyne	KCNK9	41	35
Cc1cccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)c1	ZINC000853942645	DF	On-Demand	Anodyne	GPR142	40	44
Cc1cccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)c1	ZINC000853942645	DF	On-Demand	Anodyne	KCNK3	48	35
Cc1cccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)c1	ZINC000853942645	DF	On-Demand	Anodyne	KCNK9	41	35
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	CHRM2	15	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	DRD2	16	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	DRD4	40	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	ACHE	38	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	KCNH2	16	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	CHRM3	19	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	LTA4H	19	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	SIGMAR1	43	52
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	SSTR5	61	38
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	CACNA1B	15	43
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	CCR3	38	43
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	SCN5A	58	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	SLC6A5	23	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	MCHR1	44	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	CACNA1G	24	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853942662	GE	On-Demand	Anodyne	GPR142	39	40
COc1ccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)c(OC)c1	ZINC000853942666	FE	On-Demand	Anodyne	GPR142	28	40
O=C(Cc1cscn1)OCCCOc1cccc(Cl)c1	ZINC000853942681	DG	On-Demand	Anodyne	MAOB	15	42
O=C(COC(=O)Cc1cscn1)NCc1ccc(F)cc1C(F)(F)F	ZINC000853942732	GF	On-Demand	Anodyne	P2RX7	28	49
O=C(COC(=O)Cc1cscn1)NCC1(N2CCOCC2)CCCCC1	ZINC000853942741	GD	On-Demand	Anodyne	HCN1	55	33
O=C(COC(=O)Cc1cscn1)NCC1(N2CCOCC2)CCCCC1	ZINC000853942741	GD	On-Demand	Anodyne	HCN4	51	33
O=C(COC(=O)Cc1cscn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853942757	FD	On-Demand	Anodyne	MTOR	43	34
O=C(COC(=O)Cc1cscn1)Nc1ccc(N2CCOCC2)cc1	ZINC000853942757	FD	On-Demand	Anodyne	STAT6	61	37
C#CCNC(=O)c1ccc(N2CCC(c3ccon3)CC2)nc1	ZINC000853942758	DD	On-Demand	Mild	HPGDS	27	43
CN1CCCC[C@@H]1CCOC(=O)Cc1cscn1	ZINC000853942790	CE	On-Demand	Anodyne	CHRNA10	57	35
CN1CCCC[C@@H]1CCOC(=O)Cc1cscn1	ZINC000853942790	CE	On-Demand	Anodyne	ACKR3	63	32
CN1CCCC[C@H]1CCOC(=O)Cc1cscn1	ZINC000853942791	CE	On-Demand	Anodyne	CHRNA10	57	35
CN1CCCC[C@H]1CCOC(=O)Cc1cscn1	ZINC000853942791	CE	On-Demand	Anodyne	ACKR3	63	32
NS(=O)(=O)c1ccc2c(c1)CCN2C(=O)COC(=O)Cc1cscn1	ZINC000853942807	GC	On-Demand	Anodyne	EIF2AK3	68	37
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	TACR1	18	50
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	BMP1	15	47
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	CCKAR	53	49
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	BRS3	27	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	NMBR	33	49
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	MC5R	40	34
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	MTNR1A	21	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	MMP2	21	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	MMP8	32	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	GRPR	65	36
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	MMP11	56	33
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	GHSR	51	36
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	MMP9	20	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853942828	FE	On-Demand	Anodyne	MC1R	50	33
CC(=O)c1cccc(NC(=O)[C@@H](OC(=O)Cc2cscn2)C(C)C)c1	ZINC000853942834	FG	On-Demand	Anodyne	GPR142	40	44
CC(=O)c1cccc(NC(=O)[C@H](OC(=O)Cc2cscn2)C(C)C)c1	ZINC000853942835	FG	On-Demand	Anodyne	GPR142	40	44
Cc1cc(C(F)(F)F)c(N2CCC3(CCc4ccccc4O3)CC2)nn1	ZINC000853942839	FI	On-Demand	Anodyne	SCD1	35	42
Cc1cc(C(F)(F)F)c(N2CCC3(CCc4ccccc4O3)CC2)nn1	ZINC000853942839	FI	On-Demand	Anodyne	SCD	41	40
COCCN(CCF)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000853942840	GH	On-Demand	Anodyne	RBP4	57	36
COCCN(CCF)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000853942841	GH	On-Demand	Anodyne	RBP4	57	36
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853942854	FG	On-Demand	Anodyne	GPR142	35	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000853942854	FG	On-Demand	Anodyne	PDS	41	41
CN(C)C(=O)c1cc(N2CCC3(CCc4ccccc4O3)CC2)ccn1	ZINC000853942866	FG	On-Demand	Anodyne	SCD1	23	45
CN(C)C(=O)c1cc(N2CCC3(CCc4ccccc4O3)CC2)ccn1	ZINC000853942866	FG	On-Demand	Anodyne	SCD	35	45
CS(=O)(=O)c1cccc(OCCOC(=O)Cc2cscn2)c1	ZINC000853942891	ED	On-Demand	Anodyne	NR1H3	48	37
O=C(Cc1cscn1)OCCCOc1ccc2c(c1)OCO2	ZINC000853942897	DE	On-Demand	Anodyne	EDNRA	30	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853942899	GE	On-Demand	Anodyne	MTOR	50	38
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853942899	GE	On-Demand	Anodyne	STAT6	55	35
Cc1ccccc1CN1CCCN(C(=O)COC(=O)Cc2cscn2)CC1	ZINC000853942927	GE	On-Demand	Anodyne	SCN5A	22	40
O=C(COC(=O)Cc1cscn1)NCc1cccc(C(=O)NC2CC2)c1	ZINC000853942945	FD	On-Demand	Anodyne	PLG	15	42
COCCN(CCF)C(=O)NCCc1cccc(C(=O)OC)c1	ZINC000853942948	ED	On-Demand	Anodyne	CRTM	40	34
c1cc(N2CCCC2)nc(N2CCC(c3ccon3)CC2)n1	ZINC000853942951	CE	On-Demand	Anodyne	SORD	72	41
O=C(COC(=O)Cc1cscn1)NCC1(c2ccccc2)CCCCC1	ZINC000853942966	FG	On-Demand	Anodyne	KCNA3	41	36
COC(=O)C1CCN(C(=O)[C@@H](OC(=O)Cc2cscn2)C(C)C)CC1	ZINC000853942988	FD	On-Demand	Anodyne	PTR1	45	33
COC(=O)C1CCN(C(=O)[C@H](OC(=O)Cc2cscn2)C(C)C)CC1	ZINC000853942989	FD	On-Demand	Anodyne	PTR1	45	33
O=C(NCCCc1nc[nH]n1)NCc1ccc(N2CCN(CC3CC3)CC2)cc1	ZINC000853942999	GD	On-Demand	Clean	CCR3	20	43
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl	ZINC000853943007	GH	On-Demand	Anodyne	BMP1	17	42
C[C@H](NC(=O)[C@@H](C)OC(=O)Cc1cscn1)c1ccc(Cl)cc1Cl	ZINC000853943009	GH	On-Demand	Anodyne	BMP1	17	42
CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)Cc2cscn2)C(C)C)c1	ZINC000853943032	GF	On-Demand	Anodyne	GPR142	39	43
CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)Cc2cscn2)C(C)C)c1	ZINC000853943033	GF	On-Demand	Anodyne	GPR142	39	43
O=C(COC(=O)Cc1cscn1)NCC1(c2ccccc2)CC1	ZINC000853943037	EE	On-Demand	Anodyne	KCNA3	42	36
NC(=O)c1cc(Cl)nnc1N1CCC2(CCc3ccccc3O2)CC1	ZINC000853943054	FF	On-Demand	Anodyne	SCD1	21	44
NC(=O)c1cc(Cl)nnc1N1CCC2(CCc3ccccc3O2)CC1	ZINC000853943054	FF	On-Demand	Anodyne	SCD	34	44
O=C(Cc1cscn1)OCCCn1c(O)nc2ccccc21	ZINC000853943058	DE	On-Demand	Anodyne	IMDH_CRYPV	18	41
O=C(COC(=O)Cc1cscn1)NCc1cccc(OCC(F)(F)F)c1	ZINC000853943077	GE	On-Demand	Anodyne	PDS	39	40
O=C(Cc1cscn1)OCCOc1ccc(C(F)(F)F)cc1	ZINC000853943090	EG	On-Demand	Anodyne	PPARD	37	42
O=C(Cc1cscn1)OCCCOc1cccc(C(F)(F)F)c1	ZINC000853943095	EH	On-Demand	Anodyne	GALR3	48	31
O=C(Cc1cscn1)OCCCOc1cccc(C(F)(F)F)c1	ZINC000853943095	EH	On-Demand	Anodyne	PDS	43	45
O=C(Cc1cscn1)OCC(=O)N1CCN(c2cccc(Cl)c2)CC1	ZINC000853943106	GE	On-Demand	Anodyne	HTR1A	15	42
O=C(Cc1cscn1)OCc1cccc(C(=O)N2CCCCC2)c1	ZINC000853943110	EG	On-Demand	Anodyne	PARP1	15	45
O=C(Cc1cscn1)OCc1cccc(C(=O)N2CCCCC2)c1	ZINC000853943110	EG	On-Demand	Anodyne	HPGD	40	38
COC(=O)c1cccc(CCNC(=O)NCCS(=O)(=O)CC(F)(F)F)c1	ZINC000853943121	GD	On-Demand	Anodyne	PTPRB	17	43
N#Cc1ccc(OC2CCC(NC(=O)N[C@H]3C=CCC3)CC2)nc1	ZINC000853943143	EF	On-Demand	Mild	DGAT1	23	41
N#Cc1ccc(OC2CCC(NC(=O)N[C@@H]3C=CCC3)CC2)nc1	ZINC000853943144	EF	On-Demand	Mild	DGAT1	23	41
CCOc1ccc([C@@H]2CCCN2C(=O)COC(=O)Cc2cscn2)cc1	ZINC000853943154	FF	On-Demand	Anodyne	CPT1A	105	40
COC(=O)c1sc(N2CCC3(CCc4ccccc4O3)CC2)nc1Cl	ZINC000853943169	GH	On-Demand	Anodyne	SCD1	17	41
COC(=O)c1sc(N2CCC3(CCc4ccccc4O3)CC2)nc1Cl	ZINC000853943169	GH	On-Demand	Anodyne	SCD	29	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)N[C@H](C)c1ccc(F)cc1	ZINC000853943180	EF	On-Demand	Anodyne	BMP1	17	42
C[C@H](NC(=O)[C@@H](C)OC(=O)Cc1cscn1)c1ccc(F)cc1	ZINC000853943183	EF	On-Demand	Anodyne	BMP1	17	42
C[C@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943197	CD	On-Demand	Anodyne	CPT1A	63	38
C[C@@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943198	CD	On-Demand	Anodyne	CPT1A	63	38
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1cccc(S(=O)(=O)N(C)C)c1	ZINC000853943254	GD	On-Demand	Anodyne	GPR142	31	42
O=C(Cc1cscn1)OCC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000853943258	ED	On-Demand	Bother	EIF2AK3	61	35
COc1ccccc1NC(=O)[C@@H](OC(=O)Cc1cscn1)C(C)C	ZINC000853943294	EF	On-Demand	Anodyne	GPR142	37	45
O=C(Cc1cscn1)OCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000853943325	FE	On-Demand	Anodyne	GRIN2B	32	41
O=C(Cc1cscn1)OCC(=O)N1CCC(OCc2ccccc2)CC1	ZINC000853943325	FE	On-Demand	Anodyne	SCN5A	41	38
O=C(Cc1cscn1)OCCCOc1ccc([N+](=O)[O-])cc1	ZINC000853943329	DF	On-Demand	Bother	ACR	17	47
COC(=O)c1cccc(CCNC(=O)NCCN(C)OC)c1	ZINC000853943350	DC	On-Demand	Anodyne	MTNR1A	40	39
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)Cc2cscn2)c(OC)c1	ZINC000853943351	GF	On-Demand	Anodyne	CPT1A	88	40
O=C(COC(=O)Cc1cscn1)NCCOc1cccc(C(F)(F)F)c1	ZINC000853943363	GE	On-Demand	Anodyne	PDS	44	46
N#Cc1cc2ccccc2nc1N1CCC(c2ccon2)CC1	ZINC000853943366	DG	On-Demand	Mild	SMO	30	40
Cc1nn(-c2ccccc2)c(C)c1CNC(=O)COC(=O)Cc1cscn1	ZINC000853943368	GE	On-Demand	Anodyne	P2RX7	28	56
O=[N+]([O-])c1c(F)cccc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853943385	DG	On-Demand	Bother	LIPG	49	44
O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3ccccc3)C2)c(F)c1	ZINC000853943406	DG	On-Demand	Bother	LIPG	50	45
O=C1CCCN1C[C@@H]1CCN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)C1	ZINC000853943419	GF	On-Demand	Anodyne	LIPG	23	40
O=C1CCCN1C[C@H]1CCN(c2ccc(F)cc2S(=O)(=O)C(F)(F)F)C1	ZINC000853943420	GF	On-Demand	Anodyne	LIPG	23	40
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCCn1ccnc1)c1ccc(F)cc1F	ZINC000853943448	GG	On-Demand	Anodyne	TBXAS1	42	40
CC(=O)C(=O)COC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943458	FE	On-Demand	Clean	PAPA1_CARPA	32	40
CC(=O)C(=O)COC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943459	FE	On-Demand	Clean	PAPA1_CARPA	32	40
COc1ccc([C@@H]2CCCN2C(=O)COC(=O)Cc2cscn2)cc1OC	ZINC000853943475	GF	On-Demand	Anodyne	CPT1A	75	41
O=C(Cc1cscn1)OCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1	ZINC000853943535	GE	On-Demand	Anodyne	ADAM17	16	43
Fc1nc(F)c(F)c(N2CCC3(CCc4ccccc4O3)CC2)c1F	ZINC000853943554	FI	On-Demand	Anodyne	SCD1	22	41
Fc1nc(F)c(F)c(N2CCC3(CCc4ccccc4O3)CC2)c1F	ZINC000853943554	FI	On-Demand	Anodyne	SCD	33	41
COC(=O)c1sc(N2CCC(c3ccon3)CC2)nc1Cl	ZINC000853943587	EF	On-Demand	Anodyne	PARE	68	34
CCCOc1cccc(CNC(=O)COC(=O)Cc2cscn2)c1	ZINC000853943600	EE	On-Demand	Anodyne	UPP1	15	40
CCCOc1cccc(CNC(=O)COC(=O)Cc2cscn2)c1	ZINC000853943600	EE	On-Demand	Anodyne	MTNR1A	29	41
CCCOc1cccc(CNC(=O)COC(=O)Cc2cscn2)c1	ZINC000853943600	EE	On-Demand	Anodyne	PDS	46	37
Nc1ncnc2c1ncn2CCCOC(=O)Cc1cscn1	ZINC000853943601	DD	On-Demand	Anodyne	AHCY	77	42
Nc1ncnc2c1ncn2CCCOC(=O)Cc1cscn1	ZINC000853943601	DD	On-Demand	Anodyne	OXGR1	100	35
C[C@@H](OC(=O)Cc1cscn1)C(=O)N1CCCCC1	ZINC000853943611	CD	On-Demand	Anodyne	DPP7	51	33
C[C@H](CCc1ccccc1)OC(=O)Cc1cscn1	ZINC000853943619	CG	On-Demand	Anodyne	BMP1	16	42
C[C@H](CCc1ccccc1)OC(=O)Cc1cscn1	ZINC000853943619	CG	On-Demand	Anodyne	GPR142	41	39
C[C@@H](CCc1ccccc1)OC(=O)Cc1cscn1	ZINC000853943620	CG	On-Demand	Anodyne	BMP1	16	42
C[C@@H](CCc1ccccc1)OC(=O)Cc1cscn1	ZINC000853943620	CG	On-Demand	Anodyne	GPR142	41	39
N#Cc1ccc(OC2CCC(NC(=O)NCc3ncccn3)CC2)nc1	ZINC000853943649	FD	On-Demand	Mild	TNKS	44	38
O=C(Cc1cscn1)OCC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000853943661	FD	On-Demand	Anodyne	FAAH	21	42
C#CCNC(=O)[C@@H](C)OC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943669	GE	On-Demand	Mild	PAPA1_CARPA	38	45
C#CCNC(=O)[C@@H](C)OC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943670	GE	On-Demand	Mild	PAPA1_CARPA	38	45
C#CCNC(=O)[C@H](C)OC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943671	GE	On-Demand	Mild	PAPA1_CARPA	38	45
C#CCNC(=O)[C@H](C)OC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943672	GE	On-Demand	Mild	PAPA1_CARPA	38	45
C#CCNC(=O)COC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943713	GD	On-Demand	Mild	PAPA1_CARPA	35	42
C#CCNC(=O)COC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853943714	GD	On-Demand	Mild	PAPA1_CARPA	35	42
C[C@@H](NC(=O)N1CCC2=C(CCC(=O)N2)C1)c1ccc(-c2ccc(F)cc2)cc1	ZINC000853943746	GI	On-Demand	Anodyne	CACNA1H	15	43
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853943752	EF	On-Demand	Bother	LIPG	53	45
CCC(=O)N1CCc2cc(C(=O)COC(=O)Cc3cscn3)ccc21	ZINC000853943791	FE	On-Demand	Anodyne	EIF2AK3	81	36
O=C(COC(=O)Cc1cscn1)Nc1ccc(CN2CCOCC2)cc1	ZINC000853943801	GD	On-Demand	Anodyne	EPHX2	15	44
Fc1cccc(N2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853943822	CH	On-Demand	Anodyne	SCD	55	44
COc1ccccc1NC(=O)[C@@H](C)OC(=O)Cc1cscn1	ZINC000853943824	DE	On-Demand	Anodyne	GPR142	38	46
CCc1ccc([C@H](C)NC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853943826	EF	On-Demand	Anodyne	ACACA	15	40
CCc1ccc([C@H](C)NC(=O)COC(=O)Cc2cscn2)cc1	ZINC000853943826	EF	On-Demand	Anodyne	ACACB	16	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC2(CCc3ccccc3O2)CC1	ZINC000853943830	GG	On-Demand	Bother	SCD1	16	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC2(CCc3ccccc3O2)CC1	ZINC000853943830	GG	On-Demand	Bother	WDR5	35	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853943841	FG	On-Demand	Anodyne	P2RY1	57	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC000853943841	FG	On-Demand	Anodyne	EPHX2	44	38
CON(C)CCNC(=O)N[C@@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000853943846	FG	On-Demand	Anodyne	RBP4	55	37
CON(C)CCNC(=O)N[C@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000853943847	FG	On-Demand	Anodyne	RBP4	55	37
CON(C)CCNC(=O)N[C@@H]1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000853943848	FG	On-Demand	Anodyne	RBP4	55	37
CON(C)CCNC(=O)N[C@H]1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000853943849	FG	On-Demand	Anodyne	RBP4	55	37
COC(=O)c1cccc(N2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853943875	EG	On-Demand	Anodyne	SCD1	31	49
COC(=O)c1cccc(N2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853943875	EG	On-Demand	Anodyne	SCD	53	49
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943885	DC	On-Demand	Anodyne	TRHR	49	33
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943885	DC	On-Demand	Anodyne	CPT1A	53	37
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943885	DC	On-Demand	Anodyne	CPT2	44	33
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943886	DC	On-Demand	Anodyne	TRHR	49	33
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943886	DC	On-Demand	Anodyne	CPT1A	53	37
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853943886	DC	On-Demand	Anodyne	CPT2	44	33
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)Cc2cscn2)CC1	ZINC000853943896	ED	On-Demand	Anodyne	PTR1	47	33
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)Cc2cscn2)CC1	ZINC000853943897	ED	On-Demand	Anodyne	PTR1	47	33
FC(F)(F)c1nnc2ccc(N3CCC4(CCc5ccccc5O4)CC3)nn12	ZINC000853943905	GH	On-Demand	Anodyne	SCD	56	44
CC(C)(C)OC(=O)N[C@@H](C(=O)OCc1cccnc1)c1ccc(F)cc1F	ZINC000853943926	GH	On-Demand	Anodyne	CYSP_TRYCR	19	40
Fc1nc(F)c(F)c(N2CC[C@@H](Oc3ccccc3)C2)c1F	ZINC000853943957	DG	On-Demand	Anodyne	PDE3B	43	38
COCCN(CCF)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000853943990	FH	On-Demand	Anodyne	CCR2	49	36
O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3ccccc3)C2)c2nonc12	ZINC000853943997	EF	On-Demand	Bother	GSTM2	106	42
O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3ccccc3)C2)c2nonc12	ZINC000853943997	EF	On-Demand	Bother	GSTP1	65	42
O=C(COC(=O)Cc1cscn1)N[C@@H]1CCOc2ccccc21	ZINC000853944046	ED	On-Demand	Anodyne	LUXR	51	35
O=C(COC(=O)Cc1cscn1)N[C@@H]1CCOc2ccccc21	ZINC000853944046	ED	On-Demand	Anodyne	TRAR	63	36
O=C(COC(=O)Cc1cscn1)N[C@H]1CCOc2ccccc21	ZINC000853944047	ED	On-Demand	Anodyne	LUXR	51	35
O=C(COC(=O)Cc1cscn1)N[C@H]1CCOc2ccccc21	ZINC000853944047	ED	On-Demand	Anodyne	TRAR	63	36
C#CCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944078	EF	On-Demand	Mild	PAPA1_CARPA	34	41
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cscn2)c1	ZINC000853944079	EE	On-Demand	Anodyne	GPR142	41	45
C#CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944080	EF	On-Demand	Mild	PAPA1_CARPA	34	41
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)c1	ZINC000853944082	EE	On-Demand	Anodyne	GPR142	41	45
c1ccc2c(c1)CCC1(CCN(c3ncnc4c3CCC4)CC1)O2	ZINC000853944114	DG	On-Demand	Anodyne	SCD	41	39
Nc1nc(Cl)cc(N2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853944129	EG	On-Demand	Anodyne	HRH4	30	42
Nc1nc(Cl)cc(N2CCC3(CCc4ccccc4O3)CC2)n1	ZINC000853944129	EG	On-Demand	Anodyne	SCD	44	41
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853944132	GF	On-Demand	Anodyne	LIPG	49	42
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC#N)c1ccc(F)cc1F	ZINC000853944196	EF	On-Demand	Mild	PAPA1_CARPA	39	47
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC1(C#N)CC1)c1ccc(F)cc1F	ZINC000853944209	FG	On-Demand	Mild	PAPA1_CARPA	30	42
CN(C)C(=O)c1cc(N2CC[C@@H](Oc3ccccc3)C2)ccn1	ZINC000853944227	DE	On-Demand	Anodyne	PDE3B	43	38
CN(C)C(=O)c1cc(N2CC[C@@H](Oc3ccccc3)C2)ccn1	ZINC000853944227	DE	On-Demand	Anodyne	SCD1	23	43
CCN(Cc1ccccc1)c1ccc(C=NOCC(N)=O)cc1	ZINC000853944249	DF	On-Demand	Mild	G6PC	44	36
COCCN(CCF)C(=O)N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000853944324	FI	On-Demand	Anodyne	ACACA	25	46
COCCN(CCF)C(=O)N[C@@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000853944324	FI	On-Demand	Anodyne	ACACB	24	42
O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853944325	FG	On-Demand	Bother	EPHX2	16	41
O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853944325	FG	On-Demand	Bother	LIPG	52	45
COCCN(CCF)C(=O)N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000853944326	FI	On-Demand	Anodyne	ACACA	25	46
COCCN(CCF)C(=O)N[C@H](C)c1ccc(-c2ccc(F)cc2)cc1	ZINC000853944326	FI	On-Demand	Anodyne	ACACB	24	42
N#Cc1sc(N2CC[C@@H](Oc3ccccc3)C2)nc1Cl	ZINC000853944367	DG	On-Demand	Mild	PDE3A	39	42
N#Cc1sc(N2CC[C@@H](Oc3ccccc3)C2)nc1Cl	ZINC000853944367	DG	On-Demand	Mild	PDE3B	47	42
O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000853944376	EG	On-Demand	Bother	PDE3A	26	40
O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000853944376	EG	On-Demand	Bother	PDE3B	31	40
O=[N+]([O-])c1ccc(N2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])c1	ZINC000853944376	EG	On-Demand	Bother	LIPG	42	41
CC(C)(C#N)CCCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944413	GI	On-Demand	Mild	PAPA1_CARPA	35	41
COc1cc(F)c([N+](=O)[O-])c(N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853944416	EG	On-Demand	Bother	PDE3B	42	39
COc1cc(F)c([N+](=O)[O-])c(N2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000853944416	EG	On-Demand	Bother	LIPG	48	42
CC(C)(C#N)CCCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944417	GI	On-Demand	Mild	PAPA1_CARPA	35	41
C[C@@H](NC(=O)N1CC[C@@H](N2CCOC2=O)C1)c1ccc(-c2ccc(F)cc2)cc1	ZINC000853944429	GH	On-Demand	Anodyne	DPP4	15	43
C[C@@H](NC(=O)N1CC[C@H](N2CCOC2=O)C1)c1ccc(-c2ccc(F)cc2)cc1	ZINC000853944433	GH	On-Demand	Anodyne	DPP4	15	43
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC(=O)NCC#N)c1ccc(F)cc1F	ZINC000853944448	GD	On-Demand	Mild	PAPA1_CARPA	42	50
O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853944487	EI	On-Demand	Bother	LIPG	45	41
COc1cc(N2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])cc1OC	ZINC000853944523	EG	On-Demand	Clean	PDE3A	48	49
COc1cc(N2CC[C@@H](Oc3ccccc3)C2)c([N+](=O)[O-])cc1OC	ZINC000853944523	EG	On-Demand	Clean	PDE3B	55	49
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944629	DG	On-Demand	Anodyne	PAPA1_CARPA	33	41
CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944629	DG	On-Demand	Anodyne	CTSK	19	41
COC(=O)c1cccc(N2CC[C@@H](Oc3ccccc3)C2)n1	ZINC000853944643	CF	On-Demand	Anodyne	PDE3B	43	39
COC(=O)c1cccc(N2CC[C@@H](Oc3ccccc3)C2)n1	ZINC000853944643	CF	On-Demand	Anodyne	SCD1	29	46
N#Cc1ncc(Br)cc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853944680	EG	On-Demand	Mild	PDE3B	42	39
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC(=O)NCC1CC1)c1ccc(F)cc1F	ZINC000853944687	GF	On-Demand	Anodyne	CACNA1I	44	36
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCCCC#N)c1ccc(F)cc1F	ZINC000853944757	FH	On-Demand	Mild	PAPA1_CARPA	37	44
Cc1cc(N2CC[C@@H](Oc3ccccc3)C2)nc(N)n1	ZINC000853944798	CE	On-Demand	Anodyne	PDE3A	41	39
Cc1cc(N2CC[C@@H](Oc3ccccc3)C2)nc(N)n1	ZINC000853944798	CE	On-Demand	Anodyne	DCK	47	42
Cc1cc(N2CC[C@@H](Oc3ccccc3)C2)nc(N)n1	ZINC000853944798	CE	On-Demand	Anodyne	HRH4	55	43
Cc1cc(N2CC[C@@H](Oc3ccccc3)C2)nc(N)n1	ZINC000853944798	CE	On-Demand	Anodyne	PDE3B	46	39
Cc1cc(N2CC[C@@H](Oc3ccccc3)C2)nc(N)n1	ZINC000853944798	CE	On-Demand	Anodyne	SCD1	17	43
COC(=O)c1cnc(N2CC[C@@H](Oc3ccccc3)C2)cc1C(F)(F)F	ZINC000853944847	FH	On-Demand	Anodyne	PDE3A	38	41
COC(=O)c1cnc(N2CC[C@@H](Oc3ccccc3)C2)cc1C(F)(F)F	ZINC000853944847	FH	On-Demand	Anodyne	PDE3B	44	37
COC(=O)c1cnc(N2CC[C@@H](Oc3ccccc3)C2)cc1C(F)(F)F	ZINC000853944847	FH	On-Demand	Anodyne	RBP4	52	35
COC(=O)c1cnc(N2CC[C@@H](Oc3ccccc3)C2)cc1C(F)(F)F	ZINC000853944847	FH	On-Demand	Anodyne	SCD1	54	44
COC(=O)c1cnc(N2CC[C@@H](Oc3ccccc3)C2)cc1C(F)(F)F	ZINC000853944847	FH	On-Demand	Anodyne	LIPG	54	44
COC(=O)c1cnc(N2CC[C@@H](Oc3ccccc3)C2)cc1C(F)(F)F	ZINC000853944847	FH	On-Demand	Anodyne	SFRP1	47	33
COC(=O)c1cnc(N2CC[C@@H](Oc3ccccc3)C2)cc1C(F)(F)F	ZINC000853944847	FH	On-Demand	Anodyne	SCD	35	44
C[C@H](C#N)OCCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944905	GG	On-Demand	Mild	PAPA1_CARPA	33	42
C[C@H](C#N)OCCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944910	GG	On-Demand	Mild	PAPA1_CARPA	33	42
C[C@@H](C#N)OCCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944912	GG	On-Demand	Mild	PAPA1_CARPA	33	42
C[C@@H](C#N)OCCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853944914	GG	On-Demand	Mild	PAPA1_CARPA	33	42
NC(=O)c1cc(N2CC[C@@H](CN3CCCC3=O)C2)ccn1	ZINC000853944929	CC	On-Demand	Anodyne	SIRT3	54	36
NC(=O)c1cc(N2CC[C@@H](CN3CCCC3=O)C2)ccn1	ZINC000853944929	CC	On-Demand	Anodyne	SIRT2	43	36
NC(=O)c1cc(N2CC[C@@H](CN3CCCC3=O)C2)ccn1	ZINC000853944929	CC	On-Demand	Anodyne	SIRT1	40	36
NC(=O)c1cc(N2CC[C@H](CN3CCCC3=O)C2)ccn1	ZINC000853944930	CC	On-Demand	Anodyne	SIRT3	54	36
NC(=O)c1cc(N2CC[C@H](CN3CCCC3=O)C2)ccn1	ZINC000853944930	CC	On-Demand	Anodyne	SIRT2	43	36
NC(=O)c1cc(N2CC[C@H](CN3CCCC3=O)C2)ccn1	ZINC000853944930	CC	On-Demand	Anodyne	SIRT1	40	36
COc1ccc2c(N3CC[C@H](CN4CCCC4=O)C3)ccnc2c1	ZINC000853944977	EF	On-Demand	Anodyne	PDE3B	43	36
COc1ccc2c(N3CC[C@@H](CN4CCCC4=O)C3)ccnc2c1	ZINC000853944978	EF	On-Demand	Anodyne	PDE3B	43	36
Cc1cc(C(F)(F)F)c(N2CC[C@@H](Oc3ccccc3)C2)nn1	ZINC000853944982	DG	On-Demand	Anodyne	PDE3A	43	48
Cc1cc(C(F)(F)F)c(N2CC[C@@H](Oc3ccccc3)C2)nn1	ZINC000853944982	DG	On-Demand	Anodyne	PDE3B	49	41
Cc1cc(C(F)(F)F)c(N2CC[C@@H](Oc3ccccc3)C2)nn1	ZINC000853944982	DG	On-Demand	Anodyne	SCD1	44	45
Cc1cc(C(F)(F)F)c(N2CC[C@@H](Oc3ccccc3)C2)nn1	ZINC000853944982	DG	On-Demand	Anodyne	LIPG	46	41
Cc1cc(C(F)(F)F)c(N2CC[C@@H](Oc3ccccc3)C2)nn1	ZINC000853944982	DG	On-Demand	Anodyne	SCD	24	45
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC(=O)NCCC#N)c1ccc(F)cc1F	ZINC000853945011	GE	On-Demand	Mild	PAPA1_CARPA	35	44
CC(C)(C#N)CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853945030	GI	On-Demand	Mild	PAPA1_CARPA	36	42
CC(C)(C#N)CCOC(=O)[C@H](NC(=O)OC(C)(C)C)c1ccc(F)cc1F	ZINC000853945033	GI	On-Demand	Mild	PAPA1_CARPA	36	42
c1ccc(O[C@@H]2CCN(c3nccc(N4CCCC4)n3)C2)cc1	ZINC000853945089	DF	On-Demand	Anodyne	PDE3B	43	37
c1ccc(O[C@@H]2CCN(c3nccc(N4CCCC4)n3)C2)cc1	ZINC000853945089	DF	On-Demand	Anodyne	SORD	40	36
c1ccc(O[C@@H]2CCN(c3nccc(N4CCCC4)n3)C2)cc1	ZINC000853945089	DF	On-Demand	Anodyne	SCD1	25	41
CCOc1ccccc1NC(=O)[C@H](C)OC(=O)C1(OCC)CCOCC1	ZINC000853945091	FF	On-Demand	Anodyne	HCN1	49	41
CCOc1ccccc1NC(=O)[C@H](C)OC(=O)C1(OCC)CCOCC1	ZINC000853945091	FF	On-Demand	Anodyne	HCN4	40	33
CCOc1ccccc1NC(=O)[C@@H](C)OC(=O)C1(OCC)CCOCC1	ZINC000853945093	FF	On-Demand	Anodyne	HCN1	49	41
CCOc1ccccc1NC(=O)[C@@H](C)OC(=O)C1(OCC)CCOCC1	ZINC000853945093	FF	On-Demand	Anodyne	HCN4	40	33
CCOc1ccc(OCCOC(=O)C2(OCC)CCOCC2)cc1	ZINC000853945105	EF	On-Demand	Anodyne	MMP13	23	41
NC(=O)c1cc(Cl)nnc1N1CC[C@H](CN2CCCC2=O)C1	ZINC000853945116	DC	On-Demand	Anodyne	SIRT3	44	35
CCOc1ccccc1NC(=O)COC(=O)C1(OCC)CCOCC1	ZINC000853945117	FE	On-Demand	Anodyne	HCN1	50	41
CCOc1ccccc1NC(=O)COC(=O)C1(OCC)CCOCC1	ZINC000853945117	FE	On-Demand	Anodyne	HCN4	40	32
NC(=O)c1cc(Cl)nnc1N1CC[C@@H](CN2CCCC2=O)C1	ZINC000853945118	DC	On-Demand	Anodyne	SIRT3	44	35
Cc1nc(N2CC[C@@H](Oc3ccccc3)C2)c2cnn(C)c2n1	ZINC000853945120	DE	On-Demand	Anodyne	PDE3A	42	40
Cc1nc(N2CC[C@@H](Oc3ccccc3)C2)c2cnn(C)c2n1	ZINC000853945120	DE	On-Demand	Anodyne	PDE3B	49	40
O=S(=O)(c1ccccc1N1CC[C@@H](Oc2ccccc2)C1)C(F)F	ZINC000853945139	FG	On-Demand	Anodyne	LIPG	39	40
c1ccc(O[C@@H]2CCN(c3ncnc4c3CCC4)C2)cc1	ZINC000853945157	CF	On-Demand	Anodyne	PDE3A	51	47
c1ccc(O[C@@H]2CCN(c3ncnc4c3CCC4)C2)cc1	ZINC000853945157	CF	On-Demand	Anodyne	DCK	45	37
c1ccc(O[C@@H]2CCN(c3ncnc4c3CCC4)C2)cc1	ZINC000853945157	CF	On-Demand	Anodyne	PDE3B	57	47
CCOc1ccccc1COC(=O)C1(OCC)CCOCC1	ZINC000853945180	DF	On-Demand	Anodyne	HCN1	49	39
CCOc1ccccc1COC(=O)C1(OCC)CCOCC1	ZINC000853945180	DF	On-Demand	Anodyne	HCN4	40	31
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853945296	GE	On-Demand	Anodyne	EPHX2	87	41
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC1(CC#N)CC1)c1ccc(F)cc1F	ZINC000853945304	GH	On-Demand	Mild	PAPA1_CARPA	31	43
O=C(Cc1cscn1)O[C@@H]1CCOC1=O	ZINC000853945315	BC	On-Demand	Anodyne	TRAR	57	32
O=C(Cc1cscn1)O[C@H]1CCOC1=O	ZINC000853945316	BC	On-Demand	Anodyne	TRAR	57	32
Nc1nc(Cl)cc(N2CC[C@@H](CN3CCCC3=O)C2)n1	ZINC000853945350	CD	On-Demand	Anodyne	HRH4	49	43
Nc1nc(Cl)cc(N2CC[C@H](CN3CCCC3=O)C2)n1	ZINC000853945351	CD	On-Demand	Anodyne	HRH4	49	43
Cc1cc(N2CC[C@H](CN3CCCC3=O)C2)nc(N)n1	ZINC000853945359	CC	On-Demand	Anodyne	HRH4	51	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	MME	51	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	FCER2	46	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	BMP1	21	45
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	PAPA1_CARPA	43	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	CYSP_TRYCR	47	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	TIMP3	41	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	CAPNS1	59	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	HLA-DRB1	46	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	CAPN1	58	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	CAPN2	43	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	ACE2	46	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	MC1R	53	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	PLM2_PLAFA	59	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	NPFFR1	46	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945368	ED	On-Demand	Anodyne	GPR142	78	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	MME	51	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	FCER2	46	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	BMP1	21	45
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	PAPA1_CARPA	43	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	CYSP_TRYCR	47	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	TIMP3	41	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	CAPNS1	59	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	HLA-DRB1	46	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	CAPN1	58	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	CAPN2	43	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	ACE2	46	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	MC1R	53	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	PLM2_PLAFA	59	33
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	NPFFR1	46	30
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cscn1	ZINC000853945369	ED	On-Demand	Anodyne	GPR142	78	45
O=C(Cc1cscn1)OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000853945370	GD	On-Demand	Bother	SSTR1	42	43
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccc(F)cc1	ZINC000853945380	DE	On-Demand	Anodyne	BMP1	17	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA2	76	49
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA1	68	49
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA7	49	49
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA13	18	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA5B	36	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA4	49	47
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA5A	36	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA14	44	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA12	47	46
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CA9	53	46
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	CYNT	19	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	P96878_MYCTU	17	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000853945395	GC	On-Demand	Anodyne	A6YCJ1_9METZ	16	44
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853945407	ED	On-Demand	Anodyne	FKBP1A	41	38
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853945407	ED	On-Demand	Anodyne	CPT1A	47	36
O=C1CCCN1C[C@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853945423	ED	On-Demand	Bother	GSTM2	89	42
O=C1CCCN1C[C@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853945423	ED	On-Demand	Bother	GSTP1	47	42
O=C1CCCN1C[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853945424	ED	On-Demand	Bother	GSTM2	89	42
O=C1CCCN1C[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853945424	ED	On-Demand	Bother	GSTP1	47	42
O=C(COC(=O)Cc1cscn1)NCc1ccccc1CN1CCOCC1	ZINC000853945425	GD	On-Demand	Anodyne	SCN5A	42	38
C[C@@H](OC(=O)Cc1cscn1)C(=O)N1CCc2ccccc2C1	ZINC000853945465	EE	On-Demand	Anodyne	DPP8	22	42
CC[C@@H](C)[C@@H](NC(=O)COC(=O)Cc1cscn1)C(=O)OC	ZINC000853945469	EC	On-Demand	Anodyne	BMP1	19	43
CC[C@@H](C)[C@H](NC(=O)COC(=O)Cc1cscn1)C(=O)OC	ZINC000853945470	EC	On-Demand	Anodyne	BMP1	19	43
COc1ccc(CNC(=O)[C@H](C)OC(=O)Cc2cscn2)cc1OC	ZINC000853945479	FD	On-Demand	Anodyne	GPR142	33	40
Fc1cnc(N2CCC3(CCc4ccccc4O3)CC2)cn1	ZINC000853945484	CF	On-Demand	Anodyne	SCD	54	43
COC(=O)c1sc(N2CC[C@H](CN3CCCC3=O)C2)nc1Cl	ZINC000853945488	EE	On-Demand	Anodyne	PARE	96	42
COC(=O)c1sc(N2CC[C@@H](CN3CCCC3=O)C2)nc1Cl	ZINC000853945489	EE	On-Demand	Anodyne	PARE	96	42
O=C(COC(=O)Cc1cscn1)NCC1(c2ccccc2)CCCC1	ZINC000853945491	FF	On-Demand	Anodyne	KCNA3	42	37
OC[C@@H](Nc1nccc(N2CCCC2)n1)c1cccc(Cl)c1Cl	ZINC000853945492	FH	On-Demand	Anodyne	SORD	55	37
OC[C@H](Nc1nccc(N2CCCC2)n1)c1cccc(Cl)c1Cl	ZINC000853945493	FH	On-Demand	Anodyne	SORD	55	37
O=C1CCCN1C[C@@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000853945501	FG	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	33
O=C1CCCN1C[C@H]1CCN(c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000853945502	FG	On-Demand	Anodyne	Q8MHZ5_SHEEP	51	33
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)c1	ZINC000853945547	EE	On-Demand	Anodyne	GPR142	41	45
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cscn2)c1	ZINC000853945548	EE	On-Demand	Anodyne	GPR142	41	45
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCCC#N)c1ccc(F)cc1F	ZINC000853945552	FG	On-Demand	Mild	PAPA1_CARPA	37	44
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccccc1	ZINC000853945559	DD	On-Demand	Anodyne	BMP1	20	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccccc1	ZINC000853945559	DD	On-Demand	Anodyne	CAPNS1	42	31
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccccc1	ZINC000853945559	DD	On-Demand	Anodyne	CAPN2	58	36
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccccc1	ZINC000853945559	DD	On-Demand	Anodyne	AMP1_PLAFQ	39	40
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccccc1	ZINC000853945559	DD	On-Demand	Anodyne	GPR142	44	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccccc1	ZINC000853945559	DD	On-Demand	Anodyne	PDS	55	38
CC(C)(C)OC(=O)N[C@@H](C(=O)OCCn1cccn1)c1ccc(F)cc1F	ZINC000853945566	GF	On-Demand	Anodyne	AMP1_PLAFQ	19	41
COC(=O)C1CCN(C(=O)COC(=O)Cc2cscn2)CC1	ZINC000853945578	EC	On-Demand	Anodyne	PTR1	51	36
Fc1cc(N2CC[C@@H](Oc3ccccc3)C2)ncn1	ZINC000853945592	CE	On-Demand	Anodyne	PDE3A	50	47
Fc1cc(N2CC[C@@H](Oc3ccccc3)C2)ncn1	ZINC000853945592	CE	On-Demand	Anodyne	DCK	62	51
Fc1cc(N2CC[C@@H](Oc3ccccc3)C2)ncn1	ZINC000853945592	CE	On-Demand	Anodyne	PDE3B	55	47
Fc1ncnc(N2CC[C@@H](Oc3ccccc3)C2)c1Br	ZINC000853945659	EG	On-Demand	Anodyne	PDE3A	51	48
Fc1ncnc(N2CC[C@@H](Oc3ccccc3)C2)c1Br	ZINC000853945659	EG	On-Demand	Anodyne	DCK	55	42
Fc1ncnc(N2CC[C@@H](Oc3ccccc3)C2)c1Br	ZINC000853945659	EG	On-Demand	Anodyne	PDE3B	56	48
N#Cc1c(NC(=O)COC(=O)Cc2cscn2)sc2c1CCCCC2	ZINC000853945779	GG	On-Demand	Mild	VIPR1	32	50
O=C1CCCN1C[C@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000853945787	FG	On-Demand	Anodyne	Q8MHZ5_SHEEP	59	33
O=C1CCCN1C[C@@H]1CCN(c2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000853945789	FG	On-Demand	Anodyne	Q8MHZ5_SHEEP	59	33
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	MMP3	16	40
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	NR1H3	18	44
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	MMP10	24	40
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	NR1H2	15	44
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	AKR1C3	19	47
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	SFRP1	83	39
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	WNT3	53	35
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2)c1)N1CCCC1	ZINC000853945790	GI	On-Demand	Anodyne	L3MBTL3	35	40
O=C(c1cccc(Oc2ccc(C(F)(F)F)c(Cl)n2)c1)N1CCCC1	ZINC000853945795	FJ	On-Demand	Anodyne	TRY1_BOVIN	15	48
O=C(c1cccc(Oc2ccc(C(F)(F)F)c(Cl)n2)c1)N1CCCC1	ZINC000853945795	FJ	On-Demand	Anodyne	RBP4	29	41
O=C(c1cccc(Oc2ccc(C(F)(F)F)c(Cl)n2)c1)N1CCCC1	ZINC000853945795	FJ	On-Demand	Anodyne	NR1H2	15	47
CC[C@@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853945800	CE	On-Demand	Anodyne	CPT1A	48	37
CC[C@H]1CCCCN1C(=O)COC(=O)Cc1cscn1	ZINC000853945802	CE	On-Demand	Anodyne	CPT1A	48	37
O=C(Cc1cscn1)OCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853945826	FF	On-Demand	Anodyne	GRIN2B	89	44
O=C(Cc1cscn1)OCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000853945826	FF	On-Demand	Anodyne	CCR3	27	40
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC(=O)NCc1ccccc1	ZINC000853945846	ED	On-Demand	Anodyne	BMP1	20	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC(=O)NCc1ccccc1	ZINC000853945846	ED	On-Demand	Anodyne	GPR142	41	39
C[C@@H](OC(=O)Cc1cscn1)C(=O)NC(=O)NCc1ccccc1	ZINC000853945846	ED	On-Demand	Anodyne	PDS	47	35
COc1ccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)cc1	ZINC000853945869	DE	On-Demand	Anodyne	GPR142	27	41
CCOC(=O)N1CCC(NC(=O)COC(=O)Cc2cscn2)CC1	ZINC000853945884	FC	On-Demand	Anodyne	CCR8	18	40
C#Cc1cnc(N2CC[C@@H](Oc3ccccc3)C2)nc1	ZINC000853945980	CE	On-Demand	Mild	PDE3A	43	42
C#Cc1cnc(N2CC[C@@H](Oc3ccccc3)C2)nc1	ZINC000853945980	CE	On-Demand	Mild	DCK	42	37
C#Cc1cnc(N2CC[C@@H](Oc3ccccc3)C2)nc1	ZINC000853945980	CE	On-Demand	Mild	PDE3B	50	42
Cn1cc(-c2cccc(Nc3ncnc4c3cnn4C(C)(C)C)c2)nn1	ZINC000853945985	EG	On-Demand	Anodyne	EGFR	45	36
O=C(c1cccc(Oc2ncnc(F)c2Br)c1)N1CCCC1	ZINC000853946023	FG	On-Demand	Anodyne	HPGD	47	42
Nc1nc(Cl)cc(Oc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853946042	DF	On-Demand	Anodyne	TRY1_BOVIN	16	45
Nc1nc(Cl)cc(Oc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853946042	DF	On-Demand	Anodyne	L3MBTL3	27	40
Nc1nc(Cl)cc(Oc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853946042	DF	On-Demand	Anodyne	HPGD	34	40
COc1cc2c(cc1OC)CN(C(=O)COC(=O)Cc1cscn1)CC2	ZINC000853946064	GD	On-Demand	Anodyne	ABCB1	20	48
CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)Cc1cscn1	ZINC000853946087	FI	On-Demand	Anodyne	SOAT1	52	41
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)F)cc2)c1)N1CCCC1	ZINC000853946088	GH	On-Demand	Anodyne	MMP9	21	44
O=C(c1cccc(Oc2ccc(S(=O)(=O)C(F)F)cc2)c1)N1CCCC1	ZINC000853946088	GH	On-Demand	Anodyne	MMP10	17	40
Cc1nc(N2CC[C@@H](CN3CCCC3=O)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853946137	GF	On-Demand	Anodyne	Q8MHZ5_SHEEP	58	32
Cc1nc(N2CC[C@H](CN3CCCC3=O)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853946139	GF	On-Demand	Anodyne	Q8MHZ5_SHEEP	58	32
COc1ccc(OC)c([C@H]2CCCN2C(=O)COC(=O)Cc2cscn2)c1	ZINC000853946143	GF	On-Demand	Anodyne	CPT1A	76	43
C#Cc1cnc(N2CCC3(CCc4ccccc4O3)CC2)nc1	ZINC000853946145	DF	On-Demand	Mild	SCD	38	41
CC(C)(C)OC(=O)N[C@@H](C(=O)OCC1(C#N)CCC1)c1ccc(F)cc1F	ZINC000853946155	GH	On-Demand	Mild	PAPA1_CARPA	31	41
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)Cc1cscn1	ZINC000853946169	FE	On-Demand	Bother	KCNMA1	20	44
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)Cc1cscn1	ZINC000853946169	FE	On-Demand	Bother	GPR142	21	44
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)Cc1cscn1	ZINC000853946170	FE	On-Demand	Bother	KCNMA1	20	44
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)Cc1cscn1	ZINC000853946170	FE	On-Demand	Bother	GPR142	21	44
O=C(c1cccc(Oc2cncc(Cl)n2)c1)N1CCCC1	ZINC000853946305	DG	On-Demand	Anodyne	GRM5	17	43
O=C(c1cccc(Oc2cncc(Cl)n2)c1)N1CCCC1	ZINC000853946305	DG	On-Demand	Anodyne	L3MBTL3	33	40
O=C(c1cccc(Oc2cncc(Cl)n2)c1)N1CCCC1	ZINC000853946305	DG	On-Demand	Anodyne	HPGD	45	41
N#Cc1sc(Oc2cccc(C(=O)N3CCCC3)c2)nc1Cl	ZINC000853946329	EH	On-Demand	Mild	HPGD	41	38
CCCc1ccc(COC(=O)C2(OCC)CCOCC2)cc1	ZINC000853946330	DG	On-Demand	Anodyne	SLC12A5	56	33
Cc1c(NC(=O)[C@H](C)OC(=O)Cc2cscn2)cccc1[N+](=O)[O-]	ZINC000853946357	EE	On-Demand	Bother	COLA	83	40
Cc1c(NC(=O)[C@@H](C)OC(=O)Cc2cscn2)cccc1[N+](=O)[O-]	ZINC000853946358	EE	On-Demand	Bother	COLA	83	40
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000853946361	EE	On-Demand	Anodyne	IMDH_CRYPV	21	42
OC[C@H](Nc1ncc2c(n1)CCCC2)c1cccc(Cl)c1Cl	ZINC000853946375	EH	On-Demand	Anodyne	MAPK1	49	40
OC[C@@H](Nc1ncc2c(n1)CCCC2)c1cccc(Cl)c1Cl	ZINC000853946377	EH	On-Demand	Anodyne	MAPK1	49	40
COc1ccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)cc1OC	ZINC000853946380	FE	On-Demand	Anodyne	ENPP1	74	36
COc1ccc(NC(=O)[C@H](C)OC(=O)Cc2cscn2)cc1OC	ZINC000853946380	FE	On-Demand	Anodyne	GPR142	34	47
O=C(COC(=O)Cc1cscn1)NCCCc1ccccc1	ZINC000853946405	DD	On-Demand	Anodyne	HRH2	17	40
O=C(COC(=O)Cc1cscn1)NCCCc1ccccc1	ZINC000853946405	DD	On-Demand	Anodyne	FAAH	34	42
C[C@@H](OC(=O)Cc1cscn1)C(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000853946427	GG	On-Demand	Mild	VIPR1	29	44
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCc1ccc(Cl)cc1	ZINC000853946456	EF	On-Demand	Anodyne	BMP1	16	41
C[C@@H](OC(=O)Cc1cscn1)C(=O)N1c2ccccc2C[C@H]1C	ZINC000853946479	EF	On-Demand	Anodyne	TPP2	70	39
c1ccc(O[C@@H]2CCN(c3ncc4c(n3)CCCC4)C2)cc1	ZINC000853946569	CG	On-Demand	Anodyne	PDE3B	41	36
COC(=O)c1sc(Oc2cccc(C(=O)N3CCCC3)c2)nc1Cl	ZINC000853946591	FH	On-Demand	Anodyne	DRD4	44	35
COC(=O)c1sc(Oc2cccc(C(=O)N3CCCC3)c2)nc1Cl	ZINC000853946591	FH	On-Demand	Anodyne	HPGD	31	41
O=C(c1cccc(Oc2cc(Cl)nc(C3CC3)n2)c1)N1CCCC1	ZINC000853946600	EI	On-Demand	Anodyne	PREP	25	40
O=C(c1cccc(Oc2cc(Cl)nc(C3CC3)n2)c1)N1CCCC1	ZINC000853946600	EI	On-Demand	Anodyne	L3MBTL3	56	43
COCc1cc(Oc2cccc(C(=O)N3CCCC3)c2)ncn1	ZINC000853946626	DF	On-Demand	Anodyne	HPGD	42	42
O=C(COC(=O)Cc1cscn1)NC12CC3CC(CC(C3)C1)C2	ZINC000853946657	EE	On-Demand	Anodyne	EPHX2	67	39
O=C(COC(=O)Cc1cscn1)NCc1ccc2c(c1)OCO2	ZINC000853946660	ED	On-Demand	Anodyne	BMP1	46	38
O=C(COC(=O)Cc1cscn1)NCc1ccc2c(c1)OCO2	ZINC000853946660	ED	On-Demand	Anodyne	NOS2	103	40
C#Cc1cccnc1N1CCC2(CCc3ccccc3O2)CC1	ZINC000853946673	DG	On-Demand	Mild	SCD	38	42
COc1ccc(NC(=O)[C@H](OC(=O)Cc2cscn2)C(C)C)cc1	ZINC000853946741	EF	On-Demand	Anodyne	IMDH_CRYPV	19	40
CCCCCNC(=O)COC(=O)Cc1cscn1	ZINC000853946777	CD	On-Demand	Anodyne	ASAH1	60	32
O=C1CCCN1C[C@@H]1CCN(c2cc3ccccc3c(Cl)n2)C1	ZINC000853946778	EG	On-Demand	Anodyne	Q8MHZ5_SHEEP	46	35
O=C1CCCN1C[C@H]1CCN(c2cc3ccccc3c(Cl)n2)C1	ZINC000853946779	EG	On-Demand	Anodyne	Q8MHZ5_SHEEP	46	35
CCC[C@H](NC(=O)COC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946795	FF	On-Demand	Anodyne	NPPA	50	34
CCC[C@@H](NC(=O)COC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946796	FF	On-Demand	Anodyne	NPPA	50	34
C[C@H]1C[C@H](NC(=O)NNc2nc3ccc(Cl)cc3s2)CCO1	ZINC000853946813	EG	On-Demand	Reactive	LCK	15	40
CCC[C@H](NC(=O)[C@@H](C)OC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946831	GG	On-Demand	Anodyne	TIMP3	63	33
CCC[C@H](NC(=O)[C@@H](C)OC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946831	GG	On-Demand	Anodyne	NPPA	45	32
CCC[C@@H](NC(=O)[C@H](C)OC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946832	GG	On-Demand	Anodyne	TIMP3	63	33
CCC[C@@H](NC(=O)[C@H](C)OC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946832	GG	On-Demand	Anodyne	NPPA	45	32
CCC[C@H](NC(=O)[C@H](C)OC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946834	GG	On-Demand	Anodyne	TIMP3	63	33
CCC[C@H](NC(=O)[C@H](C)OC(=O)C1(OCC)CCOCC1)c1ccccc1	ZINC000853946834	GG	On-Demand	Anodyne	NPPA	45	32
O=C(c1cccc(Oc2cnc(F)cn2)c1)N1CCCC1	ZINC000853946898	CF	On-Demand	Anodyne	L3MBTL3	37	40
O=C(c1cccc(Oc2cnc(F)cn2)c1)N1CCCC1	ZINC000853946898	CF	On-Demand	Anodyne	HPGD	45	41
O=C(c1cccc(Oc2nc(C(F)(F)F)nc3ccccc23)c1)N1CCCC1	ZINC000853946919	GJ	On-Demand	Anodyne	NR1H2	17	50
O=C(c1cccc(Oc2c(F)c(F)nc(F)c2F)c1)N1CCCC1	ZINC000853946923	EH	On-Demand	Anodyne	L3MBTL3	45	42
O=C(c1cccc(Oc2c(F)c(F)nc(F)c2F)c1)N1CCCC1	ZINC000853946923	EH	On-Demand	Anodyne	HPGD	44	40
COC(=O)c1cnc(Oc2cccc(C(=O)N3CCCC3)c2)cc1C(F)(F)F	ZINC000853946929	GH	On-Demand	Anodyne	NR1H3	23	49
COC(=O)c1cnc(Oc2cccc(C(=O)N3CCCC3)c2)cc1C(F)(F)F	ZINC000853946929	GH	On-Demand	Anodyne	RBP4	23	46
COC(=O)c1cnc(Oc2cccc(C(=O)N3CCCC3)c2)cc1C(F)(F)F	ZINC000853946929	GH	On-Demand	Anodyne	NR1H2	33	49
O=C(c1cccc(Oc2ccc3nnc(C(F)(F)F)n3n2)c1)N1CCCC1	ZINC000853946957	GG	On-Demand	Anodyne	HPGD	43	38
O=C(COC(=O)Cc1cscn1)Nc1ccc(N2CCCCC2)nc1	ZINC000853947008	FE	On-Demand	Anodyne	DGAT1	30	40
O=C(COC(=O)Cc1cscn1)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853947021	GE	On-Demand	Anodyne	EPHX2	91	43
CON(C)CCNC(=O)NCCCc1cccs1	ZINC000853947061	CD	On-Demand	Anodyne	BMP1	15	44
COc1ccc(C)cc1NC(=O)[C@@H](C)OC(=O)Cc1cscn1	ZINC000853947085	EF	On-Demand	Anodyne	GPR142	26	45
COc1ccc(C)cc1NC(=O)[C@H](C)OC(=O)Cc1cscn1	ZINC000853947087	EF	On-Demand	Anodyne	GPR142	26	45
C[C@@H](OC(=O)Cc1cscn1)C(=O)NCCc1ccc(F)cc1	ZINC000853947089	EE	On-Demand	Anodyne	BMP1	17	43
C[C@@H](OC(=O)Cc1cscn1)C(=O)N1CCCCCC1	ZINC000853947113	CE	On-Demand	Anodyne	DPP7	51	33
Fc1cc(N2CCC3(CCc4ccccc4O3)CC2)ncn1	ZINC000853947145	CF	On-Demand	Anodyne	SCD	53	42
COCCc1nsc(Oc2cccc(C(=O)N3CCCC3)c2)n1	ZINC000853947196	EF	On-Demand	Anodyne	DRD4	40	31
O=C(c1cccc(Oc2ncnc3c2CCC3)c1)N1CCCC1	ZINC000853947223	DF	On-Demand	Anodyne	HPGD	41	40
Cc1cc(C(F)(F)F)c(Oc2cccc(C(=O)N3CCCC3)c2)nn1	ZINC000853947232	FH	On-Demand	Anodyne	TRY1_BOVIN	16	41
Cc1cc(C(F)(F)F)c(Oc2cccc(C(=O)N3CCCC3)c2)nn1	ZINC000853947232	FH	On-Demand	Anodyne	NR1H3	44	51
Cc1cc(C(F)(F)F)c(Oc2cccc(C(=O)N3CCCC3)c2)nn1	ZINC000853947232	FH	On-Demand	Anodyne	RBP4	20	41
Cc1cc(C(F)(F)F)c(Oc2cccc(C(=O)N3CCCC3)c2)nn1	ZINC000853947232	FH	On-Demand	Anodyne	NR1H2	37	51
Cc1cc(C(F)(F)F)c(Oc2cccc(C(=O)N3CCCC3)c2)nn1	ZINC000853947232	FH	On-Demand	Anodyne	HPGD	43	38
O=C(c1cccc(Oc2ncc(I)cn2)c1)N1CCCC1	ZINC000853947233	GG	On-Demand	Anodyne	PREP	26	40
O=C(c1cccc(Oc2ncc(I)cn2)c1)N1CCCC1	ZINC000853947233	GG	On-Demand	Anodyne	L3MBTL3	40	42
O=C(c1cccc(Oc2ncc(I)cn2)c1)N1CCCC1	ZINC000853947233	GG	On-Demand	Anodyne	HPGD	48	43
O=C(c1cccc(Oc2cc(F)ncn2)c1)N1CCCC1	ZINC000853947257	CF	On-Demand	Anodyne	L3MBTL3	33	40
O=C(c1cccc(Oc2cc(F)ncn2)c1)N1CCCC1	ZINC000853947257	CF	On-Demand	Anodyne	HPGD	45	41
Fc1cnc(N2CC[C@@H](Oc3ccccc3)C2)cn1	ZINC000853947355	CE	On-Demand	Anodyne	DCK	45	42
Fc1cnc(N2CC[C@@H](Oc3ccccc3)C2)cn1	ZINC000853947355	CE	On-Demand	Anodyne	PDE3B	45	38
N#Cc1ncc(C(F)(F)F)cc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853947456	EH	On-Demand	Mild	DCK	41	36
N#Cc1ncc(C(F)(F)F)cc1N1CC[C@@H](Oc2ccccc2)C1	ZINC000853947456	EH	On-Demand	Mild	LIPG	60	50
CCOc1ccccc1OCCOC(=O)C1(OCC)CCOCC1	ZINC000853947569	EF	On-Demand	Anodyne	HCN1	50	40
CCOc1ccccc1OCCOC(=O)C1(OCC)CCOCC1	ZINC000853947569	EF	On-Demand	Anodyne	HCN4	41	32
Cn1cnc2c(NCC34CC(CN3C(=O)OC(C)(C)C)C4)ncnc21	ZINC000853947804	EE	On-Demand	Anodyne	ADORA1	17	40
CC(C)(C)OC(=O)N1CC2CC1(CNc1cnccc1C#N)C2	ZINC000853947920	DF	On-Demand	Mild	GPR119	19	42
CC(C)(C)OC(=O)N1CC2CC1(CNc1ccc(S(C)(=O)=O)cc1)C2	ZINC000853947975	FF	On-Demand	Anodyne	GPR119	43	48
C[C@H]1C[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)CCO1	ZINC000853948017	DF	On-Demand	Reactive	CACNA1I	49	33
COCc1cc([N+](=O)[O-])ccc1NCC12CC(CN1C(=O)OC(C)(C)C)C2	ZINC000853948032	GH	On-Demand	Bother	CACNA1D	44	33
CC(C)(C)OC(=O)N1CC2CC1(CNc1nccc(N3CCOCC3)n1)C2	ZINC000853948225	GE	On-Demand	Anodyne	EPHB4	62	32
C[C@H]1C[C@H](CNC(=O)NNc2nc3ccc(Cl)cc3s2)CCO1	ZINC000853948283	FG	On-Demand	Reactive	CSNK1D	32	41
CCCOc1ccc(COC(=O)C2(OCC)CCOCC2)cc1	ZINC000853948407	DG	On-Demand	Anodyne	MMP13	30	40
CCCOc1ccc(COC(=O)C2(OCC)CCOCC2)cc1	ZINC000853948407	DG	On-Demand	Anodyne	MMP3	15	40
CCCOc1ccc(COC(=O)C2(OCC)CCOCC2)cc1	ZINC000853948407	DG	On-Demand	Anodyne	PLA2G4B	44	35
CCCOc1ccc(COC(=O)C2(OCC)CCOCC2)cc1	ZINC000853948407	DG	On-Demand	Anodyne	SLC12A5	45	34
CC(C)(C)OC(=O)N1CC2CC1(CNc1ncnc3c1ncn3C1CC1)C2	ZINC000853948451	FF	On-Demand	Anodyne	ADORA1	51	45
CC(C)(C)OC(=O)N1CC2CC1(CNc1ncnc3c1ncn3C1CC1)C2	ZINC000853948451	FF	On-Demand	Anodyne	ADORA3	72	36
CC(C)(C)OC(=O)N1CC2CC1(CNc1nc(O)c3ccccc3n1)C2	ZINC000853948589	FG	On-Demand	Anodyne	TNKS	45	31
CC(C)(C)OC(=O)N1CC2CC1(CNc1ccc(S(C)(=O)=O)cc1F)C2	ZINC000853948641	GG	On-Demand	Anodyne	GPR119	57	46
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)CCc2ccccc2)C1	ZINC000853948705	FG	On-Demand	Anodyne	FPR1	43	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)CCc2ccccc2)C1	ZINC000853948705	FG	On-Demand	Anodyne	NAAA	40	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccccc2[N+](=O)[O-])C1	ZINC000853948714	FF	On-Demand	Bother	COLA	110	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@H](Cc2ccc(Cl)cc2)C(N)=O)C1	ZINC000853948718	GF	On-Demand	Anodyne	FPR1	37	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@@H](Cc2ccc(Cl)cc2)C(N)=O)C1	ZINC000853948719	GF	On-Demand	Anodyne	FPR1	37	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccncc2C#N)C1	ZINC000853948782	EE	On-Demand	Mild	GPR119	20	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCCN2CCCCC2)C1	ZINC000853948801	EF	On-Demand	Anodyne	HRH3	15	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCCn2ccnc2)C1	ZINC000853948878	DE	On-Demand	Anodyne	TBXAS1	27	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)OCc2ccccc2)C1	ZINC000853949083	FF	On-Demand	Anodyne	PAPA1_CARPA	41	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)OCc2ccccc2)C1	ZINC000853949083	FF	On-Demand	Anodyne	CTSK	30	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)OCc2ccccc2)C1	ZINC000853949083	FF	On-Demand	Anodyne	CTSL	33	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)OCc2ccccc2)C1	ZINC000853949083	FF	On-Demand	Anodyne	KLK5	35	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)OCc2ccccc2)C1	ZINC000853949083	FF	On-Demand	Anodyne	FPR1	46	37
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)OCc2ccccc2)C1	ZINC000853949083	FF	On-Demand	Anodyne	NAAA	40	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)OCc2ccccc2)C1	ZINC000853949083	FF	On-Demand	Anodyne	SLC12A5	53	32
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)COc2ccccc2)C1	ZINC000853949147	FE	On-Demand	Anodyne	CPT1A	68	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)COc2ccccc2)C1	ZINC000853949147	FE	On-Demand	Anodyne	PLA2G4B	70	34
COC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949155	GF	On-Demand	Anodyne	PGC	50	36
COC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949155	GF	On-Demand	Anodyne	PAPA1_CARPA	58	46
COC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949155	GF	On-Demand	Anodyne	CCKAR	45	37
COC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949155	GF	On-Demand	Anodyne	CTSK	17	47
COC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949155	GF	On-Demand	Anodyne	CTSL	27	46
COC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949155	GF	On-Demand	Anodyne	REN	60	43
COC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949155	GF	On-Demand	Anodyne	FPR1	52	41
COC(=O)[C@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949157	GF	On-Demand	Anodyne	PGC	50	36
COC(=O)[C@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949157	GF	On-Demand	Anodyne	PAPA1_CARPA	58	46
COC(=O)[C@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949157	GF	On-Demand	Anodyne	CCKAR	45	37
COC(=O)[C@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949157	GF	On-Demand	Anodyne	CTSK	17	47
COC(=O)[C@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949157	GF	On-Demand	Anodyne	CTSL	27	46
COC(=O)[C@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949157	GF	On-Demand	Anodyne	REN	60	43
COC(=O)[C@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949157	GF	On-Demand	Anodyne	FPR1	52	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)NCC#N)C1	ZINC000853949204	DC	On-Demand	Mild	PAPA1_CARPA	33	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCOc2ccccc2C#N)C1	ZINC000853949209	FF	On-Demand	Mild	ADRB1	40	30
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccc(OCC#N)cc2)C1	ZINC000853949211	FF	On-Demand	Mild	KLK5	22	40
Cc1ccncc1[C@H](C)NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1	ZINC000853949236	GE	On-Demand	Anodyne	MAPK1	36	40
Cc1ccncc1[C@@H](C)NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1	ZINC000853949237	GE	On-Demand	Anodyne	MAPK1	36	40
Cc1ccncc1[C@H](C)NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853949289	FG	On-Demand	Anodyne	GPR119	29	40
Cc1ccncc1[C@@H](C)NC(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853949297	FG	On-Demand	Anodyne	GPR119	29	40
CC(=O)[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000853949346	EG	On-Demand	Anodyne	FPR1	43	36
CC(=O)[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000853949348	EG	On-Demand	Anodyne	FPR1	43	36
COC(=O)[C@@H](Cc1ccc(F)cc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949359	GF	On-Demand	Anodyne	PAPA1_CARPA	29	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccc3ccccc3n2)C1	ZINC000853949519	FH	On-Demand	Anodyne	CYSLTR1	54	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccc3ccccc3n2)C1	ZINC000853949519	FH	On-Demand	Anodyne	ALOX5AP	51	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2cc(O)n3ncc(C#N)c3n2)C1	ZINC000853949520	GD	On-Demand	Mild	CSNK2A1	95	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2cc(O)n3ncc(C#N)c3n2)C1	ZINC000853949520	GD	On-Demand	Mild	HIPK2	50	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCCn2cnc3c(N)ncnc32)C1	ZINC000853949580	GD	On-Demand	Anodyne	AHCY	65	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCCn2cnc3c(N)ncnc32)C1	ZINC000853949580	GD	On-Demand	Anodyne	OXGR1	104	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCCn2cnc3c(N)ncnc32)C1	ZINC000853949580	GD	On-Demand	Anodyne	DOT1L	57	33
COc1ccc([N+](=O)[O-])cc1COC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949600	GF	On-Demand	Bother	CACNA1D	41	31
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)c1ccccc1	ZINC000853949620	EG	On-Demand	Anodyne	FPR1	41	36
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)c1ccccc1	ZINC000853949624	EG	On-Demand	Anodyne	FPR1	41	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@H](Cc2ccc(F)cc2)C(N)=O)C1	ZINC000853949662	GE	On-Demand	Anodyne	PAPA1_CARPA	23	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@@H](Cc2ccc(F)cc2)C(N)=O)C1	ZINC000853949665	GE	On-Demand	Anodyne	PAPA1_CARPA	23	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CA2	86	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CA1	75	51
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CA7	56	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CA4	50	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CA14	71	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CA12	66	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CA9	69	48
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCc2ccc(S(N)(=O)=O)cc2)C1	ZINC000853949680	GD	On-Demand	Anodyne	CYNT	41	41
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	PGC	54	36
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	PAPA1_CARPA	47	45
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	CCKAR	47	40
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	CTSL	24	45
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	TIMP3	52	36
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	TACR3	15	40
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	REN	66	42
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949765	GE	On-Demand	Anodyne	FPR1	56	43
CC(=O)[C@@H](Cc1ccccc1F)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949776	GG	On-Demand	Anodyne	PAPA1_CARPA	28	48
CC(=O)[C@@H](Cc1ccccc1F)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949776	GG	On-Demand	Anodyne	FPR1	45	35
CC(=O)[C@H](Cc1ccccc1F)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949777	GG	On-Demand	Anodyne	PAPA1_CARPA	28	48
CC(=O)[C@H](Cc1ccccc1F)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949777	GG	On-Demand	Anodyne	FPR1	45	35
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccncc1	ZINC000853949800	DF	On-Demand	Anodyne	CYP17A1	17	45
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccncc1	ZINC000853949802	DF	On-Demand	Anodyne	CYP17A1	17	45
Cc1ccncc1[C@H](C)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853949830	GI	On-Demand	Anodyne	ROCK2	28	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@@H](C(=O)NC2CC2)c2ccccc2)C1	ZINC000853949833	GF	On-Demand	Anodyne	FPR1	46	39
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@H](C(=O)NC2CC2)c2ccccc2)C1	ZINC000853949835	GF	On-Demand	Anodyne	FPR1	46	39
Cc1ccncc1[C@@H](C)NC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853949839	GI	On-Demand	Anodyne	ROCK2	28	41
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1F	ZINC000853949863	GF	On-Demand	Anodyne	PAPA1_CARPA	27	45
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1F	ZINC000853949863	GF	On-Demand	Anodyne	FPR1	40	34
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1F	ZINC000853949865	GF	On-Demand	Anodyne	PAPA1_CARPA	27	45
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1F	ZINC000853949865	GF	On-Demand	Anodyne	FPR1	40	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2ccc(NS(C)(=O)=O)cc2)C1	ZINC000853949869	GE	On-Demand	Anodyne	PTPRB	49	39
CC(=O)c1ccc(N2CCC3(COC3)C2)c([N+](=O)[O-])c1	ZINC000853949873	CE	On-Demand	Bother	TAAR1	15	43
CCC(=O)NNC(=O)[C@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949954	FC	On-Demand	Reactive	PGA5	22	41
CCC(=O)NNC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853949956	FC	On-Demand	Reactive	PGA5	22	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)Cc2ccccc2)C1	ZINC000853949962	EF	On-Demand	Anodyne	FPR1	46	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCCN2CCOCC2)C1	ZINC000853950027	ED	On-Demand	Anodyne	PAOX	16	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000853950150	GF	On-Demand	Bother	CACNA1C	52	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)c2cccc([N+](=O)[O-])c2)C1	ZINC000853950150	GF	On-Demand	Bother	CACNA1D	80	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2nnnn2Cc2ccccc2)C1	ZINC000853950209	GE	On-Demand	Anodyne	GHSR	27	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2nnnn2Cc2ccccc2)C1	ZINC000853950209	GE	On-Demand	Anodyne	FPR1	41	33
CO[C@@H](c1ccc(F)cc1)[C@@H](C)NC(=O)NCCN(C)OC	ZINC000853950290	DD	On-Demand	Anodyne	LEF	25	41
CO[C@@H](c1ccc(F)cc1)[C@H](C)NC(=O)NCCN(C)OC	ZINC000853950293	DD	On-Demand	Anodyne	LEF	25	41
Cc1cccc(NC(=O)[C@H](C)OC(=O)[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853950390	GG	On-Demand	Anodyne	KCNK3	49	34
Cc1cccc(NC(=O)[C@@H](C)OC(=O)[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853950391	GG	On-Demand	Anodyne	KCNK3	49	34
C[C@H](NC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000853950452	GG	On-Demand	Anodyne	CTSK	19	44
C[C@H](NC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1	ZINC000853950452	GG	On-Demand	Anodyne	FPR1	47	38
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N[C@H](C)c1ccccc1	ZINC000853950453	GG	On-Demand	Anodyne	CTSK	19	44
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N[C@H](C)c1ccccc1	ZINC000853950453	GG	On-Demand	Anodyne	FPR1	47	38
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N[C@@H](C)c1ccccc1	ZINC000853950454	GG	On-Demand	Anodyne	CTSK	19	44
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N[C@@H](C)c1ccccc1	ZINC000853950454	GG	On-Demand	Anodyne	FPR1	47	38
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N[C@H](C)c1ccccc1	ZINC000853950455	GG	On-Demand	Anodyne	CTSK	19	44
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N[C@H](C)c1ccccc1	ZINC000853950455	GG	On-Demand	Anodyne	FPR1	47	38
CC(=O)Oc1ccc(COC(=O)[C@@H]2C[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC000853950468	FF	On-Demand	Anodyne	CACNA1B	16	45
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2cc(=O)oc3cc(O)ccc23)C1	ZINC000853950474	GF	On-Demand	Anodyne	HSD17B3	33	47
Cc1ccncc1[C@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853950553	FF	On-Demand	Clean	NAMPT	55	40
Cc1ccncc1[C@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853950553	FF	On-Demand	Clean	VHL	50	34
Cc1ccncc1[C@@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853950554	FF	On-Demand	Clean	NAMPT	55	40
Cc1ccncc1[C@@H](C)NC(=O)NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853950554	FF	On-Demand	Clean	VHL	50	34
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCNS(=O)(=O)c2ccccc2)C1	ZINC000853950558	GD	On-Demand	Anodyne	SFRP1	106	35
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCCNS(=O)(=O)c2ccccc2)C1	ZINC000853950558	GD	On-Demand	Anodyne	WNT3	70	33
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCc2cc(=O)c(O)co2)C1	ZINC000853950568	ED	On-Demand	Anodyne	TYR	42	47
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC#N)C1	ZINC000853950620	CD	On-Demand	Mild	PAPA1_CARPA	31	40
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)NOCc2ccccc2)C1	ZINC000853950660	GE	On-Demand	Anodyne	CTSK	15	42
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)NOCc2ccccc2)C1	ZINC000853950660	GE	On-Demand	Anodyne	KLK5	33	43
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)NOCc2ccccc2)C1	ZINC000853950660	GE	On-Demand	Anodyne	FPR1	41	34
Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853950681	GF	On-Demand	Anodyne	REN	18	41
Cc1ccccc1CNC(=O)[C@@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853950681	GF	On-Demand	Anodyne	FPR1	43	34
Cc1ccccc1CNC(=O)[C@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853950683	GF	On-Demand	Anodyne	REN	18	41
Cc1ccccc1CNC(=O)[C@H](C)OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853950683	GF	On-Demand	Anodyne	FPR1	43	34
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)Nc1cccnc1Cl	ZINC000853950750	GF	On-Demand	Anodyne	G2YM83_BOTF4	45	35
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)Nc1cccnc1Cl	ZINC000853950751	GF	On-Demand	Anodyne	G2YM83_BOTF4	45	35
O=[N+]([O-])c1ccc(N2CCC3(COC3)C2)c2nonc12	ZINC000853950808	CD	On-Demand	Bother	GSTM2	107	42
O=[N+]([O-])c1ccc(N2CCC3(COC3)C2)c2nonc12	ZINC000853950808	CD	On-Demand	Bother	GSTP1	64	40
C#CCNC(=O)c1ccc(N2CC[C@@](C)(C#N)C2)nc1	ZINC000853950869	CD	On-Demand	Mild	HDAC1	15	40
C#CCNC(=O)c1ccc(N2CC[C@](C)(C#N)C2)nc1	ZINC000853950870	CD	On-Demand	Mild	HDAC1	15	40
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccc(F)cc1	ZINC000853950980	GF	On-Demand	Anodyne	PAPA1_CARPA	27	44
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccc(F)cc1	ZINC000853950981	GF	On-Demand	Anodyne	PAPA1_CARPA	27	44
C[C@]1(C#N)CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853950992	CD	On-Demand	Mild	GSTM2	100	41
C[C@]1(C#N)CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853950992	CD	On-Demand	Mild	GSTP1	57	41
C[C@@]1(C#N)CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853950993	CD	On-Demand	Mild	GSTM2	100	41
C[C@@]1(C#N)CCN(c2ccc([N+](=O)[O-])c3nonc23)C1	ZINC000853950993	CD	On-Demand	Mild	GSTP1	57	41
COC(=O)c1sc(N2CCC3(COC3)C2)nc1Cl	ZINC000853951022	CD	On-Demand	Anodyne	PARE	43	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)Nc2cccnc2Cl)C1	ZINC000853951096	GF	On-Demand	Anodyne	G2YM83_BOTF4	65	35
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1cccs1	ZINC000853951145	GF	On-Demand	Anodyne	PAPA1_CARPA	26	45
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1cccs1	ZINC000853951146	GF	On-Demand	Anodyne	PAPA1_CARPA	26	45
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N(C)Cc1ccccc1	ZINC000853951154	GF	On-Demand	Anodyne	CTSB	32	44
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N(C)Cc1ccccc1	ZINC000853951154	GF	On-Demand	Anodyne	FPR1	48	38
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N(C)Cc1ccccc1	ZINC000853951155	GF	On-Demand	Anodyne	CTSB	32	44
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)N(C)Cc1ccccc1	ZINC000853951155	GF	On-Demand	Anodyne	FPR1	48	38
O=C(N[C@@H]1C=CCC1)N[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853951156	CD	On-Demand	Anodyne	INHA	18	42
O=C(N[C@@H]1C=CCC1)N[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853951157	CD	On-Demand	Anodyne	INHA	18	42
O=C(N[C@H]1C=CCC1)N[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853951158	CD	On-Demand	Anodyne	INHA	18	42
O=C(N[C@H]1CC(=O)N(C2CCCCC2)C1)N[C@H]1C=CCC1	ZINC000853951159	CD	On-Demand	Anodyne	INHA	18	42
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1nc(O)c2ccccc2n1	ZINC000853951208	GG	On-Demand	Anodyne	TNKS	41	31
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1nc(O)c2ccccc2n1	ZINC000853951209	GG	On-Demand	Anodyne	TNKS	41	31
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853951238	GH	On-Demand	Anodyne	PPARG	84	46
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853951238	GH	On-Demand	Anodyne	PPARA	93	46
Cc1oc(-c2ccccc2)nc1COC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000853951238	GH	On-Demand	Anodyne	PDE8B	70	41
O=[N+]([O-])c1ccc(N2CCC3(COC3)C2)cc1	ZINC000853951274	BD	On-Demand	Bother	KCNJ1	18	41
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	PGC	42	35
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	PAPA1_CARPA	47	43
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	CTSK	18	42
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	CTSL	15	43
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	TACR3	16	42
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	REN	63	43
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	FPR1	54	41
C[C@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951283	GF	On-Demand	Anodyne	PDS	54	36
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	PGC	42	35
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	PAPA1_CARPA	47	43
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	CTSK	18	42
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	CTSL	15	43
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	TACR3	16	42
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	REN	63	43
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	FPR1	54	41
C[C@@H](OC(=O)[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)C(=O)NCc1ccccc1	ZINC000853951284	GF	On-Demand	Anodyne	PDS	54	36
O=C(N[C@H]1C[C@H](O)c2ccccc21)N[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853951359	FE	On-Demand	Anodyne	INHA	19	41
O=C(N[C@@H]1CC(=O)N(C2CCCCC2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853951360	FE	On-Demand	Anodyne	INHA	19	41
O=C(N[C@H]1C[C@@H](O)c2ccccc21)N[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853951361	FE	On-Demand	Anodyne	INHA	19	41
O=C(N[C@@H]1CC(=O)N(C2CCCCC2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853951362	FE	On-Demand	Anodyne	INHA	19	41
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@H]2CCOC2=O)C1	ZINC000853951363	CD	On-Demand	Anodyne	TRAR	55	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)O[C@@H]2CCOC2=O)C1	ZINC000853951364	CD	On-Demand	Anodyne	TRAR	55	31
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)c2c[nH]c3ccccc23)C1	ZINC000853951385	FG	On-Demand	Anodyne	SSTR2	66	36
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)c2c[nH]c3ccccc23)C1	ZINC000853951385	FG	On-Demand	Anodyne	CCKAR	82	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)c2c[nH]c3ccccc23)C1	ZINC000853951385	FG	On-Demand	Anodyne	CCKBR	67	38
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)NCCc2ccc(F)cc2)C1	ZINC000853951391	GE	On-Demand	Anodyne	PAPA1_CARPA	18	40
C#CCNC(=O)c1ccc(N2CCC3(COC3)C2)nc1	ZINC000853951449	CC	On-Demand	Mild	HDAC1	18	44
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C(=O)OCC(=O)NCc2ccccc2F)C1	ZINC000853951458	GE	On-Demand	Anodyne	PAPA1_CARPA	21	43
O=C(NNC(=O)c1cccc(F)n1)N[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853951521	FD	On-Demand	Reactive	INHA	18	40
O=C(NNC(=O)c1cccc(F)n1)N[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000853951522	FD	On-Demand	Reactive	INHA	18	40
CCCCCOC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853951622	CG	On-Demand	Anodyne	INHA	47	36
CCCCCOC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853951622	CG	On-Demand	Anodyne	PLA2G4B	75	38
Cn1nnnc1CCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853951724	FD	On-Demand	Reactive	CSNK1D	33	41
C=C1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c2nonc12	ZINC000853951858	CF	On-Demand	Mild	GSTM2	114	44
C=C1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c2nonc12	ZINC000853951858	CF	On-Demand	Mild	GSTP1	70	44
COc1cccc(COC(=O)CCc2cc(OC)c(O)c(OC)c2)n1	ZINC000853952042	EE	On-Demand	Anodyne	ALS	64	35
COc1cccc(COC(=O)CCc2cc(OC)c(O)c(OC)c2)c1	ZINC000853952481	EG	On-Demand	Anodyne	MTNR1A	38	44
COc1cccc(COC(=O)CCc2cc(OC)c(O)c(OC)c2)c1	ZINC000853952481	EG	On-Demand	Anodyne	MTNR1B	42	48
COc1cccc(COC(=O)CCc2cc(OC)c(O)c(OC)c2)c1	ZINC000853952481	EG	On-Demand	Anodyne	ABCB1	21	45
COc1cccc(COC(=O)CCc2cc(OC)c(O)c(OC)c2)c1	ZINC000853952481	EG	On-Demand	Anodyne	FFAR1	41	43
COc1cccc(COC(=O)CCc2cc(OC)c(O)c(OC)c2)c1	ZINC000853952481	EG	On-Demand	Anodyne	AKR1C3	18	48
CCC1(O)CCC(NC(=O)N[C@@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000853952514	GH	On-Demand	Anodyne	CCR1	47	42
CCC1(O)CCC(NC(=O)N[C@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)CC1	ZINC000853952515	GH	On-Demand	Anodyne	CCR1	47	42
CCC1(O)CCC(NC(=O)N[C@@H](C(C)C)[C@@H](O)c2ccc(Cl)cc2)CC1	ZINC000853952516	GH	On-Demand	Anodyne	CCR1	47	42
CCC1(O)CCC(NC(=O)N[C@H](C(C)C)[C@H](O)c2ccc(Cl)cc2)CC1	ZINC000853952517	GH	On-Demand	Anodyne	CCR1	47	42
CCC1(O)CCC(NC(=O)NNc2ccc([N+](=O)[O-])cc2F)CC1	ZINC000853952525	EE	On-Demand	Reactive	SLC27A4	43	31
COc1ccc(N2CC[C@H](NC(=O)Nc3cnn(C)c3)C2)cc1	ZINC000853952534	DD	On-Demand	Clean	EPHX2	43	38
COc1ccc(N2CC[C@H](NC(=O)Nc3cnn(C)c3)C2)cc1	ZINC000853952534	DD	On-Demand	Clean	MCHR1	15	46
O=C(COC(=O)c1ccccc1-n1cnnn1)NCc1ccc(C(=O)N2CCOCC2)cc1	ZINC000853952573	JC	On-Demand	Anodyne	KCNJ1	45	32
Cc1cc(C)cc(CC(=O)OCC(=O)NCCc2cccc3cccnc23)c1	ZINC000853952601	GG	On-Demand	Anodyne	MTNR1A	39	40
COCCN(CCF)C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000853952664	ED	On-Demand	Anodyne	CACNA1I	44	32
OC1(CNc2nccc(N3CCCC3)n2)CCC(F)(F)CC1	ZINC000853952684	DE	On-Demand	Anodyne	SORD	63	37
Cc1cc(C)cc(CC(=O)OCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	ZINC000853952857	FG	On-Demand	Anodyne	SFRP1	54	32
Cc1cc(C)cc(CC(=O)OCc2ccc(S(=O)(=O)NC3CC3)cc2)c1	ZINC000853952857	FG	On-Demand	Anodyne	WNT3	40	32
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853952890	FF	On-Demand	Anodyne	LOX1.1	40	33
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853952890	FF	On-Demand	Anodyne	O49150_SOLTU	48	34
C[C@@H]1CN(Cc2ccccc2)C[C@H](C(=O)NNC(=O)Nc2cnn(C)c2)O1	ZINC000853952905	FC	On-Demand	Reactive	PANC	41	35
O=C(COC(=O)c1ccccc1-n1cnnn1)NCC1(c2ccccc2)CCCC1	ZINC000853952906	HE	On-Demand	Anodyne	KCNA3	44	36
CCC1(O)CCC(NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853953001	FH	On-Demand	Reactive	LCK	20	42
CCC1(O)CCC(NC(=O)NNc2nc3ccc(Cl)cc3s2)CC1	ZINC000853953001	FH	On-Demand	Reactive	CSNK1D	36	41
O=C(NCC1CCN(c2ccncc2)CC1)NNc1cc(F)cc(Cl)c1	ZINC000853953012	GG	On-Demand	Reactive	F10	15	53
O=C(NCC1CCN(c2ccncc2)CC1)NNc1cc(F)cc(Cl)c1	ZINC000853953012	GG	On-Demand	Reactive	CACNA1I	74	38
C=C1C[C@@H]2CC[C@H](C1)N2c1nc(-c2cccc(OC)c2)no1	ZINC000853953076	CG	On-Demand	Mild	GRM5	15	51
C=C1C[C@@H]2CC[C@H](C1)N2c1ccnc(C(C)C)n1	ZINC000853953092	BG	On-Demand	Mild	SORD	105	43
O=[N+]([O-])c1ccc(NCC2(O)CCC(F)(F)CC2)c2nonc12	ZINC000853953205	EE	On-Demand	Bother	GSTM2	117	41
O=[N+]([O-])c1ccc(NCC2(O)CCC(F)(F)CC2)c2nonc12	ZINC000853953205	EE	On-Demand	Bother	GSTP1	72	41
O=[N+]([O-])c1ccc(NCC2(O)CCC(F)(F)CC2)c2nonc12	ZINC000853953205	EE	On-Demand	Bother	EPAS1	60	32
CC[C@H]1CCCCN1C(=O)COC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853953258	GF	On-Demand	Anodyne	FKBP1A	37	41
CC[C@@H]1CCCCN1C(=O)COC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853953259	GF	On-Demand	Anodyne	FKBP1A	37	41
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853953401	GE	On-Demand	Anodyne	MME	41	41
CC[C@@H]1CCCCN1C(=O)[C@@H](C)OC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853953638	GG	On-Demand	Anodyne	FKBP1A	43	36
CC[C@@H]1CCCCN1C(=O)[C@H](C)OC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853953640	GG	On-Demand	Anodyne	FKBP1A	43	36
CC[C@H]1CCCCN1C(=O)[C@H](C)OC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853953642	GG	On-Demand	Anodyne	FKBP1A	43	36
CC[C@H]1CCCCN1C(=O)[C@@H](C)OC(=O)CCc1cc(OC)c(O)c(OC)c1	ZINC000853953644	GG	On-Demand	Anodyne	FKBP1A	43	36
Cc1cc(C)cc(CC(=O)OCCCN2CCN(C(C)C)CC2)c1	ZINC000853953821	EF	On-Demand	Anodyne	HRH3	21	40
Cc1cc(C)cc(CC(=O)OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853954009	FH	On-Demand	Anodyne	GRIN2B	52	36
Cc1cc(C)cc(CC(=O)OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853954009	FH	On-Demand	Anodyne	SMO	38	41
Cc1cc(C)cc(CC(=O)OC[C@@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853954009	FH	On-Demand	Anodyne	L3MBTL3	49	37
Cc1cc(C)cc(CC(=O)OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853954010	FH	On-Demand	Anodyne	GRIN2B	52	36
Cc1cc(C)cc(CC(=O)OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853954010	FH	On-Demand	Anodyne	SMO	38	41
Cc1cc(C)cc(CC(=O)OC[C@H]2CCN(C(=O)c3ccccc3)C2)c1	ZINC000853954010	FH	On-Demand	Anodyne	L3MBTL3	49	37
COc1ccc2c(NCC3(O)CCC(F)(F)CC3)ccnc2c1	ZINC000853954139	DH	On-Demand	Anodyne	HRP1_PLAFA	87	43
COc1ccc2c(NCC3(O)CCC(F)(F)CC3)ccnc2c1	ZINC000853954139	DH	On-Demand	Anodyne	HNMT	55	34
CNS(=O)(=O)c1ccc(COC(=O)Cc2cc(C)cc(C)c2)cc1	ZINC000853954165	EE	On-Demand	Anodyne	CA2	23	49
CNS(=O)(=O)c1ccc(COC(=O)Cc2cc(C)cc(C)c2)cc1	ZINC000853954165	EE	On-Demand	Anodyne	CA4	23	49
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccccc1-n1cnnn1	ZINC000853954215	JG	On-Demand	Anodyne	KCNK3	96	41
C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COC(=O)c1ccccc1-n1cnnn1	ZINC000853954215	JG	On-Demand	Anodyne	KCNK9	64	35
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853954222	HG	On-Demand	Anodyne	IMDH_CRYPV	43	34
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2-n2cnnn2)c1	ZINC000853954327	GD	On-Demand	Anodyne	KCNK3	66	35
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2-n2cnnn2)c1	ZINC000853954327	GD	On-Demand	Anodyne	KCNK9	58	35
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2-n2cnnn2)c1	ZINC000853954328	GD	On-Demand	Anodyne	KCNK3	66	35
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2-n2cnnn2)c1	ZINC000853954328	GD	On-Demand	Anodyne	KCNK9	58	35
OC1CCN(c2ccc(CNc3ccc4nncn4n3)cc2)CC1	ZINC000853954346	DD	On-Demand	Clean	STAT6	16	41
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCc3[nH]c4ccccc4c3C2)c1	ZINC000853954347	GG	On-Demand	Anodyne	GNRHR	18	40
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCc3[nH]c4ccccc4c3C2)c1	ZINC000853954347	GG	On-Demand	Anodyne	SSTR4	48	36
O=[N+]([O-])c1cccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954357	EF	On-Demand	Clean	STAT6	32	45
OC1CCN(c2ccc(CNc3ncnc4sc5c(c34)CCCC5)cc2)CC1	ZINC000853954358	GI	On-Demand	Clean	STAT6	23	42
OC1CCN(c2ccc(CNc3nc(C(F)(F)F)[nH]c4ncnc3-4)cc2)CC1	ZINC000853954359	GF	On-Demand	Clean	STAT6	22	40
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2cccc(C(=O)NC3CC3)c2)c1	ZINC000853954362	GF	On-Demand	Anodyne	MAPK14	32	46
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	ACE	26	44
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	PPARA	15	42
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	MME	86	38
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	ANPEP	32	40
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	FCER2	53	36
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	CTSB	40	38
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	TIMP3	56	41
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	MMP8	20	41
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	MMP9	21	41
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	CAPN2	44	31
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	ACE2	41	35
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	LAP3	16	40
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	FPR1	46	35
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853954366	EF	On-Demand	Anodyne	AMP1_PLAFQ	45	38
Cn1cnc([N+](=O)[O-])c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954379	ED	On-Demand	Clean	STAT6	20	40
OC1CCN(c2ccc(CNc3ccc4ccccc4n3)cc2)CC1	ZINC000853954380	EH	On-Demand	Clean	STAT6	24	46
OC1CCN(c2ccc(CNc3ncnc4sc5c(c34)CCC5)cc2)CC1	ZINC000853954381	GH	On-Demand	Clean	STAT6	19	42
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA2	33	44
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA1	34	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA7	17	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA5B	37	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA4	33	44
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA5A	43	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA14	15	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA12	22	44
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	CA9	22	44
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	MTCA1	34	44
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954392	GE	On-Demand	Anodyne	P96878_MYCTU	42	44
OC1CCN(c2ccc(CNc3cc4ccccc4c(Cl)n3)cc2)CC1	ZINC000853954403	FI	On-Demand	Clean	STAT6	18	41
NC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853954407	FE	On-Demand	Clean	DRTS_TOXGO	15	46
NC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853954407	FE	On-Demand	Clean	TAAR1	15	43
NC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853954407	FE	On-Demand	Clean	STAT6	34	43
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)no3)cc2)CC1	ZINC000853954415	FG	On-Demand	Clean	S1PR4	19	40
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)no3)cc2)CC1	ZINC000853954415	FG	On-Demand	Clean	STAT6	19	43
Nc1nc(Cl)cc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853954416	EE	On-Demand	Clean	HRH4	40	35
Nc1nc(Cl)cc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853954416	EE	On-Demand	Clean	STAT6	22	41
OC1CCN(c2ccc(CNc3ccc(C(F)(F)F)cn3)cc2)CC1	ZINC000853954433	FH	On-Demand	Clean	STAT6	27	43
CC(=O)c1c(F)cccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954434	EH	On-Demand	Clean	STAT6	54	35
OC1CCN(c2ccc(CNc3ncc(C(F)(F)F)cc3Cl)cc2)CC1	ZINC000853954441	GI	On-Demand	Clean	STAT6	38	42
OC1CCN(c2ccc(CNc3ccccn3)cc2)CC1	ZINC000853954442	CF	On-Demand	Clean	GRIN2B	15	44
OC1CCN(c2ccc(CNc3ccccn3)cc2)CC1	ZINC000853954442	CF	On-Demand	Clean	CXCR4	16	61
OC1CCN(c2ccc(CNc3ccccn3)cc2)CC1	ZINC000853954442	CF	On-Demand	Clean	MERTK	20	40
OC1CCN(c2ccc(CNc3ccccn3)cc2)CC1	ZINC000853954442	CF	On-Demand	Clean	STAT6	26	46
NC(=O)c1cc([N+](=O)[O-])cnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954460	FD	On-Demand	Clean	STAT6	93	54
COc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853954468	DE	On-Demand	Clean	EPHB4	57	36
COc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853954468	DE	On-Demand	Clean	STAT6	27	43
OC1CCN(c2ccc(CNc3nc4ccccc4s3)cc2)CC1	ZINC000853954469	EH	On-Demand	Clean	LTA4H	23	48
OC1CCN(c2ccc(CNc3nc4ccccc4s3)cc2)CC1	ZINC000853954469	EH	On-Demand	Clean	ITK	17	42
OC1CCN(c2ccc(CNc3nc4ccccc4s3)cc2)CC1	ZINC000853954469	EH	On-Demand	Clean	STAT6	17	43
OC1CCN(c2ccc(CNc3nc4ccccc4s3)cc2)CC1	ZINC000853954469	EH	On-Demand	Clean	SLC27A1	18	48
OC1CCN(c2ccc(CNc3ccnc4cc(Cl)ccc34)cc2)CC1	ZINC000853954473	FI	On-Demand	Clean	HRP1_PLAFA	151	50
OC1CCN(c2ccc(CNc3ccnc4cc(Cl)ccc34)cc2)CC1	ZINC000853954473	FI	On-Demand	Clean	HNMT	69	48
OC1CCN(c2ccc(CNc3ccnc4cc(Cl)ccc34)cc2)CC1	ZINC000853954473	FI	On-Demand	Clean	BOTA	41	48
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954475	FF	On-Demand	Clean	SSTR5	39	42
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954475	FF	On-Demand	Clean	TTK	21	43
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954475	FF	On-Demand	Clean	AXL	30	42
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954475	FF	On-Demand	Clean	TYRO3	31	42
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954475	FF	On-Demand	Clean	MERTK	46	42
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954475	FF	On-Demand	Clean	STAT6	32	44
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954475	FF	On-Demand	Clean	HPGDS	37	41
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853954492	ID	On-Demand	Anodyne	DRD2	19	45
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853954492	ID	On-Demand	Anodyne	DRD4	43	45
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853954492	ID	On-Demand	Anodyne	ACHE	33	42
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853954492	ID	On-Demand	Anodyne	SIGMAR1	34	48
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853954492	ID	On-Demand	Anodyne	SSTR5	50	37
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853954492	ID	On-Demand	Anodyne	MCHR1	38	45
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(CN3CCOCC3)cc2)c1	ZINC000853954495	GF	On-Demand	Anodyne	EPHX2	21	45
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(CN3CCOCC3)cc2)c1	ZINC000853954495	GF	On-Demand	Anodyne	NOD2	41	37
O=[N+]([O-])c1c(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccn12	ZINC000853954503	FF	On-Demand	Clean	STAT6	45	46
OC1CCN(c2ccc(CNc3cncc(Cl)n3)cc2)CC1	ZINC000853954511	DF	On-Demand	Clean	STAT6	29	44
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCC(OCc3ccccc3)CC2)c1	ZINC000853954516	GH	On-Demand	Anodyne	GRIN2B	42	45
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCC(OCc3ccccc3)CC2)c1	ZINC000853954516	GH	On-Demand	Anodyne	SLC12A5	49	33
CC(=O)c1ccc(NC(=O)COC(=O)Cc2cc(C)cc(C)c2)cc1	ZINC000853954521	EG	On-Demand	Anodyne	ACR	44	35
N#Cc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853954526	DF	On-Demand	Mild	PDE5A	16	43
N#Cc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853954526	DF	On-Demand	Mild	MAP3K12	53	39
OC1CCN(c2ccc(CNc3ncc(Cl)cc3Cl)cc2)CC1	ZINC000853954527	FH	On-Demand	Clean	STAT6	43	45
Cc1cc(C)cc(CC(=O)OCC(=O)NCC2(c3ccccc3)CCOCC2)c1	ZINC000853954539	GG	On-Demand	Anodyne	KCNA3	46	39
Cc1cc(C)cc(CC(=O)OCC(=O)NCC2(c3ccccc3)CCOCC2)c1	ZINC000853954539	GG	On-Demand	Anodyne	ICMT	48	36
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1	ZINC000853954559	ED	On-Demand	Anodyne	DPP7	62	33
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)N2CCC[C@@H](C(N)=O)C2)c1	ZINC000853954560	ED	On-Demand	Anodyne	DPP7	62	33
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1	ZINC000853954561	ED	On-Demand	Anodyne	DPP7	62	33
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)N2CCC[C@H](C(N)=O)C2)c1	ZINC000853954562	ED	On-Demand	Anodyne	DPP7	62	33
Cc1cc(C)cc(CC(=O)OCc2ccc(S(=O)(=O)N3CCCC3)o2)c1	ZINC000853954563	GF	On-Demand	Anodyne	LPL	52	41
Cc1cc(C)cc(CC(=O)OCc2ccc(S(=O)(=O)N3CCCC3)o2)c1	ZINC000853954563	GF	On-Demand	Anodyne	LIPG	21	41
Cc1cc(C)cc(CC(=O)OCc2cc(=O)c(O)co2)c1	ZINC000853954564	CE	On-Demand	Anodyne	TYR	46	50
Cc1cc(C)cc(CC(=O)OCc2cc(=O)c(O)co2)c1	ZINC000853954564	CE	On-Demand	Anodyne	DAO	22	45
O=[N+]([O-])c1c(NCc2ccc(N3CCC(O)CC3)cc2)nc2sccn12	ZINC000853954566	FF	On-Demand	Clean	STAT6	34	44
OC1CCN(c2ccc(CNc3nc4ccccc4o3)cc2)CC1	ZINC000853954573	DG	On-Demand	Clean	SSTR5	36	42
OC1CCN(c2ccc(CNc3nc4ccccc4o3)cc2)CC1	ZINC000853954573	DG	On-Demand	Clean	STAT6	23	43
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c2nonc12	ZINC000853954578	FF	On-Demand	Clean	GSTM2	113	41
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c2nonc12	ZINC000853954578	FF	On-Demand	Clean	GSTP1	70	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1	ZINC000853954583	GF	On-Demand	Anodyne	MAPK14	32	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1	ZINC000853954583	GF	On-Demand	Anodyne	KCNK3	76	38
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1	ZINC000853954583	GF	On-Demand	Anodyne	KCNK9	44	38
CCC(=O)N1CCc2cc(C(=O)COC(=O)Cc3cc(C)cc(C)c3)ccc21	ZINC000853954585	GH	On-Demand	Anodyne	EIF2AK3	76	38
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccccc2C(=O)NC(C)C)c1	ZINC000853954589	GG	On-Demand	Anodyne	PTGER3	62	36
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000853954597	GF	On-Demand	Anodyne	PIK3CA	23	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000853954597	GF	On-Demand	Anodyne	MTOR	44	39
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000853954597	GF	On-Demand	Anodyne	EPHX2	15	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000853954597	GF	On-Demand	Anodyne	EPHB4	44	31
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000853954597	GF	On-Demand	Anodyne	STAT6	61	36
OC1CCN(c2ccc(CNc3ncccn3)cc2)CC1	ZINC000853954607	CE	On-Demand	Clean	GRIN2B	20	41
OC1CCN(c2ccc(CNc3ncccn3)cc2)CC1	ZINC000853954607	CE	On-Demand	Clean	TYRO3	18	40
OC1CCN(c2ccc(CNc3ncccn3)cc2)CC1	ZINC000853954607	CE	On-Demand	Clean	MERTK	30	40
OC1CCN(c2ccc(CNc3ncccn3)cc2)CC1	ZINC000853954607	CE	On-Demand	Clean	STAT6	54	49
Cc1cc(C)cc(CC(=O)OCCCn2cnc3c(N)ncnc32)c1	ZINC000853954611	EE	On-Demand	Anodyne	AHCY	81	45
Cc1cc(C)cc(CC(=O)OCCCn2cnc3c(N)ncnc32)c1	ZINC000853954611	EE	On-Demand	Anodyne	OXGR1	105	36
Cc1cc(C)cc(CC(=O)OCCCn2cnc3c(N)ncnc32)c1	ZINC000853954611	EE	On-Demand	Anodyne	DOT1L	47	32
Cc1cc(C)cc(CC(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)c1	ZINC000853954616	FF	On-Demand	Anodyne	NR3C2	25	40
Cc1cc(C)cc(CC(=O)OCC(=O)c2ccc3c(c2)NC(=O)CO3)c1	ZINC000853954616	FF	On-Demand	Anodyne	HTR1B	15	40
Cc1cc(C)cc(CC(=O)OCCCn2ccnc2)c1	ZINC000853954619	CF	On-Demand	Anodyne	CYP11B1	21	51
Cc1cc(C)cc(CC(=O)OCCCn2ccnc2)c1	ZINC000853954619	CF	On-Demand	Anodyne	TBXAS1	72	49
Cc1cc(C)cc(CC(=O)OCCCn2ccnc2)c1	ZINC000853954619	CF	On-Demand	Anodyne	HMOX1	19	43
Cc1cc(C)cc(CC(=O)OCCCn2ccnc2)c1	ZINC000853954619	CF	On-Demand	Anodyne	HMOX2	50	42
Cc1cc(C)cc(CC(=O)OCCCN2CCOCC2)c1	ZINC000853954625	CE	On-Demand	Anodyne	HRH3	23	44
Cc1cc(C)cc(CC(=O)OCCCN2CCOCC2)c1	ZINC000853954625	CE	On-Demand	Anodyne	EPHX2	20	46
CS(=O)(=O)c1ccccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954631	FF	On-Demand	Clean	STAT6	22	45
N#Cc1cc2c(nc1NCc1ccc(N3CCC(O)CC3)cc1)CCCC2	ZINC000853954640	FG	On-Demand	Mild	STAT6	20	40
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)N2CCCCC2)c1	ZINC000853954645	DF	On-Demand	Anodyne	DPP7	65	36
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)N2CCCCC2)c1	ZINC000853954646	DF	On-Demand	Anodyne	DPP7	65	36
COC(=O)/C(C)=C\COC(=O)Cc1cc(C)cc(C)c1	ZINC000853954649	CF	On-Demand	Anodyne	TRPA1	15	44
COC(=O)/C(C)=C/COC(=O)Cc1cc(C)cc(C)c1	ZINC000853954650	CF	On-Demand	Anodyne	TRPA1	15	44
Cc1cc(C)cc(CC(=O)OCC(=O)N(CCC(N)=O)Cc2ccccc2)c1	ZINC000853954658	GE	On-Demand	Anodyne	FFAR2	35	43
OC1CCN(c2ccc(CNc3ncnc4ccsc34)cc2)CC1	ZINC000853954669	EG	On-Demand	Clean	SIRT3	51	32
OC1CCN(c2ccc(CNc3ncnc4ccsc34)cc2)CC1	ZINC000853954669	EG	On-Demand	Clean	SIRT2	51	32
OC1CCN(c2ccc(CNc3ncnc4ccsc34)cc2)CC1	ZINC000853954669	EG	On-Demand	Clean	SIRT1	50	32
OC1CCN(c2ccc(CNc3ncnc4ccsc34)cc2)CC1	ZINC000853954669	EG	On-Demand	Clean	STAT6	17	41
Cc1cc(C)cc(CC(=O)OCCN2CCOCC2)c1	ZINC000853954672	CD	On-Demand	Anodyne	EPHX2	17	40
Cc1cc(C)cc(CC(=O)OCC(=O)c2ccc3c(c2)CCC(=O)N3C)c1	ZINC000853954673	FG	On-Demand	Anodyne	SRD5A1	28	40
CC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853954674	FG	On-Demand	Clean	BCL2L1	39	40
CC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853954674	FG	On-Demand	Clean	TAAR1	16	45
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1C(F)(F)F	ZINC000853954675	GI	On-Demand	Clean	SERPINE1	30	46
OC1CCN(c2ccc(CNc3cnccn3)cc2)CC1	ZINC000853954677	CE	On-Demand	Clean	PRKD1	42	34
OC1CCN(c2ccc(CNc3cnccn3)cc2)CC1	ZINC000853954677	CE	On-Demand	Clean	KARS	42	40
OC1CCN(c2ccc(CNc3cnccn3)cc2)CC1	ZINC000853954677	CE	On-Demand	Clean	STAT6	37	45
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)c2c(C)c(C)sc2n1	ZINC000853954697	GI	On-Demand	Clean	STAT6	24	42
CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)Cc2cc(C)cc(C)c2)C(C)C)c1	ZINC000853954714	GI	On-Demand	Anodyne	KCNK3	68	35
CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)Cc2cc(C)cc(C)c2)C(C)C)c1	ZINC000853954714	GI	On-Demand	Anodyne	KCNK9	62	35
CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)Cc2cc(C)cc(C)c2)C(C)C)c1	ZINC000853954715	GI	On-Demand	Anodyne	KCNK3	68	35
CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)Cc2cc(C)cc(C)c2)C(C)C)c1	ZINC000853954715	GI	On-Demand	Anodyne	KCNK9	62	35
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853954716	EG	On-Demand	Clean	STAT6	19	42
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853954716	EG	On-Demand	Clean	KCNJ1	24	40
OC1CCN(c2ccc(CNc3cnc4ccccc4n3)cc2)CC1	ZINC000853954729	EG	On-Demand	Clean	STAT6	44	48
OC1CCN(c2ccc(CNc3nnc(-c4ccccc4)s3)cc2)CC1	ZINC000853954731	FH	On-Demand	Clean	SPHK2	43	35
OC1CCN(c2ccc(CNc3nnc(-c4ccccc4)s3)cc2)CC1	ZINC000853954731	FH	On-Demand	Clean	STAT6	20	45
Cc1cc(C)cc(CC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	ZINC000853954733	FE	On-Demand	Reactive	KCNK3	61	43
Cc1cc(C)cc(CC(=O)OCC(=O)NNC(=O)c2cccc(C)c2)c1	ZINC000853954733	FE	On-Demand	Reactive	KCNK9	48	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	EDNRB	17	42
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	TACR1	18	47
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	CCKAR	32	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	BRS3	27	42
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	NMBR	20	44
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	GRPR	51	32
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	MMP9	17	46
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853954736	HE	On-Demand	Anodyne	KISS1R	63	31
O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954741	GI	On-Demand	Clean	SERPINE1	22	41
O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954741	GI	On-Demand	Clean	MET	16	40
Cc1cc(C)cc(CC(=O)OCCOc2cccc(S(C)(=O)=O)c2)c1	ZINC000853954748	FF	On-Demand	Anodyne	NR1H3	50	39
OC1CCN(c2ccc(CNc3ncnc4c3oc3ccccc34)cc2)CC1	ZINC000853954767	FH	On-Demand	Clean	STAT6	43	44
Cc1cc(C)cc(CC(=O)OCc2noc(Cc3ccccc3)n2)c1	ZINC000853954768	EH	On-Demand	Anodyne	TPSAB1	46	35
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)c2c3c(sc2n1)CCC3	ZINC000853954780	GI	On-Demand	Clean	STAT6	21	41
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853954786	HE	On-Demand	Mild	VIPR1	26	42
Cc1cc(C)cc(CC(=O)OCC(=O)c2ccc(NS(C)(=O)=O)cc2)c1	ZINC000853954795	GF	On-Demand	Anodyne	PTPRB	60	37
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853954796	FG	On-Demand	Anodyne	BIRC3	52	37
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853954796	FG	On-Demand	Anodyne	LUXR	44	36
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853954797	FG	On-Demand	Anodyne	BIRC3	52	37
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853954797	FG	On-Demand	Anodyne	LUXR	44	36
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853954798	FG	On-Demand	Anodyne	BIRC3	52	37
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853954798	FG	On-Demand	Anodyne	LUXR	44	36
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853954799	FG	On-Demand	Anodyne	BIRC3	52	37
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853954799	FG	On-Demand	Anodyne	LUXR	44	36
OC1CCN(c2ccc(CNc3nc[nH]c4ncnc3-4)cc2)CC1	ZINC000853954803	DD	On-Demand	Clean	STAT6	19	42
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@@H](C)C(=O)N2CCCCC2)c1	ZINC000853954815	FD	On-Demand	Anodyne	DPP7	59	34
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@H](C)C(=O)N2CCCCC2)c1	ZINC000853954816	FD	On-Demand	Anodyne	DPP7	59	34
N#Cc1cccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954818	DF	On-Demand	Mild	STAT6	27	44
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cccc(C(=O)N(C)C)c2)c1	ZINC000853954819	FF	On-Demand	Anodyne	KCNK3	63	37
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cccc(C(=O)N(C)C)c2)c1	ZINC000853954819	FF	On-Demand	Anodyne	KCNK9	41	36
Cc1cc(C)cc(CC(=O)OCc2ccc(NS(C)(=O)=O)cc2)c1	ZINC000853954820	EF	On-Demand	Anodyne	TRPV1	23	46
Cc1cc(C)cc(CC(=O)OCc2ccc(NS(C)(=O)=O)cc2)c1	ZINC000853954820	EF	On-Demand	Anodyne	PTPRB	79	41
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA2	82	46
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA1	75	46
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA7	47	45
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA5B	69	45
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA4	85	46
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA5A	74	45
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA12	39	46
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	CA9	51	46
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	NCE103	44	34
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	MTCA1	64	35
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(N)(=O)=O)ccc2C)c1	ZINC000853954838	GD	On-Demand	Anodyne	P96878_MYCTU	64	35
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(C)(=O)=O)ccc2F)c1	ZINC000853954849	GF	On-Demand	Anodyne	CA1	15	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc(S(C)(=O)=O)ccc2F)c1	ZINC000853954849	GF	On-Demand	Anodyne	CA4	17	40
N#Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954852	DF	On-Demand	Mild	STAT6	21	43
O=[N+]([O-])c1ccccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954854	EG	On-Demand	Clean	STAT6	20	43
CS(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853954855	FF	On-Demand	Clean	GHSR	22	47
CS(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853954855	FF	On-Demand	Clean	GPR119	40	50
CS(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1	ZINC000853954855	FF	On-Demand	Clean	STAT6	17	42
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA2	136	67
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA6	26	50
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA1	114	53
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA7	76	50
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA13	40	50
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA5B	60	42
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA4	97	67
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA5A	63	42
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA14	53	50
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA12	85	50
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA9	97	50
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CAH_METTE	37	44
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CYNT	34	41
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	NCE103	32	47
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	CA15	20	50
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	MTCA1	44	45
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	P96878_MYCTU	52	45
Cc1cc(C)cc(CC(=O)OCCc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853954870	EE	On-Demand	Anodyne	A6YCJ1_9METZ	25	44
Cn1ncc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1=O	ZINC000853954873	EE	On-Demand	Clean	STAT6	19	41
OCCNc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc12	ZINC000853954877	GF	On-Demand	Clean	STAT6	49	48
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	CA2	27	47
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	CA1	25	44
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	CA5B	29	42
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	CA4	24	47
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	CA5A	29	42
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	MAPK9	27	40
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	CA12	18	44
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	MAPK8	25	40
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954882	GE	On-Demand	Anodyne	CA9	30	44
N#Cc1cc([N+](=O)[O-])cnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853954884	FE	On-Demand	Mild	STAT6	33	42
Cc1cc(C)cc(CC(=O)OCC(=O)NCC2CCC2)c1	ZINC000853954897	CE	On-Demand	Anodyne	CACNA1I	41	36
CC(=O)c1cccc(NC(=O)COC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853954903	EG	On-Demand	Anodyne	KCNK3	87	39
CC(=O)c1cccc(NC(=O)COC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853954903	EG	On-Demand	Anodyne	KCNK9	48	39
Oc1nncc(NCc2ccc(N3CCC(O)CC3)cc2)c1Cl	ZINC000853954908	EE	On-Demand	Clean	STAT6	25	43
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000853954909	GG	On-Demand	Anodyne	STAT6	52	33
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000853954910	GG	On-Demand	Anodyne	STAT6	52	33
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954915	EF	On-Demand	Clean	SLC29A1	38	40
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954915	EF	On-Demand	Clean	STAT6	27	43
OC1CCN(c2ccc(CNc3ccc(Cl)nn3)cc2)CC1	ZINC000853954927	DF	On-Demand	Clean	STAT6	21	43
OC1CCN(c2ccc(CNc3ncccc3C(F)(F)F)cc2)CC1	ZINC000853954931	FH	On-Demand	Clean	TRPV1	28	41
OC1CCN(c2ccc(CNc3ncccc3C(F)(F)F)cc2)CC1	ZINC000853954931	FH	On-Demand	Clean	STAT6	49	46
Cc1cc(C)cc(CC(=O)OCC[C@H]2CCOC2=O)c1	ZINC000853954948	CE	On-Demand	Anodyne	LUXR	50	33
Cc1cc(C)cc(CC(=O)OCC[C@@H]2CCOC2=O)c1	ZINC000853954949	CE	On-Demand	Anodyne	LUXR	50	33
Cc1cc(C)cc(CC(=O)OCCCS(=O)(=O)c2ccccc2)c1	ZINC000853954953	EG	On-Demand	Anodyne	PTPRB	23	44
Cc1cc(C)cc(CC(=O)OCCNS(=O)(=O)c2ccccc2)c1	ZINC000853954958	EE	On-Demand	Anodyne	CA2	15	42
Cc1cc(C)cc(CC(=O)OCCNS(=O)(=O)c2ccccc2)c1	ZINC000853954958	EE	On-Demand	Anodyne	TBXA2R	43	37
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c2ccncc12	ZINC000853954962	GH	On-Demand	Clean	STAT6	19	40
Cc1cc(C)cc(CC(=O)OCCCOc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954992	GG	On-Demand	Anodyne	CA7	15	41
Cc1cc(C)cc(CC(=O)OCCCOc2ccc(S(C)(=O)=O)cc2)c1	ZINC000853954992	GG	On-Demand	Anodyne	O49150_SOLTU	47	33
COC(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954997	ED	On-Demand	Clean	MERTK	51	35
COC(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853954997	ED	On-Demand	Clean	STAT6	77	39
COc1cccc([N+](=O)[O-])c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955000	FG	On-Demand	Clean	SSTR1	50	40
OC1CCN(c2ccc(CNc3cncc(-c4ccccc4)n3)cc2)CC1	ZINC000853955011	FH	On-Demand	Clean	STAT6	24	46
OC1CCN(c2ccc(CNc3cncc(-c4ccccc4)n3)cc2)CC1	ZINC000853955011	FH	On-Demand	Clean	VCP	53	38
OC1CCN(c2ccc(CNc3ncc(C(F)(F)F)s3)cc2)CC1	ZINC000853955012	FH	On-Demand	Clean	MLYCD	45	41
OC1CCN(c2ccc(CNc3ncc(C(F)(F)F)s3)cc2)CC1	ZINC000853955012	FH	On-Demand	Clean	STAT6	22	40
CC(C)c1ccc2ncnc(NCc3ccc(N4CCC(O)CC4)cc3)c2c1	ZINC000853955013	GI	On-Demand	Clean	CLK4	61	37
CCOC(=O)N1CCC(NC(=O)COC(=O)Cc2cc(C)cc(C)c2)CC1	ZINC000853955021	GE	On-Demand	Anodyne	CCR8	25	42
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc(N(C)C)n1	ZINC000853955022	ED	On-Demand	Clean	STAT6	25	43
O=[N+]([O-])c1cc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc2s1	ZINC000853955031	GG	On-Demand	Clean	STAT6	28	41
C#CCCCOc1cccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955032	FG	On-Demand	Mild	STAT6	17	41
OC1CCN(c2ccc(CNc3ccnc4c(Cl)cccc34)cc2)CC1	ZINC000853955033	FI	On-Demand	Clean	HRP1_PLAFA	55	34
OC1CCN(c2ccc(CNc3ccnc4c(Cl)cccc34)cc2)CC1	ZINC000853955033	FI	On-Demand	Clean	HNMT	52	34
OC1CCN(c2ccc(CNc3ccnc4c(Cl)cccc34)cc2)CC1	ZINC000853955033	FI	On-Demand	Clean	STAT6	24	41
OC1CCN(c2ccc(CNc3nnc(C4CC4)o3)cc2)CC1	ZINC000853955034	DF	On-Demand	Clean	STAT6	16	40
OC1CCN(c2ccc(CNc3ncnc4c3CCCCC4)cc2)CC1	ZINC000853955037	FG	On-Demand	Clean	STAT6	19	42
OC1CCN(c2ccc(CNc3ccc(C(F)(F)F)nn3)cc2)CC1	ZINC000853955039	FG	On-Demand	Clean	STAT6	28	43
CCNc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc(NC(C)(C)C)n1	ZINC000853955041	GG	On-Demand	Clean	STAT6	17	41
OC1CCN(c2ccc(CNc3cccc(Cl)n3)cc2)CC1	ZINC000853955042	DG	On-Demand	Clean	STAT6	25	42
CS(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c(F)c1	ZINC000853955048	GF	On-Demand	Clean	SLC6A9	28	42
CS(=O)(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c(F)c1	ZINC000853955048	GF	On-Demand	Clean	GPR119	58	51
COc1cc2c(cc1OC)CN(C(=O)COC(=O)Cc1cc(C)cc(C)c1)CC2	ZINC000853955049	GF	On-Demand	Anodyne	ABCB1B	46	35
COc1cc2c(cc1OC)CN(C(=O)COC(=O)Cc1cc(C)cc(C)c1)CC2	ZINC000853955049	GF	On-Demand	Anodyne	ABCB1	19	54
COc1ccc(NC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)cc1OC	ZINC000853955050	FG	On-Demand	Anodyne	ENPP1	73	35
OC1CCN(c2ccc(CNc3ncc(Br)cc3Cl)cc2)CC1	ZINC000853955061	GI	On-Demand	Clean	STAT6	34	44
OC1CCN(c2ccc(CNc3ncccc3Cl)cc2)CC1	ZINC000853955062	DG	On-Demand	Clean	STAT6	33	46
OC1CCN(c2ccc(CNc3nccc(Oc4ccccc4)n3)cc2)CC1	ZINC000853955063	GH	On-Demand	Clean	EPHB4	44	31
OC1CCN(c2ccc(CNc3nccc(Oc4ccccc4)n3)cc2)CC1	ZINC000853955063	GH	On-Demand	Clean	STAT6	49	49
NC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955072	ED	On-Demand	Clean	SPHK2	80	34
NC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955072	ED	On-Demand	Clean	SPHK1	59	34
NC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955072	ED	On-Demand	Clean	STAT6	62	36
NC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955072	ED	On-Demand	Clean	TRPC6	45	35
COc1ccc2c(NCc3ccc(N4CCC(O)CC4)cc3)ccnc2c1	ZINC000853955085	FH	On-Demand	Clean	HRP1_PLAFA	106	50
COc1ccc2c(NCc3ccc(N4CCC(O)CC4)cc3)ccnc2c1	ZINC000853955085	FH	On-Demand	Clean	HNMT	62	37
COc1ccc2c(NCc3ccc(N4CCC(O)CC4)cc3)ccnc2c1	ZINC000853955085	FH	On-Demand	Clean	MET	42	33
O=[N+]([O-])c1cnc2ccc(NCc3ccc(N4CCC(O)CC4)cc3)nn12	ZINC000853955090	FE	On-Demand	Clean	STAT6	18	40
CCNc1nccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955093	EE	On-Demand	Clean	STAT6	34	45
COC(=O)c1cncnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955094	ED	On-Demand	Clean	STAT6	65	48
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000853955095	FE	On-Demand	Anodyne	BMP1	50	36
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000853955095	FE	On-Demand	Anodyne	NOS2	107	42
OC1CCN(c2ccc(CNc3nc(-c4ccc(F)cc4)cs3)cc2)CC1	ZINC000853955097	GJ	On-Demand	Clean	MAOB	20	44
OC1CCN(c2ccc(CNc3nc(-c4ccc(F)cc4)cs3)cc2)CC1	ZINC000853955097	GJ	On-Demand	Clean	SPHK2	94	42
OC1CCN(c2ccc(CNc3nc(-c4ccc(F)cc4)cs3)cc2)CC1	ZINC000853955097	GJ	On-Demand	Clean	SPHK1	73	52
Cn1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1=O	ZINC000853955100	DD	On-Demand	Clean	STAT6	36	45
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ccc1[N+](=O)[O-]	ZINC000853955101	EF	On-Demand	Clean	STAT6	19	40
O=[N+]([O-])c1ccc2nc(NCc3ccc(N4CCC(O)CC4)cc3)nc(O)c2c1	ZINC000853955104	GF	On-Demand	Clean	STAT6	22	40
O=[N+]([O-])c1ccc2nc(NCc3ccc(N4CCC(O)CC4)cc3)nc(O)c2c1	ZINC000853955104	GF	On-Demand	Clean	VCP	25	41
COC(=O)C1CCN(C(=O)COC(=O)Cc2cc(C)cc(C)c2)CC1	ZINC000853955106	ED	On-Demand	Anodyne	PTR1	47	34
OC1CCN(c2ccc(CNc3ccc4c(Cl)cccc4n3)cc2)CC1	ZINC000853955110	FI	On-Demand	Clean	STAT6	25	43
OC1CCN(c2ccc(CNc3nnc(C(F)F)s3)cc2)CC1	ZINC000853955111	EG	On-Demand	Clean	SPHK2	63	33
OC1CCN(c2ccc(CNc3nnc(C(F)F)s3)cc2)CC1	ZINC000853955111	EG	On-Demand	Clean	SPHK1	60	33
OC1CCN(c2ccc(CNc3noc(-c4ccccc4)n3)cc2)CC1	ZINC000853955114	FG	On-Demand	Clean	S1PR4	19	40
OC1CCN(c2ccc(CNc3noc(-c4ccccc4)n3)cc2)CC1	ZINC000853955114	FG	On-Demand	Clean	STAT6	38	46
OC1CCN(c2ccc(CNc3noc(-c4ccccc4)n3)cc2)CC1	ZINC000853955114	FG	On-Demand	Clean	VCP	41	34
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)sc1S(N)(=O)=O	ZINC000853955115	GD	On-Demand	Clean	STAT6	16	40
Oc1cccc2c(NCc3ccc(N4CCC(O)CC4)cc3)ccnc12	ZINC000853955117	EH	On-Demand	Clean	STAT6	24	42
N#Cc1c(NCc2ccc(N3CCC(O)CC3)cc2)cccc1S(N)(=O)=O	ZINC000853955120	GD	On-Demand	Mild	STAT6	18	40
O=C(NC1CCCC1)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853955123	GF	On-Demand	Clean	STAT6	31	44
O=c1c(NCc2ccc(N3CCC(O)CC3)cc2)nccn1C(F)F	ZINC000853955132	FE	On-Demand	Clean	CASP3	53	33
O=c1c(NCc2ccc(N3CCC(O)CC3)cc2)nccn1C(F)F	ZINC000853955132	FE	On-Demand	Clean	CASP8	45	33
O=c1c(NCc2ccc(N3CCC(O)CC3)cc2)nccn1C(F)F	ZINC000853955132	FE	On-Demand	Clean	STAT6	31	43
CC(=O)c1nc(NCc2ccc(N3CCC(O)CC3)cc2)sc1C	ZINC000853955133	EG	On-Demand	Clean	STAT6	17	41
OC1CCN(c2ccc(CNc3ccnc(N4CCOCC4)n3)cc2)CC1	ZINC000853955134	FD	On-Demand	Clean	PIK3CA	20	48
OC1CCN(c2ccc(CNc3ccnc(N4CCOCC4)n3)cc2)CC1	ZINC000853955134	FD	On-Demand	Clean	EPHB4	58	33
OC1CCN(c2ccc(CNc3ccnc(N4CCOCC4)n3)cc2)CC1	ZINC000853955134	FD	On-Demand	Clean	STAT6	70	39
OC1CCN(c2ccc(CNc3ccc(OC(F)F)cn3)cc2)CC1	ZINC000853955135	EG	On-Demand	Clean	STAT6	22	41
O=C1CCCN1c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)cn1	ZINC000853955136	FE	On-Demand	Clean	STAT6	16	40
OC1CCN(c2ccc(CNc3ncccc3Br)cc2)CC1	ZINC000853955137	FG	On-Demand	Clean	STAT6	30	46
N#Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1[N+](=O)[O-]	ZINC000853955140	FG	On-Demand	Mild	STAT6	22	40
OC1CCN(c2ccc(CNc3ncc(Cl)cn3)cc2)CC1	ZINC000853955146	DF	On-Demand	Clean	STAT6	68	49
OC1CCN(c2ccc(CNc3ncnc4c(F)cccc34)cc2)CC1	ZINC000853955149	FG	On-Demand	Clean	STAT6	49	34
Cn1ncc2c(NCc3ccc(N4CCC(O)CC4)cc3)ccnc21	ZINC000853955151	EF	On-Demand	Clean	STAT6	18	40
OC1CCN(c2ccc(CNc3ccnc(Cl)c3)cc2)CC1	ZINC000853955152	DG	On-Demand	Clean	STAT6	24	42
OC1CCN(c2ccc(CNc3nccc(N[C@H]4CCCOC4)n3)cc2)CC1	ZINC000853955154	GF	On-Demand	Clean	PRKD1	52	36
OC1CCN(c2ccc(CNc3nccc(N[C@H]4CCCOC4)n3)cc2)CC1	ZINC000853955154	GF	On-Demand	Clean	MAPK1	53	35
OC1CCN(c2ccc(CNc3nccc(N[C@H]4CCCOC4)n3)cc2)CC1	ZINC000853955154	GF	On-Demand	Clean	MAPK9	19	42
OC1CCN(c2ccc(CNc3nccc(N[C@H]4CCCOC4)n3)cc2)CC1	ZINC000853955154	GF	On-Demand	Clean	MAPK10	15	42
OC1CCN(c2ccc(CNc3nccc(N[C@H]4CCCOC4)n3)cc2)CC1	ZINC000853955154	GF	On-Demand	Clean	MAPK8	15	42
OC1CCN(c2ccc(CNc3nccc(N[C@H]4CCCOC4)n3)cc2)CC1	ZINC000853955154	GF	On-Demand	Clean	EPHB4	42	33
OC1CCN(c2ccc(CNc3nccc(N[C@@H]4CCCOC4)n3)cc2)CC1	ZINC000853955155	GF	On-Demand	Clean	PRKD1	52	36
OC1CCN(c2ccc(CNc3nccc(N[C@@H]4CCCOC4)n3)cc2)CC1	ZINC000853955155	GF	On-Demand	Clean	MAPK1	53	35
OC1CCN(c2ccc(CNc3nccc(N[C@@H]4CCCOC4)n3)cc2)CC1	ZINC000853955155	GF	On-Demand	Clean	MAPK9	19	42
OC1CCN(c2ccc(CNc3nccc(N[C@@H]4CCCOC4)n3)cc2)CC1	ZINC000853955155	GF	On-Demand	Clean	MAPK10	15	42
OC1CCN(c2ccc(CNc3nccc(N[C@@H]4CCCOC4)n3)cc2)CC1	ZINC000853955155	GF	On-Demand	Clean	MAPK8	15	42
OC1CCN(c2ccc(CNc3nccc(N[C@@H]4CCCOC4)n3)cc2)CC1	ZINC000853955155	GF	On-Demand	Clean	EPHB4	42	33
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	ACE	32	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	OPRM1	43	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	OPRD1	40	41
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	MME	96	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	ANPEP	59	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	TACR1	23	57
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CTSD	15	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CMA1	40	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CTRA_BOVIN	33	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	FCER2	71	35
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CTSB	54	40
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	PAPA1_CARPA	66	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CYSP_TRYCR	53	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CTSL	50	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	PGA	21	42
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	NPFFR2	46	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	TIMP3	48	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	TPH1	42	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CAPNS1	73	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	HLA-DRB1	66	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CTSS	19	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CAPN1	73	39
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	MMP9	17	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CAPN2	48	38
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	ACE2	61	37
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	MMP1	22	44
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	FPR1	63	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	CTRB_BOVIN	47	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	PLM2_PLAFA	42	34
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	BLA1_STEMA	42	36
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955156	FF	On-Demand	Anodyne	NPFFR1	61	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	ACE	32	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	OPRM1	43	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	OPRD1	40	41
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	MME	96	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	ANPEP	59	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	TACR1	23	57
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CTSD	15	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CMA1	40	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CTRA_BOVIN	33	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	FCER2	71	35
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CTSB	54	40
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	PAPA1_CARPA	66	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CYSP_TRYCR	53	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CTSL	50	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	PGA	21	42
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	NPFFR2	46	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	TIMP3	48	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	TPH1	42	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CAPNS1	73	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	HLA-DRB1	66	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CTSS	19	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CAPN1	73	39
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	MMP9	17	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CAPN2	48	38
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	ACE2	61	37
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	MMP1	22	44
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	FPR1	63	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	CTRB_BOVIN	47	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	PLM2_PLAFA	42	34
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	BLA1_STEMA	42	36
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955157	FF	On-Demand	Anodyne	NPFFR1	61	39
Cc1cc(Br)cnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955162	GH	On-Demand	Clean	STAT6	38	44
O=[N+]([O-])c1cc(NCc2ccc(N3CCC(O)CC3)cc2)ccc1C(F)(F)F	ZINC000853955163	GI	On-Demand	Clean	SERPINE1	28	44
COc1c(C)nc(C2CC2)nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955165	FG	On-Demand	Clean	PDE5A	17	46
COc1c(C)nc(C2CC2)nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955165	FG	On-Demand	Clean	STAT6	22	40
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c1	ZINC000853955172	FF	On-Demand	Anodyne	ACR	48	36
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(C(N)=O)cc2)c1	ZINC000853955173	FF	On-Demand	Anodyne	ACR	48	36
OC1CCN(c2ccc(CNc3cc(Br)ccn3)cc2)CC1	ZINC000853955180	FG	On-Demand	Clean	STAT6	26	42
CS(=O)(=O)c1cccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955186	FE	On-Demand	Clean	STAT6	38	46
O=[N+]([O-])c1cccc2ncnc(NCc3ccc(N4CCC(O)CC4)cc3)c12	ZINC000853955188	GG	On-Demand	Clean	STAT6	29	42
N#Cc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1[N+](=O)[O-]	ZINC000853955189	FE	On-Demand	Mild	STAT6	21	41
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955190	GE	On-Demand	Anodyne	CA2	50	53
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955190	GE	On-Demand	Anodyne	CA1	40	44
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955190	GE	On-Demand	Anodyne	CA5B	51	35
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955190	GE	On-Demand	Anodyne	CA4	51	53
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955190	GE	On-Demand	Anodyne	CA5A	59	35
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955190	GE	On-Demand	Anodyne	CA12	28	45
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955190	GE	On-Demand	Anodyne	CA9	36	41
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955191	GE	On-Demand	Anodyne	CA2	50	53
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955191	GE	On-Demand	Anodyne	CA1	40	44
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955191	GE	On-Demand	Anodyne	CA5B	51	35
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955191	GE	On-Demand	Anodyne	CA4	51	53
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955191	GE	On-Demand	Anodyne	CA5A	59	35
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955191	GE	On-Demand	Anodyne	CA12	28	45
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccc(S(N)(=O)=O)c2)c1	ZINC000853955191	GE	On-Demand	Anodyne	CA9	36	41
Cc1cc(C)cc(CC(=O)OCc2nc(COc3ccc(F)cc3)no2)c1	ZINC000853955195	FH	On-Demand	Anodyne	TPSAB1	41	33
OC1CCN(c2ccc(CNc3nnc(-c4ccccn4)s3)cc2)CC1	ZINC000853955196	FG	On-Demand	Clean	SPHK2	44	33
OC1CCN(c2ccc(CNc3nnc(-c4ccccn4)s3)cc2)CC1	ZINC000853955196	FG	On-Demand	Clean	STAT6	17	43
N#Cc1ccc(C(F)(F)F)nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955214	GH	On-Demand	Mild	STAT6	22	40
OC1CCN(c2ccc(CNc3ccnc(Cc4ccccc4)n3)cc2)CC1	ZINC000853955232	FH	On-Demand	Clean	STAT6	28	47
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	JAK2	18	47
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	MAPK1	49	37
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	MAPK10	18	41
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	EPHB4	84	37
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	AXL	29	41
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	TYRO3	30	41
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	MERTK	48	41
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	STAT6	74	44
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	MRGPRX1	41	36
OC1CCN(c2ccc(CNc3nccc(N4CCOCC4)n3)cc2)CC1	ZINC000853955233	FD	On-Demand	Clean	SMG1	31	41
OC1CCN(c2ccc(CNc3ccnc(N4CCCCC4)n3)cc2)CC1	ZINC000853955247	FG	On-Demand	Clean	STAT6	17	40
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA2	121	53
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA6	23	43
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA1	102	52
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA7	77	52
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA13	33	43
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA5B	53	36
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA4	88	53
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA5A	56	36
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA14	49	43
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA12	76	52
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA9	87	52
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CYNT	29	40
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	NCE103	30	40
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	CA15	18	43
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	MTCA1	41	48
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	P96878_MYCTU	48	48
Cc1cc(C)cc(CC(=O)OCCOc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853955258	FE	On-Demand	Anodyne	A6YCJ1_9METZ	25	40
CCCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955261	FF	On-Demand	Clean	AXL	33	41
CCCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955261	FF	On-Demand	Clean	TYRO3	35	41
CCCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955261	FF	On-Demand	Clean	MERTK	55	41
CCCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955261	FF	On-Demand	Clean	STAT6	29	42
CCCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955261	FF	On-Demand	Clean	NAMPT	17	40
OC1CCN(c2ccc(CNc3cc(-n4ccnc4)ncn3)cc2)CC1	ZINC000853955269	FE	On-Demand	Clean	NOS2	65	35
C=CCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955273	FF	On-Demand	Mild	STAT6	32	44
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)c2c(C)csc2n1	ZINC000853955275	FH	On-Demand	Clean	STAT6	25	42
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853955282	FG	On-Demand	Anodyne	BDKRB1	26	43
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853955282	FG	On-Demand	Anodyne	LUXR	73	42
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853955282	FG	On-Demand	Anodyne	TRAR	82	39
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@@H]2CCOc3ccccc32)c1	ZINC000853955282	FG	On-Demand	Anodyne	LASR	44	39
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853955283	FG	On-Demand	Anodyne	BDKRB1	26	43
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853955283	FG	On-Demand	Anodyne	LUXR	73	42
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853955283	FG	On-Demand	Anodyne	TRAR	82	39
Cc1cc(C)cc(CC(=O)OCC(=O)N[C@H]2CCOc3ccccc32)c1	ZINC000853955283	FG	On-Demand	Anodyne	LASR	44	39
Cc1cc(C)cc(CC(=O)OCc2nnnn2Cc2ccccc2)c1	ZINC000853955295	EF	On-Demand	Anodyne	PLA2G2A	55	36
Cc1cc(C)cc(CC(=O)OCc2nnnn2Cc2ccccc2)c1	ZINC000853955295	EF	On-Demand	Anodyne	GHSR	16	40
O=C(c1cccnc1NCc1ccc(N2CCC(O)CC2)cc1)N1CCCCC1	ZINC000853955298	GG	On-Demand	Clean	STAT6	56	47
N#Cc1cc(NCc2ccc(N3CCC(O)CC3)cc2)ccc1C(F)(F)F	ZINC000853955314	GI	On-Demand	Mild	AR	25	40
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@@H]2C)c1	ZINC000853955319	DF	On-Demand	Anodyne	CPT1A	45	33
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@H]2C)c1	ZINC000853955321	DF	On-Demand	Anodyne	CPT1A	45	33
COc1ccc(CNC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)cc1OC	ZINC000853955323	GG	On-Demand	Anodyne	TRPV1	23	40
COc1ccc(CNC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)cc1OC	ZINC000853955323	GG	On-Demand	Anodyne	MT-ND1	23	42
O=[N+]([O-])c1cc2ccccc2nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955325	GH	On-Demand	Clean	STAT6	34	44
OC1CCN(c2ccc(CNc3nc(-c4ccccc4F)cs3)cc2)CC1	ZINC000853955329	GJ	On-Demand	Clean	SPHK2	90	54
OC1CCN(c2ccc(CNc3nc(-c4ccccc4F)cs3)cc2)CC1	ZINC000853955329	GJ	On-Demand	Clean	SPHK1	69	54
OC1CCN(c2ccc(CNc3nc(-c4ccccc4F)cs3)cc2)CC1	ZINC000853955329	GJ	On-Demand	Clean	STAT6	22	40
OC1CCN(c2ccc(CNc3nc4c(F)cccc4o3)cc2)CC1	ZINC000853955331	EH	On-Demand	Clean	STAT6	43	32
N#Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1Cl	ZINC000853955332	EH	On-Demand	Mild	MAP3K8	79	33
O=C(NCCO)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853955336	FC	On-Demand	Clean	SCD1	35	43
O=C(NCCO)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853955336	FC	On-Demand	Clean	STAT6	21	42
COC(=O)c1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955343	ED	On-Demand	Clean	STAT6	25	42
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccccc2N2CCCC2=O)c1	ZINC000853955345	GG	On-Demand	Anodyne	KCNQ2	69	41
OC1CCN(c2ccc(CNc3nccc4ccc(F)cc34)cc2)CC1	ZINC000853955349	FH	On-Demand	Clean	STAT6	72	36
OC1CCN(c2ccc(CNc3ncnc4ccc(F)cc34)cc2)CC1	ZINC000853955351	FG	On-Demand	Clean	EGFR	15	48
OC1CCN(c2ccc(CNc3ncnc4ccc(F)cc34)cc2)CC1	ZINC000853955351	FG	On-Demand	Clean	CLK4	65	42
OC1CCN(c2ccc(CNc3ncnc4ccc(F)cc34)cc2)CC1	ZINC000853955351	FG	On-Demand	Clean	STAT6	40	34
CC(=O)c1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853955357	EF	On-Demand	Clean	PRKD1	60	36
CC(=O)c1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853955357	EF	On-Demand	Clean	STAT6	32	41
CN(C)C(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853955359	FD	On-Demand	Clean	STAT6	27	43
Nc1nc(NCc2ccc(N3CCC(O)CC3)cc2)cc(-n2cccn2)n1	ZINC000853955367	FD	On-Demand	Clean	STAT6	20	40
OC1CCN(c2ccc(CNc3ccc4ccc(F)cc4n3)cc2)CC1	ZINC000853955378	FH	On-Demand	Clean	STAT6	43	34
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955381	EE	On-Demand	Anodyne	PGA	29	44
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)cc1C#N	ZINC000853955382	FG	On-Demand	Mild	PDE5A	20	45
OC1CCN(c2ccc(CNc3cncc4ncnn34)cc2)CC1	ZINC000853955383	DD	On-Demand	Clean	STAT6	28	41
OC1CCN(c2ccc(CNc3ncncc3Br)cc2)CC1	ZINC000853955385	FF	On-Demand	Clean	STAT6	30	45
CCCCCNC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853955386	CF	On-Demand	Anodyne	ASAH1	65	36
OC1CCN(c2ccc(CNc3cc4cc[nH]c4cn3)cc2)CC1	ZINC000853955388	DG	On-Demand	Clean	STAT6	25	41
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ccc1Br	ZINC000853955389	GH	On-Demand	Clean	STAT6	17	41
OC1CCN(c2ccc(CNc3ccnc4ccsc34)cc2)CC1	ZINC000853955390	EH	On-Demand	Clean	STAT6	17	41
Cc1nnc(NCc2ccc(N3CCC(O)CC3)cc2)nc1C	ZINC000853955398	DE	On-Demand	Clean	STAT6	34	45
OC1CCN(c2ccc(CNc3nccnc3-c3ccccc3)cc2)CC1	ZINC000853955404	FH	On-Demand	Clean	STAT6	44	49
Cc1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955407	CE	On-Demand	Clean	STAT6	19	42
OCCOc1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955412	ED	On-Demand	Clean	STAT6	18	40
Cn1ncc(NCc2ccc(N3CCC(O)CC3)cc2)c(Br)c1=O	ZINC000853955416	GE	On-Demand	Clean	STAT6	17	41
Cc1cc(C)cc(CC(=O)OCC(=O)NCCc2nc3ccccc3s2)c1	ZINC000853955417	GG	On-Demand	Anodyne	CSNK1D	26	40
OC1CCN(c2ccc(CNc3cc(C(F)(F)F)nc4ncnn34)cc2)CC1	ZINC000853955420	GF	On-Demand	Clean	STAT6	37	40
OC1CCN(c2ccc(CNc3ccnc(C(F)(F)F)c3)cc2)CC1	ZINC000853955421	FH	On-Demand	Clean	STAT6	33	42
OC1CCN(c2ccc(CNc3cncc(-c4cccs4)n3)cc2)CC1	ZINC000853955423	FH	On-Demand	Clean	STAT6	16	40
CC(C)c1noc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)c2)n1	ZINC000853955428	GH	On-Demand	Clean	PRKD1	65	34
CN(C)S(=O)(=O)c1ccccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955437	GF	On-Demand	Clean	STAT6	17	42
CC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955439	EF	On-Demand	Clean	STAT6	45	46
OC1CCN(c2ccc(CNc3ncc(Cl)cc3Br)cc2)CC1	ZINC000853955441	GI	On-Demand	Clean	STAT6	34	44
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955445	FG	On-Demand	Clean	STAT6	18	40
COc1cccc(C2(NC(=O)NC[C@H]3COC4(CCCC4)O3)CCC2)c1	ZINC000853955446	FG	On-Demand	Anodyne	ADRA1D	15	42
COc1cccc(C2(NC(=O)NC[C@H]3COC4(CCCC4)O3)CCC2)c1	ZINC000853955446	FG	On-Demand	Anodyne	ADRA1B	15	42
Cc1cc(C)cc(CC(=O)OCC(=O)NC[C@H]2COc3ccccc3O2)c1	ZINC000853955447	FE	On-Demand	Anodyne	PTGDR	25	40
COc1cccc(C2(NC(=O)NC[C@@H]3COC4(CCCC4)O3)CCC2)c1	ZINC000853955448	FG	On-Demand	Anodyne	ADRA1D	15	42
COc1cccc(C2(NC(=O)NC[C@@H]3COC4(CCCC4)O3)CCC2)c1	ZINC000853955448	FG	On-Demand	Anodyne	ADRA1B	15	42
Cc1cc(C)cc(CC(=O)OCC(=O)NC[C@@H]2COc3ccccc3O2)c1	ZINC000853955451	FE	On-Demand	Anodyne	PTGDR	25	40
N#Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cn1	ZINC000853955457	DF	On-Demand	Mild	STAT6	34	45
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)s1	ZINC000853955459	EF	On-Demand	Clean	STAT6	19	41
OC1CCN(c2ccc(CNc3nccn4nnnc34)cc2)CC1	ZINC000853955462	ED	On-Demand	Clean	STAT6	36	46
O=C1CSc2ncnc(NCc3ccc(N4CCC(O)CC4)cc3)c2N1	ZINC000853955472	FE	On-Demand	Clean	STAT6	21	42
O=S(=O)(c1ccccc1NCc1ccc(N2CCC(O)CC2)cc1)C(F)F	ZINC000853955477	GG	On-Demand	Clean	STAT6	17	42
OC1CCN(c2ccc(CNc3nccn4cnnc34)cc2)CC1	ZINC000853955482	DD	On-Demand	Clean	STAT6	25	43
OC1CCN(c2ccc(CNc3ncc(Cl)s3)cc2)CC1	ZINC000853955485	DG	On-Demand	Clean	STAT6	21	42
NC(=O)c1cc(Cl)nnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955492	FD	On-Demand	Clean	PDE5A	15	45
NC(=O)c1cc(Cl)nnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955492	FD	On-Demand	Clean	STAT6	93	55
N#Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1C(F)(F)F	ZINC000853955496	GI	On-Demand	Mild	AR	62	48
COC(=O)c1cccc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955511	EE	On-Demand	Clean	STAT6	29	43
CCc1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955513	DG	On-Demand	Clean	SPHK2	77	35
CCc1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955513	DG	On-Demand	Clean	SPHK1	59	35
Oc1cc(NCc2ccc(N3CCC(O)CC3)cc2)c2ncccc2n1	ZINC000853955517	FF	On-Demand	Clean	STAT6	26	42
OC1CCN(c2ccc(CNc3ccc(OCC(F)(F)F)nn3)cc2)CC1	ZINC000853955527	GF	On-Demand	Clean	STAT6	22	40
COCc1cc([N+](=O)[O-])ccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955530	FG	On-Demand	Clean	CACNA1D	43	33
OC1CCN(c2ccc(CNc3nccc4occc34)cc2)CC1	ZINC000853955532	DG	On-Demand	Clean	STAT6	27	42
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2sc3c(c2C(N)=O)CCC3)c1	ZINC000853955547	GF	On-Demand	Anodyne	VIPR1	26	43
OC1CCN(c2ccc(CNc3ncc(Cl)cc3F)cc2)CC1	ZINC000853955551	EG	On-Demand	Clean	STAT6	61	36
OC1CCN(c2ccc(CNc3cncc(-n4cncn4)n3)cc2)CC1	ZINC000853955556	FD	On-Demand	Clean	STAT6	16	40
OC1CCN(c2ccc(CNc3nccc4sccc34)cc2)CC1	ZINC000853955562	EH	On-Demand	Clean	STAT6	17	41
Cc1cc(C)c([N+](=O)[O-])c(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955567	FG	On-Demand	Clean	STAT6	30	41
OC1CCN(c2ccc(CNc3nnc(Cc4ccccc4)s3)cc2)CC1	ZINC000853955573	GH	On-Demand	Clean	STAT6	20	46
Nc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1[N+](=O)[O-]	ZINC000853955576	EE	On-Demand	Clean	STAT6	34	44
COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853955578	GF	On-Demand	Clean	SERPINE1	28	40
OC1CCN(c2ccc(CNc3nc(-c4cccc(Cl)c4)no3)cc2)CC1	ZINC000853955579	GH	On-Demand	Clean	GRM5	18	42
CCOc1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955587	EE	On-Demand	Clean	STAT6	19	41
N#Cc1cnc2c(F)cc(F)cc2c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955594	GH	On-Demand	Mild	MAP3K8	115	40
Cc1nnc(NCc2ccc(N3CCC(O)CC3)cc2)s1	ZINC000853955595	DE	On-Demand	Clean	SPHK2	48	34
Cc1nnc(NCc2ccc(N3CCC(O)CC3)cc2)s1	ZINC000853955595	DE	On-Demand	Clean	SPHK1	41	34
Cc1nnc(NCc2ccc(N3CCC(O)CC3)cc2)s1	ZINC000853955595	DE	On-Demand	Clean	STAT6	16	40
CC(=O)c1ccc(C#N)cc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955610	EG	On-Demand	Mild	STAT6	22	40
OC1CCN(c2ccc(CNc3nnc(C(F)(F)F)s3)cc2)CC1	ZINC000853955612	FG	On-Demand	Clean	SPHK2	48	35
OC1CCN(c2ccc(CNc3nnc(C(F)(F)F)s3)cc2)CC1	ZINC000853955612	FG	On-Demand	Clean	SPHK1	46	35
OC1CCN(c2ccc(CNc3nnc(C(F)(F)F)s3)cc2)CC1	ZINC000853955612	FG	On-Demand	Clean	STAT6	18	41
CC(=O)c1ccc(C(F)(F)F)nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955622	GH	On-Demand	Clean	STAT6	66	47
OC1CCN(c2ccc(CNc3ncc(F)cn3)cc2)CC1	ZINC000853955623	DE	On-Demand	Clean	STAT6	87	49
CC(C)c1nnc2c(NCc3ccc(N4CCC(O)CC4)cc3)nccn12	ZINC000853955628	FF	On-Demand	Clean	STAT6	24	42
Nc1c(NCc2ccc(N3CCC(O)CC3)cc2)ncnc1-n1cccn1	ZINC000853955633	FD	On-Demand	Clean	STAT6	32	45
O=[N+]([O-])c1ccc2ncnc(NCc3ccc(N4CCC(O)CC4)cc3)c2c1	ZINC000853955634	GG	On-Demand	Clean	SLC29A1	20	42
O=[N+]([O-])c1ccc2ncnc(NCc3ccc(N4CCC(O)CC4)cc3)c2c1	ZINC000853955634	GG	On-Demand	Clean	CLK4	62	39
O=C(NC[C@@H]1COC2(CCCC2)O1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853955640	EF	On-Demand	Anodyne	EPHX2	19	43
O=C(NC[C@H]1COC2(CCCC2)O1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853955642	EF	On-Demand	Anodyne	EPHX2	19	43
OC1CCN(c2ccc(CNc3ncncc3Cl)cc2)CC1	ZINC000853955651	DF	On-Demand	Clean	STAT6	35	46
Nc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc12	ZINC000853955663	EF	On-Demand	Clean	STAT6	43	48
Nc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc12	ZINC000853955663	EF	On-Demand	Clean	VCP	50	33
OC1CCN(c2ccc(CNc3ccnc4cc(F)ccc34)cc2)CC1	ZINC000853955670	FH	On-Demand	Clean	HRP1_PLAFA	97	37
OC1CCN(c2ccc(CNc3ccnc4cc(F)ccc34)cc2)CC1	ZINC000853955670	FH	On-Demand	Clean	HNMT	53	35
CCCc1cc(=O)n2nc(NCc3ccc(N4CCC(O)CC4)cc3)sc2n1	ZINC000853955678	GF	On-Demand	Clean	SPHK2	48	33
CCCc1cc(=O)n2nc(NCc3ccc(N4CCC(O)CC4)cc3)sc2n1	ZINC000853955678	GF	On-Demand	Clean	SPHK1	43	33
NS(=O)(=O)c1cccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955684	FD	On-Demand	Clean	STAT6	53	48
OC1CCN(c2ccc(CNc3nc(C(F)(F)F)cs3)cc2)CC1	ZINC000853955693	FH	On-Demand	Clean	SPHK2	71	38
OC1CCN(c2ccc(CNc3nc(C(F)(F)F)cs3)cc2)CC1	ZINC000853955693	FH	On-Demand	Clean	SPHK1	61	38
OC1CCN(c2ccc(CNc3nnc(C4CC4)s3)cc2)CC1	ZINC000853955709	EF	On-Demand	Clean	SPHK2	43	32
OC1CCN(c2ccc(CNc3nnc(C4CC4)s3)cc2)CC1	ZINC000853955709	EF	On-Demand	Clean	STAT6	15	40
N#Cc1ccncc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955713	DF	On-Demand	Mild	STAT6	21	43
OCc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955722	DD	On-Demand	Clean	EPHB4	47	33
OCc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955722	DD	On-Demand	Clean	STAT6	29	45
NC(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1	ZINC000853955725	FE	On-Demand	Clean	PDE5A	15	50
NC(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1	ZINC000853955725	FE	On-Demand	Clean	CXCR3	20	41
NC(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1	ZINC000853955725	FE	On-Demand	Clean	STAT6	95	52
OC1CCN(c2ccc(CNc3ncnc4c3ncn4C3CC3)cc2)CC1	ZINC000853955726	FF	On-Demand	Clean	ADORA1	72	44
OC1CCN(c2ccc(CNc3ncnc4c3ncn4C3CC3)cc2)CC1	ZINC000853955726	FF	On-Demand	Clean	SLC29A1	31	48
OC1CCN(c2ccc(CNc3ncnc4c3ncn4C3CC3)cc2)CC1	ZINC000853955726	FF	On-Demand	Clean	CDK1	27	46
OC1CCN(c2ccc(CNc3ncnc4c3ncn4C3CC3)cc2)CC1	ZINC000853955726	FF	On-Demand	Clean	ADORA3	108	48
OC1CCN(c2ccc(CNc3ncnc4c3ncn4C3CC3)cc2)CC1	ZINC000853955726	FF	On-Demand	Clean	STAT6	16	40
OC1CCN(c2ccc(CNc3ncnc4c3ncn4C3CC3)cc2)CC1	ZINC000853955726	FF	On-Demand	Clean	DNMT3B	37	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	ZINC000853955729	GD	On-Demand	Anodyne	CA2	39	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	ZINC000853955729	GD	On-Demand	Anodyne	CA4	42	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	ZINC000853955729	GD	On-Demand	Anodyne	CA5A	41	38
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	ZINC000853955729	GD	On-Demand	Anodyne	CA12	22	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	ZINC000853955729	GD	On-Demand	Anodyne	CA9	23	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)c(S(N)(=O)=O)c2)c1	ZINC000853955729	GD	On-Demand	Anodyne	P96878_MYCTU	17	40
CC(C)c1cc(NCc2ccc(N3CCC(O)CC3)cc2)n2ncnc2n1	ZINC000853955739	FF	On-Demand	Clean	STAT6	31	40
OC1CCN(c2ccc(CNc3ncnc4c3CCCC4)cc2)CC1	ZINC000853955748	EF	On-Demand	Clean	STAT6	21	43
COC(=O)c1ccc([N+](=O)[O-])c(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955749	GE	On-Demand	Clean	STAT6	29	41
Cc1csc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc12	ZINC000853955751	FH	On-Demand	Clean	LPAR2	18	45
Cc1csc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc12	ZINC000853955751	FH	On-Demand	Clean	STAT6	18	40
NC(=O)c1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1[N+](=O)[O-]	ZINC000853955753	FD	On-Demand	Clean	STAT6	86	52
N#Cc1ncccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955759	DF	On-Demand	Mild	STAT6	17	42
OC1CCN(c2ccc(CNc3ccc(Cl)cn3)cc2)CC1	ZINC000853955773	DG	On-Demand	Clean	F10	21	44
NS(=O)(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)s1	ZINC000853955774	FD	On-Demand	Clean	STAT6	25	43
OC1CCN(c2ccc(CNc3ncc(Br)cn3)cc2)CC1	ZINC000853955776	FF	On-Demand	Clean	STAT6	72	49
OC1CCN(c2ccc(CNc3nc(C4CC4)ns3)cc2)CC1	ZINC000853955777	EF	On-Demand	Clean	STAT6	21	43
N#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)cn1	ZINC000853955783	DD	On-Demand	Mild	STAT6	16	41
OC1CCN(c2ccc(CNc3cc(N4CCCC4)ncn3)cc2)CC1	ZINC000853955784	FF	On-Demand	Clean	HRH4	16	54
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cccc(S(C)(=O)=O)c2)c1	ZINC000853955793	GE	On-Demand	Anodyne	CA4	16	47
Cn1ncc2c(N)nc(NCc3ccc(N4CCC(O)CC4)cc3)nc21	ZINC000853955799	FD	On-Demand	Clean	STAT6	33	42
CC(=O)c1cc(NCc2ccc(N3CCC(O)CC3)cc2)ccc1[N+](=O)[O-]	ZINC000853955804	FG	On-Demand	Clean	STAT6	29	41
OC1CCN(c2ccc(CNc3ncncc3-c3ccccc3)cc2)CC1	ZINC000853955805	FH	On-Demand	Clean	STAT6	49	49
Nc1ncnc(NCc2ccc(N3CCC(O)CC3)cc2)c1Cl	ZINC000853955809	EE	On-Demand	Clean	STAT6	34	45
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(N3CCCC3)cc2)c1	ZINC000853955812	FH	On-Demand	Anodyne	KCNQ2	25	41
OC1CCN(c2ccc(CNc3nccc(OCc4ccccc4)n3)cc2)CC1	ZINC000853955814	GH	On-Demand	Clean	GRIN2B	21	41
OC1CCN(c2ccc(CNc3nccc(OCc4ccccc4)n3)cc2)CC1	ZINC000853955814	GH	On-Demand	Clean	MERTK	22	41
OC1CCN(c2ccc(CNc3nccc(OCc4ccccc4)n3)cc2)CC1	ZINC000853955814	GH	On-Demand	Clean	STAT6	36	49
COc1ccc(NC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1	ZINC000853955820	GG	On-Demand	Bother	TAAR1	19	41
OCc1cc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1F	ZINC000853955823	EE	On-Demand	Clean	STAT6	51	32
OC1CCN(c2ccc(CNc3ncc(-c4ccccc4)s3)cc2)CC1	ZINC000853955826	FI	On-Demand	Clean	CDK7	26	40
OC1CCN(c2ccc(CNc3ncc(-c4ccccc4)s3)cc2)CC1	ZINC000853955826	FI	On-Demand	Clean	CHEK1	45	36
OC1CCN(c2ccc(CNc3ncc(-c4ccccc4)s3)cc2)CC1	ZINC000853955826	FI	On-Demand	Clean	STAT6	30	46
COC(=O)c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853955831	GE	On-Demand	Clean	STAT6	39	42
Cc1nnc(NCc2ccc(N3CCC(O)CC3)cc2)o1	ZINC000853955837	CD	On-Demand	Clean	STAT6	22	41
OC1CCN(c2ccc(CNc3ccnc4cc(F)cnc34)cc2)CC1	ZINC000853955839	FG	On-Demand	Clean	STAT6	52	33
O=[N+]([O-])c1cc(Cl)cnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955840	FG	On-Demand	Clean	PRKCQ	23	43
O=[N+]([O-])c1cc(Cl)cnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955840	FG	On-Demand	Clean	STAT6	36	43
COC(=O)c1nc(NCc2ccc(N3CCC(O)CC3)cc2)sc1C	ZINC000853955842	FF	On-Demand	Clean	STAT6	18	40
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2cccnc2Cl)c1	ZINC000853955845	EG	On-Demand	Anodyne	G2YM83_BOTF4	67	34
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2cccnc2Cl)c1	ZINC000853955846	EG	On-Demand	Anodyne	G2YM83_BOTF4	67	34
OC1CCN(c2ccc(CNc3ncccc3OCc3ccccc3)cc2)CC1	ZINC000853955847	GI	On-Demand	Clean	PPIA	45	45
OC1CCN(c2ccc(CNc3ncccc3OCc3ccccc3)cc2)CC1	ZINC000853955847	GI	On-Demand	Clean	STAT6	37	49
N#Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853955848	DD	On-Demand	Mild	STAT6	16	41
OC1CCN(c2ccc(CNc3ccc(F)cn3)cc2)CC1	ZINC000853955850	DF	On-Demand	Clean	STAT6	71	35
CCOC(=O)c1coc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955852	EE	On-Demand	Clean	STAT6	36	41
Cc1cc(CO)cc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853955858	EE	On-Demand	Clean	HRH4	15	41
CN(c1ccccc1)c1cc(NCc2ccc(N3CCC(O)CC3)cc2)ncn1	ZINC000853955859	GH	On-Demand	Clean	STAT6	15	41
N#Cc1ncc(Br)cc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955861	GG	On-Demand	Mild	STAT6	20	40
OC1CCN(c2ccc(CNc3cnc(-c4ccccc4)cn3)cc2)CC1	ZINC000853955862	FH	On-Demand	Clean	TPH1	33	51
OC1CCN(c2ccc(CNc3cnc(-c4ccccc4)cn3)cc2)CC1	ZINC000853955862	FH	On-Demand	Clean	STAT6	25	47
OC1CCN(c2ccc(CNc3nc(-c4ccccc4Cl)cs3)cc2)CC1	ZINC000853955866	GK	On-Demand	Clean	SPHK2	93	53
OC1CCN(c2ccc(CNc3nc(-c4ccccc4Cl)cs3)cc2)CC1	ZINC000853955866	GK	On-Demand	Clean	SPHK1	71	53
OC1CCN(c2ccc(CNc3nc(-c4ccccc4Cl)cs3)cc2)CC1	ZINC000853955866	GK	On-Demand	Clean	STAT6	18	40
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853955878	FG	On-Demand	Anodyne	KCNK3	82	37
CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853955878	FG	On-Demand	Anodyne	KCNK9	69	37
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853955879	FG	On-Demand	Anodyne	KCNK3	82	37
CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853955879	FG	On-Demand	Anodyne	KCNK9	69	37
OC1CCN(c2ccc(CNc3ncnc4cccc(F)c34)cc2)CC1	ZINC000853955887	FG	On-Demand	Clean	STAT6	49	34
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)c2cc[nH]c2n1	ZINC000853955892	EF	On-Demand	Clean	STAT6	17	41
N#Cc1cc2ccccc2nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955893	FH	On-Demand	Mild	STAT6	29	44
Cc1cc(C(F)(F)F)c(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853955896	FG	On-Demand	Clean	STAT6	40	43
OC1CCN(c2ccc(CNc3cnc4cc(F)c(F)cc4n3)cc2)CC1	ZINC000853955902	FG	On-Demand	Clean	STAT6	72	35
OC1CCN(c2ccc(CNc3ncccc3F)cc2)CC1	ZINC000853955915	DF	On-Demand	Clean	STAT6	62	47
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1	ZINC000853955917	FG	On-Demand	Bother	CACNA1D	46	31
C#CCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853955918	FE	On-Demand	Mild	STAT6	23	42
O=[N+]([O-])c1ncccc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853955919	EF	On-Demand	Clean	STAT6	32	45
O=c1cc(NCc2ccc(N3CCC(O)CC3)cc2)cnn1Cc1ccccc1	ZINC000853955936	GF	On-Demand	Clean	STAT6	37	47
OC1CCN(c2ccc(CNc3cncc(-n4cccn4)n3)cc2)CC1	ZINC000853955940	FE	On-Demand	Clean	STAT6	25	43
OC1CCN(c2ccc(CNc3cccnn3)cc2)CC1	ZINC000853955945	CE	On-Demand	Clean	STAT6	17	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853955947	HE	On-Demand	Anodyne	KIT	25	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853955947	HE	On-Demand	Anodyne	BRAF	21	43
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)c(C(F)(F)F)c1	ZINC000853955949	GI	On-Demand	Clean	MET	17	42
OC1CCN(c2ccc(CNc3nccc(N4CCCC4)n3)cc2)CC1	ZINC000853955951	FF	On-Demand	Clean	HRH4	15	43
OC1CCN(c2ccc(CNc3nccc(N4CCCC4)n3)cc2)CC1	ZINC000853955951	FF	On-Demand	Clean	EPHB4	40	33
OC1CCN(c2ccc(CNc3nccc(N4CCCC4)n3)cc2)CC1	ZINC000853955951	FF	On-Demand	Clean	STAT6	27	45
OC1CCN(c2ccc(CNc3nccc(N4CCCC4)n3)cc2)CC1	ZINC000853955951	FF	On-Demand	Clean	MRGPRX1	41	35
Cn1cnc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc21	ZINC000853955954	ED	On-Demand	Clean	ADORA1	45	47
Cn1cnc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc21	ZINC000853955954	ED	On-Demand	Clean	SLC29A1	15	42
Cn1cnc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc21	ZINC000853955954	ED	On-Demand	Clean	ADORA3	70	42
Cn1cnc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc21	ZINC000853955954	ED	On-Demand	Clean	STAT6	19	41
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)sc1C	ZINC000853955962	DG	On-Demand	Clean	STAT6	16	40
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)sc1C	ZINC000853955962	DG	On-Demand	Clean	SLC27A1	18	46
OC1CCN(c2ccc(CNc3ncnc4c3CCC4)cc2)CC1	ZINC000853955968	DF	On-Demand	Clean	STAT6	19	42
N#Cc1c(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccn12	ZINC000853955984	EF	On-Demand	Mild	STAT6	25	44
O=[N+]([O-])c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cn1	ZINC000853956001	EF	On-Demand	Clean	STAT6	48	46
Cc1cc(-c2cccc(F)c2)nnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853956003	GI	On-Demand	Clean	STAT6	43	41
Cc1nnc(NCc2ccc(N3CCC(O)CC3)cc2)c(C#N)c1C	ZINC000853956012	EF	On-Demand	Mild	STAT6	17	41
COc1cc(C)nc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853956019	EE	On-Demand	Clean	STAT6	22	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)cc2F)c1	ZINC000853956023	EG	On-Demand	Anodyne	CA5B	16	40
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc(C)cc2F)c1	ZINC000853956023	EG	On-Demand	Anodyne	CA5A	19	40
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853956032	ED	On-Demand	Clean	STAT6	59	48
OC1CCN(c2ccc(CNc3cc(N4CCOCC4)ncn3)cc2)CC1	ZINC000853956033	FD	On-Demand	Clean	EPHB4	43	32
OC1CCN(c2ccc(CNc3cc(N4CCOCC4)ncn3)cc2)CC1	ZINC000853956033	FD	On-Demand	Clean	STAT6	59	38
N#Cc1cccc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853956050	DF	On-Demand	Mild	STAT6	18	41
Nc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1[N+](=O)[O-]	ZINC000853956060	ED	On-Demand	Clean	PRKCQ	30	46
Nc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1[N+](=O)[O-]	ZINC000853956060	ED	On-Demand	Clean	MERTK	49	33
Nc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1[N+](=O)[O-]	ZINC000853956060	ED	On-Demand	Clean	STAT6	71	48
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853956071	FH	On-Demand	Anodyne	KCNK3	79	37
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853956071	FH	On-Demand	Anodyne	KCNK9	55	37
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853956072	FH	On-Demand	Anodyne	KCNK3	79	37
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853956072	FH	On-Demand	Anodyne	KCNK9	55	37
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc(C)c1CC(C)C	ZINC000853956074	FH	On-Demand	Clean	STAT6	16	41
CCCc1cc(NCc2ccc(N3CCC(O)CC3)cc2)n2ncnc2n1	ZINC000853956075	FF	On-Demand	Clean	STAT6	29	40
COC(=O)c1sccc1NC(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853956076	FF	On-Demand	Anodyne	FAS	49	53
NC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853956087	ED	On-Demand	Clean	STAT6	70	38
CN(C)C(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853956088	FE	On-Demand	Clean	STAT6	36	44
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)c2ccc(NS(C)(=O)=O)cc2)c1	ZINC000853956094	GG	On-Demand	Anodyne	PTPRB	67	38
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)c2ccc(NS(C)(=O)=O)cc2)c1	ZINC000853956095	GG	On-Demand	Anodyne	PTPRB	67	38
OC1CCN(c2ccc(CNc3ccc(Br)cn3)cc2)CC1	ZINC000853956096	FG	On-Demand	Clean	STAT6	26	45
OC1CCN(c2ccc(CNc3cncc(Br)c3)cc2)CC1	ZINC000853956103	FG	On-Demand	Clean	STAT6	24	42
N#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1	ZINC000853956106	EG	On-Demand	Mild	PDE5A	25	49
N#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1	ZINC000853956106	EG	On-Demand	Mild	STAT6	31	42
Oc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc12	ZINC000853956115	FF	On-Demand	Clean	STAT6	27	47
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853956116	FI	On-Demand	Clean	MAOB	17	42
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853956116	FI	On-Demand	Clean	ROCK1	17	42
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853956116	FI	On-Demand	Clean	SPHK2	95	43
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853956116	FI	On-Demand	Clean	SPHK1	77	51
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853956116	FI	On-Demand	Clean	STAT6	18	44
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)cs3)cc2)CC1	ZINC000853956116	FI	On-Demand	Clean	VCP	45	41
OC1CCN(c2ccc(CNc3nc4ccccc4[nH]3)cc2)CC1	ZINC000853956142	DG	On-Demand	Clean	KCNN3	41	58
OC1CCN(c2ccc(CNc3nc4ccccc4[nH]3)cc2)CC1	ZINC000853956142	DG	On-Demand	Clean	PDE10A	17	40
OC1CCN(c2ccc(CNc3nc4ccccc4[nH]3)cc2)CC1	ZINC000853956142	DG	On-Demand	Clean	STAT6	17	43
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)c1	ZINC000853956145	ED	On-Demand	Anodyne	FKBP1A	45	38
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)c1	ZINC000853956145	ED	On-Demand	Anodyne	TRHR	54	32
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)c1	ZINC000853956145	ED	On-Demand	Anodyne	CPT2	44	38
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@H]2C(N)=O)c1	ZINC000853956145	ED	On-Demand	Anodyne	PREP	43	35
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c1	ZINC000853956146	ED	On-Demand	Anodyne	FKBP1A	45	38
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c1	ZINC000853956146	ED	On-Demand	Anodyne	TRHR	54	32
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c1	ZINC000853956146	ED	On-Demand	Anodyne	CPT2	44	38
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCCC[C@@H]2C(N)=O)c1	ZINC000853956146	ED	On-Demand	Anodyne	PREP	43	35
COCCNC(=O)c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853956149	GE	On-Demand	Clean	STAT6	25	41
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1	ZINC000853956153	FG	On-Demand	Clean	MET	16	40
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)c1	ZINC000853956153	FG	On-Demand	Clean	STAT6	36	43
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)c2ccc3c(c2)NC(=O)CO3)c1	ZINC000853956161	FF	On-Demand	Anodyne	NR3C2	25	41
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)c2ccc3c(c2)NC(=O)CO3)c1	ZINC000853956162	FF	On-Demand	Anodyne	NR3C2	25	41
OC1CCN(c2ccc(CNc3ccnc(C4CC4)n3)cc2)CC1	ZINC000853956163	DF	On-Demand	Clean	STAT6	17	42
Cn1ncc2c(O)nc(NCc3ccc(N4CCC(O)CC4)cc3)nc21	ZINC000853956166	FD	On-Demand	Clean	STAT6	24	40
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)cc(-c2cccnc2)n1	ZINC000853956167	GG	On-Demand	Clean	PRKD1	48	35
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)cc(-c2cccnc2)n1	ZINC000853956167	GG	On-Demand	Clean	ROS1	66	35
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)cc(-c2cccnc2)n1	ZINC000853956167	GG	On-Demand	Clean	STAT6	33	42
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)cc(-c2cccnc2)n1	ZINC000853956167	GG	On-Demand	Clean	VCP	48	46
Cc1cc(C)cc(CC(=O)OCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c1	ZINC000853956168	FF	On-Demand	Bother	EIF2AK3	66	36
COc1ccccc1N(CCC(N)=O)C(=O)COC(=O)Cc1cc(C)cc(C)c1	ZINC000853956177	GE	On-Demand	Anodyne	TSPO	40	31
COc1cc(NCc2ccc(N3CCC(O)CC3)cc2)c(Br)cn1	ZINC000853956186	GG	On-Demand	Clean	STAT6	26	40
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1	ZINC000853956202	FG	On-Demand	Bother	COLA	120	40
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1	ZINC000853956203	FG	On-Demand	Bother	COLA	120	40
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853956204	GG	On-Demand	Bother	KCNMA1	20	48
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)Cc1cc(C)cc(C)c1	ZINC000853956205	GG	On-Demand	Bother	KCNMA1	20	48
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)NCCCN1CCCC1=O	ZINC000853956230	FC	On-Demand	Anodyne	TYRO3	20	40
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)NCCCN1CCCC1=O	ZINC000853956231	FC	On-Demand	Anodyne	TYRO3	20	40
C#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)nc1	ZINC000853956262	DE	On-Demand	Mild	STAT6	44	47
O=C(C[C@H]1NC(=O)c2ccccc21)OCC(=O)N1CCc2ccccc2C1	ZINC000853956273	FD	On-Demand	Anodyne	DPP8	17	42
O=C(C[C@@H]1NC(=O)c2ccccc21)OCC(=O)N1CCc2ccccc2C1	ZINC000853956274	FD	On-Demand	Anodyne	DPP8	17	42
OC1CCN(c2ccc(CNc3cc(N4CCCCC4)ncn3)cc2)CC1	ZINC000853956301	FG	On-Demand	Clean	HRH4	15	53
OC1CCN(c2ccc(CNc3ccnc(-c4ccccc4)n3)cc2)CC1	ZINC000853956334	FH	On-Demand	Clean	STAT6	22	46
OC1CCN(c2ccc(CNc3ccnc(-c4ccccc4)n3)cc2)CC1	ZINC000853956334	FH	On-Demand	Clean	PKNB	45	38
CC(=O)NCCCc1ccc(C(=O)COC(=O)Cc2cc(C)cc(C)c2)cc1	ZINC000853956342	GG	On-Demand	Anodyne	MTNR1A	37	44
CC(=O)NCCCc1ccc(C(=O)COC(=O)Cc2cc(C)cc(C)c2)cc1	ZINC000853956342	GG	On-Demand	Anodyne	MTNR1B	35	44
OC1CCN(c2ccc(CNc3nc(C(F)F)nc4ccccc34)cc2)CC1	ZINC000853956346	GI	On-Demand	Clean	STAT6	32	46
N#Cc1cc(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc12	ZINC000853956350	FH	On-Demand	Mild	METG	40	35
N#Cc1cc(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc12	ZINC000853956350	FH	On-Demand	Mild	STAT6	15	41
OC1CCN(c2ccc(CNc3ncnc4[nH]ccc34)cc2)CC1	ZINC000853956388	DF	On-Demand	Clean	AKT2	49	47
OC1CCN(c2ccc(CNc3ncnc4[nH]ccc34)cc2)CC1	ZINC000853956388	DF	On-Demand	Clean	AKT3	28	42
OC1CCN(c2ccc(CNc3ncnc4[nH]ccc34)cc2)CC1	ZINC000853956388	DF	On-Demand	Clean	JAK3	26	41
OC1CCN(c2ccc(CNc3ncnc4[nH]ccc34)cc2)CC1	ZINC000853956388	DF	On-Demand	Clean	JAK1	45	43
OC1CCN(c2ccc(CNc3ncnc4[nH]ccc34)cc2)CC1	ZINC000853956388	DF	On-Demand	Clean	JAK2	18	43
OC1CCN(c2ccc(CNc3ncnc4[nH]ccc34)cc2)CC1	ZINC000853956388	DF	On-Demand	Clean	STAT6	30	45
Nc1ncnc2c1ncn2CCCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956389	FD	On-Demand	Anodyne	AHCY	47	39
Nc1ncnc2c1ncn2CCCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956389	FD	On-Demand	Anodyne	OXGR1	77	32
Nc1ncnc2c1ncn2CCCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956391	FD	On-Demand	Anodyne	AHCY	47	39
Nc1ncnc2c1ncn2CCCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956391	FD	On-Demand	Anodyne	OXGR1	77	32
NC(=O)c1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853956436	ED	On-Demand	Clean	STAT6	70	50
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCOc1ccc2c(c1)OCO2	ZINC000853956476	FF	On-Demand	Anodyne	EDNRB	36	41
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCOc1ccc2c(c1)OCO2	ZINC000853956476	FF	On-Demand	Anodyne	EDNRA	47	41
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCOc1ccc2c(c1)OCO2	ZINC000853956477	FF	On-Demand	Anodyne	EDNRB	36	41
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCOc1ccc2c(c1)OCO2	ZINC000853956477	FF	On-Demand	Anodyne	EDNRA	47	41
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@@H]1CCCc2ccccc21	ZINC000853956481	GF	On-Demand	Anodyne	BDKRB1	41	42
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@H]1CCCc2ccccc21	ZINC000853956482	GF	On-Demand	Anodyne	BDKRB1	41	42
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@H]1CCCc2ccccc21	ZINC000853956483	GF	On-Demand	Anodyne	BDKRB1	41	42
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@@H]1CCCc2ccccc21	ZINC000853956484	GF	On-Demand	Anodyne	BDKRB1	41	42
Cc1cc(C)cc(CC(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1	ZINC000853956487	FG	On-Demand	Bother	CACNA1D	44	31
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956492	GD	On-Demand	Anodyne	CAPN1	30	42
COC(=O)[C@@H](CC(C)C)NC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956493	GD	On-Demand	Anodyne	CAPN1	30	42
Oc1ncnc2c(NCc3ccc(N4CCC(O)CC4)cc3)nccc12	ZINC000853956494	FE	On-Demand	Clean	STAT6	18	41
N#Cc1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853956497	DD	On-Demand	Mild	STAT6	16	41
O=C(C[C@H]1NC(=O)c2ccccc21)O[C@@H]1CCOC1=O	ZINC000853956507	CC	On-Demand	Anodyne	TRAR	46	32
O=C(C[C@H]1NC(=O)c2ccccc21)O[C@H]1CCOC1=O	ZINC000853956508	CC	On-Demand	Anodyne	TRAR	46	32
O=C(C[C@@H]1NC(=O)c2ccccc21)O[C@H]1CCOC1=O	ZINC000853956509	CC	On-Demand	Anodyne	TRAR	46	32
O=C(C[C@@H]1NC(=O)c2ccccc21)O[C@@H]1CCOC1=O	ZINC000853956510	CC	On-Demand	Anodyne	TRAR	46	32
CCOc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1Cl	ZINC000853956565	FG	On-Demand	Clean	PDE5A	15	41
CCOc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1Cl	ZINC000853956565	FG	On-Demand	Clean	AXL	55	37
CCOc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1Cl	ZINC000853956565	FG	On-Demand	Clean	TYRO3	49	37
CCOc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1Cl	ZINC000853956565	FG	On-Demand	Clean	MERTK	70	37
CCOc1nc(NCc2ccc(N3CCC(O)CC3)cc2)ncc1Cl	ZINC000853956565	FG	On-Demand	Clean	STAT6	64	44
N#Cc1cc(Br)cnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853956570	GG	On-Demand	Mild	STAT6	31	43
OC1CCN(c2ccc(CNc3nc(-c4ccccc4)ns3)cc2)CC1	ZINC000853956581	FH	On-Demand	Clean	STAT6	17	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853956595	HD	On-Demand	Anodyne	DRD4	34	46
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853956595	HD	On-Demand	Anodyne	SIGMAR1	25	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853956595	HD	On-Demand	Anodyne	CCR2	15	40
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853956595	HD	On-Demand	Anodyne	MCHR1	23	44
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853956595	HD	On-Demand	Anodyne	BIRC2	29	41
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853956597	HD	On-Demand	Anodyne	DRD4	34	46
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853956597	HD	On-Demand	Anodyne	SIGMAR1	25	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853956597	HD	On-Demand	Anodyne	CCR2	15	40
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853956597	HD	On-Demand	Anodyne	MCHR1	23	44
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853956597	HD	On-Demand	Anodyne	BIRC2	29	41
OC1CCN(c2ccc(CNc3nccc(C(F)(F)F)n3)cc2)CC1	ZINC000853956611	FG	On-Demand	Clean	STAT6	35	43
O=S(=O)(c1ccc(NCc2ccc(N3CCC(O)CC3)cc2)cc1)C(F)F	ZINC000853956612	GG	On-Demand	Clean	STAT6	18	41
O=C(NC[C@@H]1COC2(CCCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853956613	ED	On-Demand	Anodyne	CPT1A	73	36
O=C(NC[C@@H]1COC2(CCCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853956614	ED	On-Demand	Anodyne	CPT1A	73	36
O=C(NC[C@H]1COC2(CCCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853956615	ED	On-Demand	Anodyne	CPT1A	73	36
O=C(NC[C@H]1COC2(CCCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853956616	ED	On-Demand	Anodyne	CPT1A	73	36
COc1cc(NCc2ccc(N3CCC(O)CC3)cc2)ccc1[N+](=O)[O-]	ZINC000853956623	FG	On-Demand	Clean	DRTS_TRYCR	45	32
Cc1nc(NCc2ccc(N3CCC(O)CC3)cc2)c2cnn(C)c2n1	ZINC000853956641	FE	On-Demand	Clean	STAT6	27	42
OC1CCN(c2ccc(CNc3cc(C(F)(F)F)ccn3)cc2)CC1	ZINC000853956642	FH	On-Demand	Clean	KARS	16	42
OC1CCN(c2ccc(CNc3cc(C(F)(F)F)ccn3)cc2)CC1	ZINC000853956642	FH	On-Demand	Clean	MAP3K12	29	41
Cc1nsc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853956647	DE	On-Demand	Clean	STAT6	16	40
N#Cc1nccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853956648	DD	On-Demand	Mild	STAT6	21	43
OC1CCN(c2ccc(CNc3cc(NCC4CC4)ncn3)cc2)CC1	ZINC000853956654	FF	On-Demand	Clean	VCP	52	38
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA2	131	57
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA1	113	51
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA7	54	53
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA5B	64	44
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA4	105	48
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA5A	69	44
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA14	46	53
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	PTPRB	17	41
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA12	79	53
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CA9	87	57
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	CYNT	40	38
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	MTCA1	54	53
Cc1cc(C)cc(CC(=O)O[C@@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956674	GE	On-Demand	Anodyne	P96878_MYCTU	67	53
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA2	131	57
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA1	113	51
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA7	54	53
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA5B	64	44
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA4	105	48
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA5A	69	44
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA14	46	53
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	PTPRB	17	41
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA12	79	53
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CA9	87	57
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	CYNT	40	38
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	MTCA1	54	53
Cc1cc(C)cc(CC(=O)O[C@H](C)C(=O)Nc2ccc(S(N)(=O)=O)cc2)c1	ZINC000853956675	GE	On-Demand	Anodyne	P96878_MYCTU	67	53
OC1CCN(c2ccc(CNc3cccc(F)n3)cc2)CC1	ZINC000853956676	DF	On-Demand	Clean	STAT6	33	42
OC1CCN(c2ccc(CNc3cccc(C(F)(F)F)n3)cc2)CC1	ZINC000853956677	FH	On-Demand	Clean	STAT6	24	41
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853956769	HE	On-Demand	Anodyne	KCNQ2	48	43
C[C@H](OC(=O)c1ccccc1-n1cnnn1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853956769	HE	On-Demand	Anodyne	PRNP	41	36
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956777	FC	On-Demand	Anodyne	TRHR	49	36
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956777	FC	On-Demand	Anodyne	CPT1A	77	37
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956777	FC	On-Demand	Anodyne	CPT2	46	36
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956777	FC	On-Demand	Anodyne	PREP	42	35
OCc1cc2ccccc2nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853956779	FG	On-Demand	Clean	STAT6	41	45
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956780	FC	On-Demand	Anodyne	TRHR	49	36
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956780	FC	On-Demand	Anodyne	CPT1A	77	37
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956780	FC	On-Demand	Anodyne	CPT2	46	36
NC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956780	FC	On-Demand	Anodyne	PREP	42	35
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956781	FC	On-Demand	Anodyne	TRHR	49	36
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956781	FC	On-Demand	Anodyne	CPT1A	77	37
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956781	FC	On-Demand	Anodyne	CPT2	46	36
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956781	FC	On-Demand	Anodyne	PREP	42	35
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956783	FC	On-Demand	Anodyne	TRHR	49	36
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956783	FC	On-Demand	Anodyne	CPT1A	77	37
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956783	FC	On-Demand	Anodyne	CPT2	46	36
NC(=O)[C@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956783	FC	On-Demand	Anodyne	PREP	42	35
C[C@@H](OC(=O)C[C@H]1NC(=O)c2ccccc21)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853956824	GF	On-Demand	Anodyne	EPHX2	62	39
C[C@@H](OC(=O)C[C@@H]1NC(=O)c2ccccc21)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000853956826	GF	On-Demand	Anodyne	EPHX2	62	39
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(F)c1	ZINC000853956844	EF	On-Demand	Clean	MET	16	40
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(F)c1	ZINC000853956844	EF	On-Demand	Clean	STAT6	55	35
OC1CCN(c2ccc(CNc3nccc(-c4cnccn4)n3)cc2)CC1	ZINC000853956869	FF	On-Demand	Clean	MAPK1	47	34
OC1CCN(c2ccc(CNc3nccc(-c4cnccn4)n3)cc2)CC1	ZINC000853956869	FF	On-Demand	Clean	TYRO3	32	40
OC1CCN(c2ccc(CNc3nccc(-c4cnccn4)n3)cc2)CC1	ZINC000853956869	FF	On-Demand	Clean	MERTK	50	40
OC1CCN(c2ccc(CNc3nccc(-c4cnccn4)n3)cc2)CC1	ZINC000853956869	FF	On-Demand	Clean	STAT6	53	46
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956876	GD	On-Demand	Anodyne	TIMP3	54	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956876	GD	On-Demand	Anodyne	CAPNS1	45	30
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956876	GD	On-Demand	Anodyne	CAPN1	41	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956877	GD	On-Demand	Anodyne	TIMP3	54	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956877	GD	On-Demand	Anodyne	CAPNS1	45	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853956877	GD	On-Demand	Anodyne	CAPN1	41	43
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956878	GD	On-Demand	Anodyne	TIMP3	54	32
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956878	GD	On-Demand	Anodyne	CAPNS1	45	30
CC(=O)[C@H](Cc1ccccc1)NC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956878	GD	On-Demand	Anodyne	CAPN1	41	43
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956879	GD	On-Demand	Anodyne	TIMP3	54	32
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956879	GD	On-Demand	Anodyne	CAPNS1	45	30
CC(=O)[C@@H](Cc1ccccc1)NC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853956879	GD	On-Demand	Anodyne	CAPN1	41	43
OC1CCN(c2ccc(CNc3nc(C4CCCC4)ns3)cc2)CC1	ZINC000853956885	FH	On-Demand	Clean	STAT6	19	42
CCOc1cc(NCc2ccc(N3CCC(O)CC3)cc2)c(F)cn1	ZINC000853956891	EG	On-Demand	Clean	STAT6	51	32
O=[N+]([O-])c1c(NCc2ccc(N3CCC(O)CC3)cc2)ccnc1O	ZINC000853956892	EE	On-Demand	Clean	STAT6	20	40
OC1CCN(c2ccc(CNc3ncc(F)c(-c4ccsc4)n3)cc2)CC1	ZINC000853956897	GH	On-Demand	Clean	MERTK	41	33
OC1CCN(c2ccc(CNc3ncc(F)c(-c4ccsc4)n3)cc2)CC1	ZINC000853956897	GH	On-Demand	Clean	STAT6	66	34
Cn1cnc(NCc2ccc(N3CCC(O)CC3)cc2)cc1=O	ZINC000853956914	DD	On-Demand	Clean	STAT6	20	40
OC1CCN(c2ccc(CNc3ncc(C(F)F)cn3)cc2)CC1	ZINC000853956952	EF	On-Demand	Clean	STAT6	78	48
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)CC1	ZINC000853956967	GD	On-Demand	Anodyne	PTR1	44	31
COC(=O)C1CCN(C(=O)[C@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)CC1	ZINC000853956971	GD	On-Demand	Anodyne	PTR1	44	31
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)CC1	ZINC000853956975	GD	On-Demand	Anodyne	PTR1	44	31
COC(=O)C1CCN(C(=O)[C@@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)CC1	ZINC000853956979	GD	On-Demand	Anodyne	PTR1	44	31
N#Cc1cc2cccnc2nc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853957007	FG	On-Demand	Mild	STAT6	29	43
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@H]1CCOc2ccccc21	ZINC000853957015	GE	On-Demand	Anodyne	BDKRB1	22	42
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@H]1CCOc2ccccc21	ZINC000853957015	GE	On-Demand	Anodyne	LUXR	63	36
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@H]1CCOc2ccccc21	ZINC000853957015	GE	On-Demand	Anodyne	TRAR	80	37
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@@H]1CCOc2ccccc21	ZINC000853957016	GE	On-Demand	Anodyne	BDKRB1	22	42
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@@H]1CCOc2ccccc21	ZINC000853957016	GE	On-Demand	Anodyne	LUXR	63	36
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)N[C@@H]1CCOc2ccccc21	ZINC000853957016	GE	On-Demand	Anodyne	TRAR	80	37
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@H]1CCOc2ccccc21	ZINC000853957017	GE	On-Demand	Anodyne	BDKRB1	22	42
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@H]1CCOc2ccccc21	ZINC000853957017	GE	On-Demand	Anodyne	LUXR	63	36
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@H]1CCOc2ccccc21	ZINC000853957017	GE	On-Demand	Anodyne	TRAR	80	37
C[C@@H](OC(=O)C[C@H]1NC(=O)c2ccccc21)C(=O)NCc1ccccc1	ZINC000853957019	FE	On-Demand	Anodyne	PDS	45	34
C[C@@H](OC(=O)C[C@@H]1NC(=O)c2ccccc21)C(=O)NCc1ccccc1	ZINC000853957020	FE	On-Demand	Anodyne	PDS	45	34
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@@H]1CCOc2ccccc21	ZINC000853957022	GE	On-Demand	Anodyne	BDKRB1	22	42
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@@H]1CCOc2ccccc21	ZINC000853957022	GE	On-Demand	Anodyne	LUXR	63	36
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)N[C@@H]1CCOc2ccccc21	ZINC000853957022	GE	On-Demand	Anodyne	TRAR	80	37
OC1CCN(c2ccc(CNc3ccnc4c(F)cc(Cl)cc34)cc2)CC1	ZINC000853957033	GJ	On-Demand	Clean	HRP1_PLAFA	58	34
C[C@@H](OC(=O)C[C@@H]1NC(=O)c2ccccc21)C(=O)N1CCCCCC1	ZINC000853957043	EE	On-Demand	Anodyne	DPP7	58	35
C[C@@H](OC(=O)C[C@H]1NC(=O)c2ccccc21)C(=O)N1CCCCCC1	ZINC000853957044	EE	On-Demand	Anodyne	DPP7	58	35
CCCCCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957080	CF	On-Demand	Anodyne	PLA2G4B	56	33
CCCCCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957081	CF	On-Demand	Anodyne	PLA2G4B	56	33
OC1CCN(c2ccc(CNc3cc(Nc4ccccc4)ncn3)cc2)CC1	ZINC000853957125	GH	On-Demand	Clean	MAPK10	15	40
OC1CCN(c2ccc(CNc3cc(Nc4ccccc4)ncn3)cc2)CC1	ZINC000853957125	GH	On-Demand	Clean	STAT6	56	50
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957130	GD	On-Demand	Anodyne	FKBP1A	70	41
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957130	GD	On-Demand	Anodyne	CPT1A	59	37
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957130	GD	On-Demand	Anodyne	CPT2	45	37
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957131	GD	On-Demand	Anodyne	FKBP1A	70	41
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957131	GD	On-Demand	Anodyne	CPT1A	59	37
CCOC(=O)[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957131	GD	On-Demand	Anodyne	CPT2	45	37
N#Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nc1N	ZINC000853957136	DE	On-Demand	Mild	STAT6	17	41
CCn1c(=O)c(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc21	ZINC000853957138	GF	On-Demand	Clean	PDE6D	42	36
CCn1c(=O)c(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc21	ZINC000853957138	GF	On-Demand	Clean	PYGM	18	41
CCn1c(=O)c(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc21	ZINC000853957138	GF	On-Demand	Clean	STAT6	33	46
OC1CCN(c2ccc(CNc3cc(OCc4ccccc4)ncn3)cc2)CC1	ZINC000853957139	GH	On-Demand	Clean	STAT6	20	44
CCOC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853957140	FF	On-Demand	Clean	P2RY12	35	42
CCOC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853957140	FF	On-Demand	Clean	SPHK2	47	33
CCOC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853957140	FF	On-Demand	Clean	SPHK1	40	33
CCOC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853957140	FF	On-Demand	Clean	STAT6	18	41
CCOC(=O)c1csc(NCc2ccc(N3CCC(O)CC3)cc2)n1	ZINC000853957140	FF	On-Demand	Clean	TRPC6	44	35
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)C[C@@H]2NC(=O)c3ccccc32)C1	ZINC000853957154	GD	On-Demand	Anodyne	FDFT1	17	40
CCOC(=O)[C@@H]1CCCN(C(=O)COC(=O)C[C@H]2NC(=O)c3ccccc32)C1	ZINC000853957155	GD	On-Demand	Anodyne	FDFT1	17	40
OC1CCN(c2ccc(CNc3nccnc3OC3CCC3)cc2)CC1	ZINC000853957212	FF	On-Demand	Clean	STAT6	27	42
C[C@@H](OC(=O)C[C@H]1NC(=O)c2ccccc21)C(=O)N1CCc2ccccc2C1	ZINC000853957227	GE	On-Demand	Anodyne	DPP8	24	41
COc1ccc(OCCCOC(=O)C[C@H]2NC(=O)c3ccccc32)cc1	ZINC000853957228	FF	On-Demand	Anodyne	PPARD	20	42
COc1ccc(OCCCOC(=O)C[C@@H]2NC(=O)c3ccccc32)cc1	ZINC000853957230	FF	On-Demand	Anodyne	PPARD	20	42
C[C@@H](OC(=O)C[C@@H]1NC(=O)c2ccccc21)C(=O)N1CCc2ccccc2C1	ZINC000853957231	GE	On-Demand	Anodyne	DPP8	24	41
COc1cc(NCc2ccc(N3CCC(O)CC3)cc2)c(Cl)cc1[N+](=O)[O-]	ZINC000853957245	GH	On-Demand	Clean	PDE5A	21	50
Cc1c(NC(=O)[C@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)cccc1[N+](=O)[O-]	ZINC000853957255	GF	On-Demand	Bother	COLA	83	38
Cc1c(NC(=O)[C@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)cccc1[N+](=O)[O-]	ZINC000853957256	GF	On-Demand	Bother	COLA	83	38
Cc1c(NC(=O)[C@@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)cccc1[N+](=O)[O-]	ZINC000853957257	GF	On-Demand	Bother	COLA	83	38
Cc1c(NC(=O)[C@@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)cccc1[N+](=O)[O-]	ZINC000853957259	GF	On-Demand	Bother	COLA	83	38
O=[N+]([O-])c1cc2c(nc1NCc1ccc(N3CCC(O)CC3)cc1)CCCC2	ZINC000853957328	GG	On-Demand	Clean	STAT6	24	40
Nc1nc2c(c(NCc3ccc(N4CCC(O)CC4)cc3)n1)CCCC2	ZINC000853957341	FF	On-Demand	Clean	STAT6	27	43
OC1CCN(c2ccc(CNc3ncnc(F)c3Br)cc2)CC1	ZINC000853957348	GF	On-Demand	Clean	STAT6	43	32
CC(C)(C)OC(=O)CCCCNC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853957355	EF	On-Demand	Anodyne	EPHX2	20	50
CC(C)(C)OC(=O)CCCCNC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853957356	EF	On-Demand	Anodyne	EPHX2	20	50
CC(C)(C)OC(=O)CCCCNC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853957357	EF	On-Demand	Anodyne	EPHX2	20	50
CC(C)(C)OC(=O)CCCCNC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853957358	EF	On-Demand	Anodyne	EPHX2	20	50
O=[N+]([O-])c1cccc2c(NCc3ccc(N4CCC(O)CC4)cc3)nccc12	ZINC000853957369	GH	On-Demand	Clean	STAT6	29	42
Cc1ccc2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)c2c1	ZINC000853957370	EI	On-Demand	Clean	EPHB4	55	34
Cc1ccc2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)c2c1	ZINC000853957370	EI	On-Demand	Clean	STAT6	33	43
OC1CCN(c2ccc(CNc3nc4ccccc4n4cccc34)cc2)CC1	ZINC000853957375	FI	On-Demand	Clean	STAT6	28	46
NC(=O)c1cc(NCc2ccc(N3CCC(O)CC3)cc2)ccc1[N+](=O)[O-]	ZINC000853957377	FE	On-Demand	Clean	STAT6	71	38
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)NCc1ccc2c(c1)OCO2	ZINC000853957391	GD	On-Demand	Anodyne	NOS2	94	37
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)NCc1ccc2c(c1)OCO2	ZINC000853957391	GD	On-Demand	Anodyne	MCHR1	16	40
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)NCc1ccc2c(c1)OCO2	ZINC000853957393	GD	On-Demand	Anodyne	NOS2	94	37
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)NCc1ccc2c(c1)OCO2	ZINC000853957393	GD	On-Demand	Anodyne	MCHR1	16	40
CCCc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1	ZINC000853957432	EG	On-Demand	Clean	STAT6	16	41
C[C@@H](CCc1ccccc1)OC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957489	DG	On-Demand	Anodyne	GALR1	44	31
C[C@H](CCc1ccccc1)OC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957490	DG	On-Demand	Anodyne	GALR1	44	31
C[C@@H](CCc1ccccc1)OC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957491	DG	On-Demand	Anodyne	GALR1	44	31
C[C@H](CCc1ccccc1)OC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957492	DG	On-Demand	Anodyne	GALR1	44	31
CN1CCCC[C@H]1CCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957512	DE	On-Demand	Anodyne	CHRNA10	53	37
CN1CCCC[C@H]1CCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957512	DE	On-Demand	Anodyne	ACKR3	64	33
CN1CCCC[C@@H]1CCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957513	DE	On-Demand	Anodyne	CHRNA10	53	37
CN1CCCC[C@@H]1CCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957513	DE	On-Demand	Anodyne	ACKR3	64	33
CN1CCCC[C@@H]1CCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957514	DE	On-Demand	Anodyne	CHRNA10	53	37
CN1CCCC[C@@H]1CCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957514	DE	On-Demand	Anodyne	ACKR3	64	33
CN1CCCC[C@H]1CCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957515	DE	On-Demand	Anodyne	CHRNA10	53	37
CN1CCCC[C@H]1CCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957515	DE	On-Demand	Anodyne	ACKR3	64	33
C#Cc1cccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853957516	DF	On-Demand	Mild	STAT6	28	44
C[C@@H](OC(=O)C[C@@H]1NC(=O)c2ccccc21)C(=O)N(C)Cc1ccccc1	ZINC000853957532	FE	On-Demand	Anodyne	GALR1	46	33
C[C@@H](OC(=O)C[C@H]1NC(=O)c2ccccc21)C(=O)N(C)Cc1ccccc1	ZINC000853957534	FE	On-Demand	Anodyne	GALR1	46	33
OC1CCN(c2ccc(CNc3nc(C4CCCCC4)ns3)cc2)CC1	ZINC000853957561	FI	On-Demand	Clean	STAT6	17	41
COC(=O)c1nccnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853957564	ED	On-Demand	Clean	STAT6	41	46
CC(C)c1nnc(NCc2ccc(N3CCC(O)CC3)cc2)o1	ZINC000853957567	DF	On-Demand	Clean	STAT6	24	41
Cn1nnc2c(NCc3ccc(N4CCC(O)CC4)cc3)ncnc21	ZINC000853957579	ED	On-Demand	Clean	STAT6	25	42
COc1ccc(NC(=O)[C@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)cc1OC	ZINC000853957598	GE	On-Demand	Anodyne	ENPP1	68	32
COc1ccc(NC(=O)[C@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)cc1OC	ZINC000853957599	GE	On-Demand	Anodyne	ENPP1	68	32
COC(=O)[C@@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000853957644	DD	On-Demand	Bother	CACNA1D	58	34
Cc1cccc(NC(=O)[C@@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)c1	ZINC000853957657	FF	On-Demand	Anodyne	HDAC10	24	40
Cc1cccc(NC(=O)[C@@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)c1	ZINC000853957657	FF	On-Demand	Anodyne	HDAC11	21	40
Cc1cccc(NC(=O)[C@@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)c1	ZINC000853957658	FF	On-Demand	Anodyne	HDAC10	24	40
Cc1cccc(NC(=O)[C@@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)c1	ZINC000853957658	FF	On-Demand	Anodyne	HDAC11	21	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)c1	ZINC000853957659	FF	On-Demand	Anodyne	HDAC10	24	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)C[C@@H]2NC(=O)c3ccccc32)c1	ZINC000853957659	FF	On-Demand	Anodyne	HDAC11	21	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)c1	ZINC000853957660	FF	On-Demand	Anodyne	HDAC10	24	40
Cc1cccc(NC(=O)[C@H](C)OC(=O)C[C@H]2NC(=O)c3ccccc32)c1	ZINC000853957660	FF	On-Demand	Anodyne	HDAC11	21	40
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)NCC1(c2ccccc2)CC1	ZINC000853957703	GE	On-Demand	Anodyne	KCNA3	45	37
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)NCC1(c2ccccc2)CC1	ZINC000853957704	GE	On-Demand	Anodyne	KCNA3	45	37
CC[C@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957716	EE	On-Demand	Anodyne	CPT1A	75	34
CC[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957717	EE	On-Demand	Anodyne	CPT1A	75	34
CC[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957718	EE	On-Demand	Anodyne	CPT1A	75	34
CC[C@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957719	EE	On-Demand	Anodyne	CPT1A	75	34
N#Cc1cnnc(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853957742	DD	On-Demand	Mild	PDE5A	15	42
N#Cc1cnnc(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853957742	DD	On-Demand	Mild	STAT6	18	40
Cc1cc(C)cc(CC(=O)O[C@@H]2CCOC2=O)c1	ZINC000853957755	BD	On-Demand	Anodyne	LUXR	66	35
Cc1cc(C)cc(CC(=O)O[C@@H]2CCOC2=O)c1	ZINC000853957755	BD	On-Demand	Anodyne	TRAR	76	35
Cc1cc(C)cc(CC(=O)O[C@@H]2CCOC2=O)c1	ZINC000853957755	BD	On-Demand	Anodyne	LASR	42	34
Cc1cc(C)cc(CC(=O)O[C@H]2CCOC2=O)c1	ZINC000853957756	BD	On-Demand	Anodyne	LUXR	66	35
Cc1cc(C)cc(CC(=O)O[C@H]2CCOC2=O)c1	ZINC000853957756	BD	On-Demand	Anodyne	TRAR	76	35
Cc1cc(C)cc(CC(=O)O[C@H]2CCOC2=O)c1	ZINC000853957756	BD	On-Demand	Anodyne	LASR	42	34
CC(C)(C)OC(=O)CCCCNC(=O)N[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853957757	GG	On-Demand	Anodyne	EPHX2	25	56
CC(C)(C)OC(=O)CCCCNC(=O)N[C@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000853957758	GG	On-Demand	Anodyne	EPHX2	25	56
OC1CCN(c2ccc(CNc3ccnc4cc(F)c(Cl)cc34)cc2)CC1	ZINC000853957793	GJ	On-Demand	Clean	HRP1_PLAFA	109	38
COc1ccc(C)cc1COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957805	EF	On-Demand	Anodyne	TSHR	42	33
COc1ccc(C)cc1COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957807	EF	On-Demand	Anodyne	TSHR	42	33
O=[N+]([O-])c1ccc2c(NCc3ccc(N4CCC(O)CC4)cc3)nccc2c1	ZINC000853957814	GH	On-Demand	Clean	STAT6	30	41
CCCOc1cccc(CNC(=O)COC(=O)C[C@@H]2NC(=O)c3ccccc32)c1	ZINC000853957861	GF	On-Demand	Anodyne	PDS	40	36
CCCOc1cccc(CNC(=O)COC(=O)C[C@H]2NC(=O)c3ccccc32)c1	ZINC000853957862	GF	On-Demand	Anodyne	PDS	40	36
O=C(C[C@@H]1NC(=O)c2ccccc21)OCC(=O)N1CCC[C@H]2CCCC[C@H]21	ZINC000853957887	FF	On-Demand	Anodyne	CPT1A	50	33
O=C(C[C@@H]1NC(=O)c2ccccc21)OCC(=O)N1CCC[C@@H]2CCCC[C@H]21	ZINC000853957888	FF	On-Demand	Anodyne	CPT1A	50	33
O=C(C[C@@H]1NC(=O)c2ccccc21)OCC(=O)N1CCC[C@H]2CCCC[C@@H]21	ZINC000853957889	FF	On-Demand	Anodyne	CPT1A	50	33
O=C(C[C@@H]1NC(=O)c2ccccc21)OCC(=O)N1CCC[C@@H]2CCCC[C@@H]21	ZINC000853957890	FF	On-Demand	Anodyne	CPT1A	50	33
CCCCCNC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957929	DD	On-Demand	Anodyne	ASAH1	61	35
CCCCCNC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957930	DD	On-Demand	Anodyne	ASAH1	61	35
O=C(COC(=O)C[C@@H]1NC(=O)c2ccccc21)NC12CC3CC(CC(C3)C1)C2	ZINC000853957932	GE	On-Demand	Anodyne	EPHX2	64	41
O=C(COC(=O)C[C@H]1NC(=O)c2ccccc21)NC12CC3CC(CC(C3)C1)C2	ZINC000853957933	GE	On-Demand	Anodyne	EPHX2	64	41
OC1CCN(c2ccc(CNc3nc(C4CCOCC4)ns3)cc2)CC1	ZINC000853957943	FG	On-Demand	Clean	STAT6	52	41
C[C@@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957979	ED	On-Demand	Anodyne	CPT1A	88	35
C[C@@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957980	ED	On-Demand	Anodyne	CPT1A	88	35
C[C@H]1CCCCN1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853957981	ED	On-Demand	Anodyne	CPT1A	88	35
C[C@H]1CCCCN1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853957982	ED	On-Demand	Anodyne	CPT1A	88	35
CC(C)(C)OC(=O)N1CCC(COC(=O)C[C@@H]2NC(=O)c3ccccc32)CC1	ZINC000853958107	GG	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1CCC(COC(=O)C[C@H]2NC(=O)c3ccccc32)CC1	ZINC000853958108	GG	On-Demand	Anodyne	GPR119	39	42
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCn1ccnc1	ZINC000853958109	CD	On-Demand	Anodyne	TBXAS1	46	46
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCn1ccnc1	ZINC000853958110	CD	On-Demand	Anodyne	TBXAS1	46	46
COC(=O)Cc1ccnc(NCc2ccc(N3CCC(O)CC3)cc2)c1	ZINC000853958210	FE	On-Demand	Clean	STAT6	24	40
CC(=O)Nc1cccc(NC(=O)COC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853958211	FF	On-Demand	Anodyne	KCNK3	81	38
CC(=O)Nc1cccc(NC(=O)COC(=O)Cc2cc(C)cc(C)c2)c1	ZINC000853958211	FF	On-Demand	Anodyne	KCNK9	64	38
COC(=O)C1CCN(C(=O)COC(=O)C[C@@H]2NC(=O)c3ccccc32)CC1	ZINC000853958230	FC	On-Demand	Anodyne	PTR1	48	33
COC(=O)C1CCN(C(=O)COC(=O)C[C@H]2NC(=O)c3ccccc32)CC1	ZINC000853958231	FC	On-Demand	Anodyne	PTR1	48	33
OC1CCN(c2ccc(CNc3nccc4cc(F)ccc34)cc2)CC1	ZINC000853958234	FH	On-Demand	Clean	STAT6	74	37
NC(=O)c1cccc([N+](=O)[O-])c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853958238	FE	On-Demand	Clean	STAT6	62	48
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(C(F)(F)F)c1	ZINC000853958259	GH	On-Demand	Clean	MET	18	44
O=[N+]([O-])c1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(C(F)(F)F)c1	ZINC000853958259	GH	On-Demand	Clean	STAT6	52	33
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2cccs2)c1	ZINC000853958283	DF	On-Demand	Anodyne	CA5B	31	43
Cc1cc(C)cc(CC(=O)OCC(=O)NCc2cccs2)c1	ZINC000853958283	DF	On-Demand	Anodyne	CA5A	30	43
O=[N+]([O-])c1ccc2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)c2c1	ZINC000853958290	GH	On-Demand	Clean	STAT6	31	42
COc1c(C)ncnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853958301	EE	On-Demand	Clean	PDE5A	24	45
COc1c(C)ncnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853958301	EE	On-Demand	Clean	PDE6A	44	34
COc1c(C)ncnc1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853958301	EE	On-Demand	Clean	STAT6	21	41
CCCCCNC(=O)[C@@H](C)OC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853958393	EE	On-Demand	Anodyne	ASAH1	50	34
CCCCCNC(=O)[C@@H](C)OC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853958394	EE	On-Demand	Anodyne	ASAH1	50	34
CCCCCNC(=O)[C@H](C)OC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853958395	EE	On-Demand	Anodyne	ASAH1	50	34
CCCCCNC(=O)[C@H](C)OC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853958396	EE	On-Demand	Anodyne	ASAH1	50	34
COC(=O)/C=C\c1ccc(N(C)[C@H]2C[C@@H](C(=O)OC)C2)c([N+](=O)[O-])c1	ZINC000853958437	EE	On-Demand	Clean	NR1H4	43	36
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853958493	FD	On-Demand	Anodyne	TIMP3	51	36
CNC(=O)[C@@H](Cc1ccccc1)OC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853958494	FD	On-Demand	Anodyne	TIMP3	51	36
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	JAK3	15	55
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	JAK2	22	55
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	MAPK1	48	39
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	CLK4	32	56
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	EPHB4	48	35
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	MERTK	44	38
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	DYRK1B	26	62
COc1ccc(-c2ccnc(NCc3ccc(N4CCC(O)CC4)cc3)n2)cc1	ZINC000853958517	GH	On-Demand	Clean	STAT6	22	40
O=[N+]([O-])c1ccc2c(NCc3ccc(N4CCC(O)CC4)cc3)ccnc2c1	ZINC000853958531	GH	On-Demand	Clean	HRP1_PLAFA	90	49
O=[N+]([O-])c1ccc2c(NCc3ccc(N4CCC(O)CC4)cc3)ccnc2c1	ZINC000853958531	GH	On-Demand	Clean	MET	17	42
Cn1ncc2c(NCc3ccc(N4CCC(O)CC4)cc3)nc(N)nc21	ZINC000853958541	FD	On-Demand	Clean	HRH4	15	40
Cn1ncc2c(NCc3ccc(N4CCC(O)CC4)cc3)nc(N)nc21	ZINC000853958541	FD	On-Demand	Clean	STAT6	39	43
CNc1nc(NCc2ccc(N3CCC(O)CC3)cc2)nc2ccccc12	ZINC000853958546	FG	On-Demand	Clean	STAT6	53	49
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853958551	FE	On-Demand	Anodyne	DRD4	25	43
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853958551	FE	On-Demand	Anodyne	TPP2	55	32
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853958552	FE	On-Demand	Anodyne	DRD4	25	43
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853958552	FE	On-Demand	Anodyne	TPP2	55	32
COc1ccc(-c2nnc(NCc3ccc(N4CCC(O)CC4)cc3)s2)cc1	ZINC000853958564	GH	On-Demand	Clean	SPHK2	57	44
COc1ccc(-c2nnc(NCc3ccc(N4CCC(O)CC4)cc3)s2)cc1	ZINC000853958564	GH	On-Demand	Clean	SPHK1	45	44
COc1ccc(-c2nnc(NCc3ccc(N4CCC(O)CC4)cc3)s2)cc1	ZINC000853958564	GH	On-Demand	Clean	PROKR1	58	31
N#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(F)c1	ZINC000853958569	EF	On-Demand	Mild	PDE5A	15	43
N#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c(F)c1	ZINC000853958569	EF	On-Demand	Mild	STAT6	54	34
OC1CCN(c2ccc(CNc3ncnc4[nH]c5ccccc5c34)cc2)CC1	ZINC000853958570	FH	On-Demand	Clean	UTS2R	20	46
OC1CCN(c2ccc(CNc3ncnc4[nH]c5ccccc5c34)cc2)CC1	ZINC000853958570	FH	On-Demand	Clean	STAT6	39	46
N#Cc1cnc2c(Cl)cccc2c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853958571	GI	On-Demand	Mild	PDE5A	21	41
N#Cc1cnc2c(Cl)cccc2c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853958571	GI	On-Demand	Mild	SRC	50	40
N#Cc1cnc2c(Cl)cccc2c1NCc1ccc(N2CCC(O)CC2)cc1	ZINC000853958571	GI	On-Demand	Mild	MAP3K8	110	38
N#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853958573	FE	On-Demand	Mild	PDE5A	15	41
N#Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)c([N+](=O)[O-])c1	ZINC000853958573	FE	On-Demand	Mild	STAT6	31	41
OC1CCN(c2ccc(CNc3cc(-c4ccccc4)nc4ccnn34)cc2)CC1	ZINC000853958574	GH	On-Demand	Clean	STAT6	33	43
OC1CCN(c2ccc(CNc3cc(-c4ccccc4)nc4ccnn34)cc2)CC1	ZINC000853958574	GH	On-Demand	Clean	VCP	51	36
OC1CCN(c2ccc(CNc3cc(NC4CC4)ncn3)cc2)CC1	ZINC000853958585	EF	On-Demand	Clean	PRKD1	73	39
Nc1cccc2c(NCc3ccc(N4CCC(O)CC4)cc3)nccc12	ZINC000853958593	EG	On-Demand	Clean	STAT6	36	45
CCCCCCC(=O)COC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853958694	DF	On-Demand	Anodyne	PLA2G4B	44	34
CCCCCCC(=O)COC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853958696	DF	On-Demand	Anodyne	PLA2G4B	44	34
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCCCC1	ZINC000853958722	DE	On-Demand	Anodyne	HTR1A	17	42
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCCCC1	ZINC000853958722	DE	On-Demand	Anodyne	HTR4	16	43
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCCCC1	ZINC000853958722	DE	On-Demand	Anodyne	HRH3	80	48
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCCCC1	ZINC000853958723	DE	On-Demand	Anodyne	HTR1A	17	42
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCCCC1	ZINC000853958723	DE	On-Demand	Anodyne	HTR4	16	43
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCCCC1	ZINC000853958723	DE	On-Demand	Anodyne	HRH3	80	48
OC1CCN(c2ccc(CNc3ncc4c(n3)CCCC4)cc2)CC1	ZINC000853958806	EF	On-Demand	Clean	MERTK	57	37
OC1CCN(c2ccc(CNc3ncc4c(n3)CCCC4)cc2)CC1	ZINC000853958806	EF	On-Demand	Clean	STAT6	62	47
O=C(NCCc1cnccn1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853958879	GD	On-Demand	Anodyne	HTR1A	21	44
O=C(NCCc1cnccn1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853958879	GD	On-Demand	Anodyne	DRD3	16	44
CN(C)CCCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853958969	CD	On-Demand	Anodyne	AMY2	40	40
CN(C)CCCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853958970	CD	On-Demand	Anodyne	AMY2	40	40
CCN(CCCOC(=O)C[C@@H]1NC(=O)c2ccccc21)CC(F)(F)F	ZINC000853959079	FF	On-Demand	Anodyne	AMY2	49	38
CCN(CCCOC(=O)C[C@H]1NC(=O)c2ccccc21)CC(F)(F)F	ZINC000853959081	FF	On-Demand	Anodyne	AMY2	49	38
O=C(C[C@@H]1NC(=O)c2ccccc21)OCc1ccc(CN2CCCCC2)cc1	ZINC000853959173	GH	On-Demand	Anodyne	DRD4	20	40
O=C(C[C@@H]1NC(=O)c2ccccc21)OCc1ccc(CN2CCCCC2)cc1	ZINC000853959173	GH	On-Demand	Anodyne	HRH3	24	44
O=C(C[C@H]1NC(=O)c2ccccc21)OCc1ccc(CN2CCCCC2)cc1	ZINC000853959176	GH	On-Demand	Anodyne	DRD4	20	40
O=C(C[C@H]1NC(=O)c2ccccc21)OCc1ccc(CN2CCCCC2)cc1	ZINC000853959176	GH	On-Demand	Anodyne	HRH3	24	44
CCCOc1ccc(COC(=O)C[C@H]2NC(=O)c3ccccc32)cc1	ZINC000853959196	EG	On-Demand	Anodyne	PLA2G4B	48	33
CCCOc1ccc(COC(=O)C[C@@H]2NC(=O)c3ccccc32)cc1	ZINC000853959198	EG	On-Demand	Anodyne	PLA2G4B	48	33
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959239	DD	On-Demand	Anodyne	SLC6A1	53	36
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959239	DD	On-Demand	Anodyne	HTR4	16	45
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959239	DD	On-Demand	Anodyne	LTA4H	40	37
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959239	DD	On-Demand	Anodyne	HRH3	40	47
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959239	DD	On-Demand	Anodyne	PSMB1	42	38
O=C(C[C@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959241	DD	On-Demand	Anodyne	SLC6A1	53	36
O=C(C[C@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959241	DD	On-Demand	Anodyne	HTR4	16	45
O=C(C[C@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959241	DD	On-Demand	Anodyne	LTA4H	40	37
O=C(C[C@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959241	DD	On-Demand	Anodyne	HRH3	40	47
O=C(C[C@H]1NC(=O)c2ccccc21)OCCN1CCCCC1	ZINC000853959241	DD	On-Demand	Anodyne	PSMB1	42	38
CN(C(=O)NCCc1cnccn1)[C@H](CO)Cc1ccccc1	ZINC000853959333	DD	On-Demand	Anodyne	NPY5R	16	42
CN(C(=O)NCCc1cnccn1)[C@H](CO)Cc1ccccc1	ZINC000853959333	DD	On-Demand	Anodyne	AMP1_PLAFQ	36	40
CN(C(=O)NCCc1cnccn1)[C@@H](CO)Cc1ccccc1	ZINC000853959334	DD	On-Demand	Anodyne	NPY5R	16	42
CN(C(=O)NCCc1cnccn1)[C@@H](CO)Cc1ccccc1	ZINC000853959334	DD	On-Demand	Anodyne	AMP1_PLAFQ	36	40
N#Cc1cnc2c(Cl)cccc2c1NCCC1SCCS1	ZINC000853959337	EI	On-Demand	Mild	MAP3K8	98	36
C[C@@H](OC(=O)C[C@@H]1NC(=O)c2ccccc21)C(=O)N1CCCCC1	ZINC000853959404	ED	On-Demand	Anodyne	DPP7	58	35
C[C@@H](OC(=O)C[C@H]1NC(=O)c2ccccc21)C(=O)N1CCCCC1	ZINC000853959405	ED	On-Demand	Anodyne	DPP7	58	35
COC[C@@H](NC(=O)NCCN(C)OC)c1ccc(F)c(F)c1	ZINC000853959451	DD	On-Demand	Anodyne	UTS2	40	31
COC[C@H](NC(=O)NCCN(C)OC)c1ccc(F)c(F)c1	ZINC000853959452	DD	On-Demand	Anodyne	UTS2	40	31
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCOCC1	ZINC000853959503	DD	On-Demand	Anodyne	AVPR1B	21	40
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCOCC1	ZINC000853959503	DD	On-Demand	Anodyne	HRH3	20	43
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCOCC1	ZINC000853959503	DD	On-Demand	Anodyne	EPHX2	18	44
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCOCC1	ZINC000853959504	DD	On-Demand	Anodyne	AVPR1B	21	40
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCOCC1	ZINC000853959504	DD	On-Demand	Anodyne	HRH3	20	43
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCOCC1	ZINC000853959504	DD	On-Demand	Anodyne	EPHX2	18	44
O=C(C[C@@H]1NC(=O)c2ccccc21)OCc1cccc(CN2CCCCC2)c1	ZINC000853959551	GH	On-Demand	Anodyne	HRH2	40	39
O=C(C[C@H]1NC(=O)c2ccccc21)OCc1cccc(CN2CCCCC2)c1	ZINC000853959552	GH	On-Demand	Anodyne	HRH2	40	39
O=C(C[C@H]1NC(=O)c2ccccc21)OCCn1ccnc1	ZINC000853959663	CD	On-Demand	Anodyne	TBXAS1	43	43
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCn1ccnc1	ZINC000853959665	CD	On-Demand	Anodyne	TBXAS1	43	43
COC(=O)[C@@H]1C[C@H](N(C)c2nc(-c3ccncc3)nc3ccccc23)C1	ZINC000853959742	EG	On-Demand	Anodyne	TACR3	29	40
O=C(C[C@@H]1NC(=O)c2ccccc21)OCc1cccc(C(=O)N2CCCCC2)c1	ZINC000853959808	GG	On-Demand	Anodyne	PARP1	20	44
O=C(C[C@@H]1NC(=O)c2ccccc21)OCc1cccc(C(=O)N2CCCCC2)c1	ZINC000853959808	GG	On-Demand	Anodyne	L3MBTL3	40	38
O=C(C[C@H]1NC(=O)c2ccccc21)OCc1cccc(C(=O)N2CCCCC2)c1	ZINC000853959810	GG	On-Demand	Anodyne	PARP1	20	44
O=C(C[C@H]1NC(=O)c2ccccc21)OCc1cccc(C(=O)N2CCCCC2)c1	ZINC000853959810	GG	On-Demand	Anodyne	L3MBTL3	40	38
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCOc1ccc([N+](=O)[O-])cc1	ZINC000853959833	FF	On-Demand	Bother	SLC27A4	42	31
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCOc1ccc([N+](=O)[O-])cc1	ZINC000853959835	FF	On-Demand	Bother	SLC27A4	42	31
O=C(NCCc1cnccn1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853959935	FE	On-Demand	Anodyne	GPBAR1	17	43
O=C(NCCc1cnccn1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853959939	FE	On-Demand	Anodyne	GPBAR1	17	43
Cc1cc(N2CCc3cc(Br)c(Br)cc3C2)nc(N)n1	ZINC000853959960	GG	On-Demand	Anodyne	HRH4	39	56
COC(=O)[C@@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])cc2)C1	ZINC000853960048	CD	On-Demand	Bother	SLC27A4	51	35
C[C@@H](O)CCCOC(=O)C[C@@H]1NC(=O)c2ccccc21	ZINC000853960062	CD	On-Demand	Anodyne	GALR1	44	31
C[C@@H](O)CCCOC(=O)C[C@H]1NC(=O)c2ccccc21	ZINC000853960063	CD	On-Demand	Anodyne	GALR1	44	31
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCCc1ccccc1	ZINC000853960070	DG	On-Demand	Anodyne	NAAA	33	41
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCCc1ccccc1	ZINC000853960071	DG	On-Demand	Anodyne	NAAA	33	41
CC(C)(C)OC(=O)N1CC[C@H](COC(=O)C[C@@H]2NC(=O)c3ccccc32)C1	ZINC000853960082	FF	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CC[C@@H](COC(=O)C[C@@H]2NC(=O)c3ccccc32)C1	ZINC000853960083	FF	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CC[C@@H](COC(=O)C[C@H]2NC(=O)c3ccccc32)C1	ZINC000853960084	FF	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1CC[C@H](COC(=O)C[C@H]2NC(=O)c3ccccc32)C1	ZINC000853960085	FF	On-Demand	Anodyne	GPR119	31	41
C[C@H](CCOC(=O)C[C@@H]1NC(=O)c2ccccc21)OCc1ccccc1	ZINC000853960226	FG	On-Demand	Anodyne	GALR1	45	32
C[C@H](CCOC(=O)C[C@H]1NC(=O)c2ccccc21)OCc1ccccc1	ZINC000853960227	FG	On-Demand	Anodyne	GALR1	45	32
C[C@@H](CCOC(=O)C[C@H]1NC(=O)c2ccccc21)OCc1ccccc1	ZINC000853960228	FG	On-Demand	Anodyne	GALR1	45	32
C[C@@H](CCOC(=O)C[C@@H]1NC(=O)c2ccccc21)OCc1ccccc1	ZINC000853960229	FG	On-Demand	Anodyne	GALR1	45	32
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCC1CCCC1	ZINC000853960281	CF	On-Demand	Anodyne	HPGD	24	40
O=C(C[C@H]1NC(=O)c2ccccc21)OCCC1CCCC1	ZINC000853960282	CF	On-Demand	Anodyne	HPGD	24	40
COC[C@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960335	ED	On-Demand	Anodyne	ROCK1	17	40
COC[C@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960335	ED	On-Demand	Anodyne	MTNR1A	59	40
COC[C@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960335	ED	On-Demand	Anodyne	MTNR1B	53	40
COC[C@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960335	ED	On-Demand	Anodyne	ROCK2	20	40
COC[C@@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960337	ED	On-Demand	Anodyne	ROCK1	17	40
COC[C@@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960337	ED	On-Demand	Anodyne	MTNR1A	59	40
COC[C@@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960337	ED	On-Demand	Anodyne	MTNR1B	53	40
COC[C@@H](NC(=O)NCCc1cnccn1)c1cccc(OC)c1	ZINC000853960337	ED	On-Demand	Anodyne	ROCK2	20	40
CC(C)(C)OC(=O)N1CC[C@H](CCOC(=O)C[C@@H]2NC(=O)c3ccccc32)C1	ZINC000853960361	GG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@H](CCOC(=O)C[C@H]2NC(=O)c3ccccc32)C1	ZINC000853960363	GG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@@H](CCOC(=O)C[C@H]2NC(=O)c3ccccc32)C1	ZINC000853960369	GG	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@@H](CCOC(=O)C[C@@H]2NC(=O)c3ccccc32)C1	ZINC000853960371	GG	On-Demand	Anodyne	GPR119	30	41
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCOCc1ccccc1	ZINC000853960376	EG	On-Demand	Anodyne	NAAA	19	43
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCOCc1ccccc1	ZINC000853960378	EG	On-Demand	Anodyne	NAAA	19	43
COc1ccc(-c2ccnc(NCCC3SCCS3)n2)cc1	ZINC000853960381	EH	On-Demand	Anodyne	CLK4	28	54
COc1ccc(-c2ccnc(NCCC3SCCS3)n2)cc1	ZINC000853960381	EH	On-Demand	Anodyne	DYRK1B	18	56
COC(=O)[C@@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000853960406	CF	On-Demand	Bother	CACNA1D	41	34
COc1cccc(OCCOC(=O)C[C@@H]2NC(=O)c3ccccc32)c1	ZINC000853960466	EE	On-Demand	Anodyne	MTNR1A	24	42
COc1cccc(OCCOC(=O)C[C@@H]2NC(=O)c3ccccc32)c1	ZINC000853960466	EE	On-Demand	Anodyne	MTNR1B	24	42
COc1cccc(OCCOC(=O)C[C@H]2NC(=O)c3ccccc32)c1	ZINC000853960468	EE	On-Demand	Anodyne	MTNR1A	24	42
COc1cccc(OCCOC(=O)C[C@H]2NC(=O)c3ccccc32)c1	ZINC000853960468	EE	On-Demand	Anodyne	MTNR1B	24	42
CC(C)(C)OC(=O)N1CCC(OC(=O)C[C@@H]2NC(=O)c3ccccc32)CC1	ZINC000853960474	FF	On-Demand	Anodyne	GPR119	41	41
CC(C)(C)OC(=O)N1CCC(OC(=O)C[C@H]2NC(=O)c3ccccc32)CC1	ZINC000853960476	FF	On-Demand	Anodyne	GPR119	41	41
CC(=O)c1ccc(C(F)(F)F)nc1NCCC1SCCS1	ZINC000853960541	EH	On-Demand	Anodyne	TRPV1	65	33
c1cc(NCCC2SCCS2)c2sccc2n1	ZINC000853960550	CH	On-Demand	Anodyne	HRP1_PLAFA	50	34
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCCC1	ZINC000853960553	DD	On-Demand	Anodyne	HTR1A	20	42
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCCC1	ZINC000853960553	DD	On-Demand	Anodyne	SLC6A1	40	36
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCCN1CCCC1	ZINC000853960553	DD	On-Demand	Anodyne	HRH3	73	47
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCCC1	ZINC000853960554	DD	On-Demand	Anodyne	HTR1A	20	42
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCCC1	ZINC000853960554	DD	On-Demand	Anodyne	SLC6A1	40	36
O=C(C[C@H]1NC(=O)c2ccccc21)OCCCN1CCCC1	ZINC000853960554	DD	On-Demand	Anodyne	HRH3	73	47
Nc1nc(NCCC2SCCS2)cc(-n2cccn2)n1	ZINC000853960568	DD	On-Demand	Anodyne	HRH4	15	40
O=C(C[C@@H]1NC(=O)c2ccccc21)OCCSCc1ccccc1	ZINC000853960591	EG	On-Demand	Anodyne	CACNA2D1	15	40
O=C(C[C@H]1NC(=O)c2ccccc21)OCCSCc1ccccc1	ZINC000853960593	EG	On-Demand	Anodyne	CACNA2D1	15	40
Cc1cc(C(=O)CCC(=O)OCC(=O)Nc2ccc(N3CCCCC3)nc2)c(C)s1	ZINC000853960630	IH	On-Demand	Anodyne	DGAT1	34	42
Fc1cnc2c(NCCC3SCCS3)ccnc2c1	ZINC000853960691	CG	On-Demand	Anodyne	HRP1_PLAFA	45	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCc1cnccn1	ZINC000853960693	FD	On-Demand	Anodyne	GPR119	33	45
O=C(C[C@@H]1NC(=O)c2ccccc21)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853960695	FF	On-Demand	Anodyne	DRD4	37	43
O=C(C[C@@H]1NC(=O)c2ccccc21)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853960695	FF	On-Demand	Anodyne	SIGMAR1	44	40
O=C(C[C@@H]1NC(=O)c2ccccc21)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000853960697	FF	On-Demand	Anodyne	DRD4	37	43
O=C(C[C@@H]1NC(=O)c2ccccc21)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000853960697	FF	On-Demand	Anodyne	SIGMAR1	44	40
O=C(C[C@H]1NC(=O)c2ccccc21)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000853960699	FF	On-Demand	Anodyne	DRD4	37	43
O=C(C[C@H]1NC(=O)c2ccccc21)O[C@H]1CCN(Cc2ccccc2)C1	ZINC000853960699	FF	On-Demand	Anodyne	SIGMAR1	44	40
O=C(C[C@H]1NC(=O)c2ccccc21)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853960701	FF	On-Demand	Anodyne	DRD4	37	43
O=C(C[C@H]1NC(=O)c2ccccc21)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853960701	FF	On-Demand	Anodyne	SIGMAR1	44	40
c1ccc(-c2cnc(NCCC3SCCS3)cn2)cc1	ZINC000853960715	DH	On-Demand	Anodyne	TPH1	28	40
CCn1c(=O)c(NCCC2SCCS2)nc2ccccc21	ZINC000853960718	DG	On-Demand	Anodyne	PYGM	20	43
O=C(NCCc1cnccn1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853960776	ED	On-Demand	Anodyne	EPHX2	22	43
O=[N+]([O-])c1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853960789	DH	On-Demand	Bother	HRP1_PLAFA	126	46
O=[N+]([O-])c1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853960789	DH	On-Demand	Bother	HNMT	46	37
COC(=O)c1ccc(C(F)(F)F)nc1NCCC1SCCS1	ZINC000853960896	FG	On-Demand	Anodyne	TRPV1	58	32
O=C(NCCc1cnccn1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853960900	EC	On-Demand	Anodyne	L3MBTL3	52	37
O=C(NCCc1cnccn1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853960901	EC	On-Demand	Anodyne	L3MBTL3	52	37
CC(C)(C)OC(=O)N1CC[C@](C)(NC(=O)NCCc2cnccn2)C1	ZINC000853960916	ED	On-Demand	Anodyne	GPR119	15	41
CC(C)(C)OC(=O)N1CC[C@@](C)(NC(=O)NCCc2cnccn2)C1	ZINC000853960917	ED	On-Demand	Anodyne	GPR119	15	41
COc1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853960918	DH	On-Demand	Anodyne	HRP1_PLAFA	133	47
COc1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853960918	DH	On-Demand	Anodyne	HNMT	64	40
COc1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853960918	DH	On-Demand	Anodyne	BOTA	20	43
CN1CCN(c2nc3ccccc3nc2NCCC2SCCS2)CC1	ZINC000853960919	GF	On-Demand	Anodyne	HTR3A	30	48
CN1CCN(c2nc3ccccc3nc2NCCC2SCCS2)CC1	ZINC000853960919	GF	On-Demand	Anodyne	HRH4	34	48
O=C(c1cccnc1NCCC1SCCS1)N1CCc2ccccc21	ZINC000853960964	FH	On-Demand	Anodyne	AVPR2	49	38
CC(=O)c1ccc(NCCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853960969	DG	On-Demand	Bother	TAAR1	19	44
O=C(NCCc1cnccn1)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853960996	FD	On-Demand	Anodyne	NAMPT	43	38
O=C(NCCc1cnccn1)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853960998	FD	On-Demand	Anodyne	NAMPT	43	38
O=[N+]([O-])c1ccc(-c2csc(NCCC3SCCS3)n2)cc1	ZINC000853961003	FI	On-Demand	Bother	MAOB	15	55
c1ccc2c(c1)[nH]c1ncnc(NCCC3SCCS3)c12	ZINC000853961027	DH	On-Demand	Anodyne	UTS2R	23	44
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1ccccc1	ZINC000853961197	FD	On-Demand	Anodyne	CARM1	73	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1ccccc1	ZINC000853961198	FD	On-Demand	Anodyne	CARM1	73	41
c1nc(NCCC2SCCS2)c2ncn(C3CC3)c2n1	ZINC000853961209	DF	On-Demand	Anodyne	ADORA1	48	41
c1nc(NCCC2SCCS2)c2ncn(C3CC3)c2n1	ZINC000853961209	DF	On-Demand	Anodyne	ADORA3	46	42
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	ADORA1	169	71
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	SLC29A1	140	62
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	ADORA2A	59	65
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	ADORA2B	19	64
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	ADK	64	56
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	AHCY	55	39
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	CDA	41	35
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	P2RX4	35	41
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	P2RX1	46	40
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	P2RY1	34	41
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	AMD1	28	41
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	P2RY2	15	41
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	ADORA3	134	64
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	OXGR1	122	41
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	RNASE1	42	33
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	DNMT3B	76	45
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	Q4VQ11_PIG	87	64
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	GPR17	57	45
OC[C@H]1O[C@@H](n2cnc3c(NCCC4SCCS4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853961215	GC	On-Demand	Anodyne	DOT1L	92	43
c1cc(N2CCOCC2)nc(NCCC2SCCS2)n1	ZINC000853961218	DD	On-Demand	Anodyne	EPHB4	72	35
O=C(NCCc1cnccn1)N1CCc2sccc2[C@@H]1c1ccc(Cl)cc1	ZINC000853961243	GI	On-Demand	Anodyne	TRPM8	29	56
O=C(NCCc1cnccn1)N1CCc2sccc2[C@H]1c1ccc(Cl)cc1	ZINC000853961244	GI	On-Demand	Anodyne	TRPM8	29	56
Oc1cccc2c(NCCC3SCCS3)ccnc12	ZINC000853961274	CH	On-Demand	Anodyne	HRP1_PLAFA	83	37
Oc1cccc2c(NCCC3SCCS3)ccnc12	ZINC000853961274	CH	On-Demand	Anodyne	HNMT	51	40
COc1cccc(C2(NC(=O)NCCc3cnccn3)CCC2)c1	ZINC000853961393	EE	On-Demand	Anodyne	DRD4	40	31
COc1cccc(C2(NC(=O)NCCc3cnccn3)CCC2)c1	ZINC000853961393	EE	On-Demand	Anodyne	MTNR1A	50	36
COc1cccc(C2(NC(=O)NCCc3cnccn3)CCC2)c1	ZINC000853961393	EE	On-Demand	Anodyne	MTNR1B	44	36
Fc1cccc2c(NCCC3SCCS3)ccnc12	ZINC000853961397	CH	On-Demand	Anodyne	HRP1_PLAFA	77	37
Fc1cccc2c(NCCC3SCCS3)ccnc12	ZINC000853961397	CH	On-Demand	Anodyne	HNMT	49	36
O=C(NCCc1cnccn1)N(CCN1CCOCC1)CC1CC1	ZINC000853961423	EC	On-Demand	Anodyne	CASR	46	47
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC1CCCCCCC1	ZINC000853961425	EF	On-Demand	Anodyne	EPHX2	31	41
CS(=O)(=O)c1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853961442	FF	On-Demand	Anodyne	CLK4	55	34
CS(=O)(=O)c1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853961442	FF	On-Demand	Anodyne	CD38	45	40
Cn1ncc2c(NCCC3SCCS3)ccnc21	ZINC000853961447	CF	On-Demand	Anodyne	HRP1_PLAFA	72	35
Cn1ncc2c(NCCC3SCCS3)ccnc21	ZINC000853961447	CF	On-Demand	Anodyne	HNMT	46	35
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCc1cnccn1	ZINC000853961448	FH	On-Demand	Anodyne	MME	42	36
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCc1cnccn1	ZINC000853961448	FH	On-Demand	Anodyne	AMP1_PLAFQ	41	40
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCc1cnccn1	ZINC000853961448	FH	On-Demand	Anodyne	PSMB5	43	39
O=[N+]([O-])c1cccc2c(NCCC3SCCS3)ccnc12	ZINC000853961464	DH	On-Demand	Bother	HRP1_PLAFA	48	34
Fc1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853961485	CH	On-Demand	Anodyne	HRP1_PLAFA	128	42
Fc1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853961485	CH	On-Demand	Anodyne	HNMT	59	40
Fc1ccc2c(NCCC3SCCS3)ccnc2c1	ZINC000853961485	CH	On-Demand	Anodyne	BOTA	15	43
Nc1nc(NCCC2SCCS2)ncc1[N+](=O)[O-]	ZINC000853961504	CD	On-Demand	Bother	PRKCQ	29	40
O=C(NC1CC1)c1cc(NCCC2SCCS2)nc2ccccc12	ZINC000853961508	FH	On-Demand	Anodyne	METG	49	33
O=C(NC1CC1)c1cc(NCCC2SCCS2)nc2ccccc12	ZINC000853961508	FH	On-Demand	Anodyne	TNKS	56	31
Cc1nc(NCCC2SCCS2)cc(-c2cccnc2)n1	ZINC000853961548	DG	On-Demand	Anodyne	CYP2E1	45	35
Cc1nc(NCCC2SCCS2)cc(-c2cccnc2)n1	ZINC000853961548	DG	On-Demand	Anodyne	ROS1	61	38
NS(=O)(=O)c1ccc(NCCC2SCCS2)c(C(F)(F)F)c1	ZINC000853961553	FF	On-Demand	Anodyne	CA2	23	42
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1ccc(F)cc1	ZINC000853961566	FD	On-Demand	Anodyne	CARM1	44	34
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1ccc(F)cc1	ZINC000853961567	FD	On-Demand	Anodyne	CARM1	44	34
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1cccnc1	ZINC000853961568	ED	On-Demand	Anodyne	PTAFR	18	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1cccnc1	ZINC000853961568	ED	On-Demand	Anodyne	CARM1	60	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1cccnc1	ZINC000853961568	ED	On-Demand	Anodyne	NAMPT	39	41
COC(=O)[C@@H](C)NC(=O)c1ccc(NCCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853961598	GE	On-Demand	Bother	TAAR1	20	45
Brc1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853961599	FI	On-Demand	Anodyne	EGFR	64	39
Brc1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853961599	FI	On-Demand	Anodyne	CLK4	61	37
Brc1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853961599	FI	On-Demand	Anodyne	CD38	61	40
O=C(NC1CC1)c1ccc(NCCC2SCCS2)nc1	ZINC000853961606	DF	On-Demand	Anodyne	SSTR5	22	40
O=C(c1cnc(NCCC2SCCS2)c(Cl)c1)N1CCOCC1	ZINC000853961607	FF	On-Demand	Anodyne	LRRK2	29	43
CON(C)CCNC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000853961626	CD	On-Demand	Bother	COLA	111	36
CON(C)CCNC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000853961627	CD	On-Demand	Bother	COLA	111	36
CO[C@H]1CCC[C@@H]1CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853961631	FG	On-Demand	Reactive	CSNK1D	39	45
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1ccccc1F	ZINC000853961640	FD	On-Demand	Anodyne	CARM1	70	39
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1ccccc1F	ZINC000853961641	FD	On-Demand	Anodyne	CARM1	70	39
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCCOc1ccccc1F	ZINC000853961645	GE	On-Demand	Anodyne	CARM1	68	39
FC(F)(F)c1cc(NCCC2SCCS2)nc(-c2cccnc2)n1	ZINC000853961659	FI	On-Demand	Anodyne	ROS1	46	35
c1coc(CCCNc2nccc(N3CCCC3)n2)c1	ZINC000853961672	CF	On-Demand	Anodyne	MRGPRX1	43	45
COc1ccccc1[C@@H](O)CNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853961674	GD	On-Demand	Anodyne	CARM1	69	41
c1cncc(-c2nc(NCCC3SCCS3)c3ccccc3n2)c1	ZINC000853961692	FI	On-Demand	Anodyne	PKN2	18	43
O=[N+]([O-])c1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853961703	DG	On-Demand	Bother	CLK4	58	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000853961706	FF	On-Demand	Mild	COLA	97	35
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000853961707	FF	On-Demand	Mild	COLA	97	35
O=C(c1ccc(NCCC2SCCS2)nc1)N1CCc2ccccc21	ZINC000853961721	FH	On-Demand	Anodyne	AVPR2	99	44
O=C(c1ccc(NCCC2SCCS2)nc1)N1CCc2ccccc21	ZINC000853961721	FH	On-Demand	Anodyne	AVPR1A	64	44
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccc(N2CCCC2)cc1	ZINC000853961741	GE	On-Demand	Clean	CARM1	62	37
NS(=O)(=O)c1ccc(NCCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853961769	ED	On-Demand	Bother	CA2	20	45
CC[C@@H](NC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C)c1ccccc1OC	ZINC000853961799	GF	On-Demand	Anodyne	CARM1	41	37
COc1ccc([C@@H](O)CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)cc1	ZINC000853961821	GD	On-Demand	Anodyne	CARM1	46	35
c1ccc(-c2nc3c(c(NCCC4SCCS4)n2)CCC3)nc1	ZINC000853961823	EH	On-Demand	Anodyne	METAP1	19	41
CCOC(=O)N1CCC(NC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)CC1	ZINC000853961828	GD	On-Demand	Anodyne	EPHX2	35	40
C[C@H](Cc1ccco1)NC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853961863	ED	On-Demand	Anodyne	CARM1	50	35
C[C@@H](Cc1ccco1)NC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853961864	ED	On-Demand	Anodyne	CARM1	50	35
C#CCNC(=O)c1ccc(N2C[C@H]3CC[C@@H](C3)C2)nc1	ZINC000853961869	CD	On-Demand	Mild	HPGDS	16	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(Cl)cn1	ZINC000853961906	GG	On-Demand	Anodyne	GPR119	40	41
C[C@@H](CCNC(=O)NOC1CCCC1)N(C)C	ZINC000853961927	BD	On-Demand	Anodyne	CHRNA3	26	41
C[C@@H](CCNC(=O)NOC1CCCC1)N(C)C	ZINC000853961927	BD	On-Demand	Anodyne	CHRNA4	24	45
O=C(NNc1nc2ccc(Cl)cc2s1)NOC1CCCC1	ZINC000853961929	EG	On-Demand	Reactive	CSNK1D	36	42
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	DRD4	35	47
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	ACHE	23	40
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	CHRM3	16	40
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	SIGMAR1	28	45
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	CCR3	27	41
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	UTS2R	18	40
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	MCHR1	21	44
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961930	IH	On-Demand	Anodyne	BIRC2	31	42
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	DRD4	35	47
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	ACHE	23	40
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	CHRM3	16	40
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	SIGMAR1	28	45
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	CCR3	27	41
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	UTS2R	18	40
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	MCHR1	21	44
Cc1cc(C(=O)CCC(=O)O[C@@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961931	IH	On-Demand	Anodyne	BIRC2	31	42
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	DRD4	35	47
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	ACHE	23	40
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	CHRM3	16	40
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	SIGMAR1	28	45
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	CCR3	27	41
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	UTS2R	18	40
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	MCHR1	21	44
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961932	IH	On-Demand	Anodyne	BIRC2	31	42
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	DRD4	35	47
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	ACHE	23	40
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	CHRM3	16	40
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	SIGMAR1	28	45
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	CCR3	27	41
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	UTS2R	18	40
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	MCHR1	21	44
Cc1cc(C(=O)CCC(=O)O[C@H](C)C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c(C)s1	ZINC000853961933	IH	On-Demand	Anodyne	BIRC2	31	42
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@@H](C3)C2)c2nonc12	ZINC000853961944	CE	On-Demand	Bother	GSTM2	115	44
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@@H](C3)C2)c2nonc12	ZINC000853961944	CE	On-Demand	Bother	GSTP1	70	44
O=C(NC[C@H]1COC2(CCCCC2)O1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853961962	FF	On-Demand	Anodyne	EPHX2	18	43
O=C(NC[C@@H]1COC2(CCCCC2)O1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853961964	FF	On-Demand	Anodyne	EPHX2	18	43
CO[C@H]1CCC[C@@H]1CNC(=O)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853961995	EE	On-Demand	Reactive	SLC27A4	43	32
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000853961998	GD	On-Demand	Anodyne	ADRB1	25	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000853961998	GD	On-Demand	Anodyne	ADRB3	40	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1cccc(Cl)c1	ZINC000853961998	GD	On-Demand	Anodyne	CARM1	58	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000853961999	GD	On-Demand	Anodyne	ADRB1	25	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000853961999	GD	On-Demand	Anodyne	ADRB3	40	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1cccc(Cl)c1	ZINC000853961999	GD	On-Demand	Anodyne	CARM1	58	37
O=c1c(Cl)c(NCCC2SCCS2)cnn1-c1ccc(Cl)cc1	ZINC000853962016	GI	On-Demand	Anodyne	HRP1_PLAFA	47	35
N#Cc1cnc2c(F)cc(F)cc2c1NCCC1SCCS1	ZINC000853962028	EH	On-Demand	Mild	MAP3K8	87	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1ccco1	ZINC000853962036	EC	On-Demand	Anodyne	CARM1	55	35
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1ccco1	ZINC000853962037	EC	On-Demand	Anodyne	CARM1	55	35
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccccc1[N+](=O)[O-]	ZINC000853962043	DE	On-Demand	Mild	COLA	95	32
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-]	ZINC000853962044	DE	On-Demand	Mild	COLA	95	32
CCn1c(CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)nc2ccccc21	ZINC000853962062	GE	On-Demand	Anodyne	CARM1	50	35
Fc1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853962070	CG	On-Demand	Anodyne	CLK4	61	38
Fc1ccc2ncnc(NCCC3SCCS3)c2c1	ZINC000853962070	CG	On-Demand	Anodyne	CD38	58	40
O=C(NC1CC1)c1ccc(NCCC2SCCS2)c([N+](=O)[O-])c1	ZINC000853962098	FG	On-Demand	Bother	TAAR1	17	42
COC[C@H](NC(=O)NOC1CCCC1)c1cccc(OC)c1	ZINC000853962106	DF	On-Demand	Anodyne	PDE4A	15	40
COC[C@@H](NC(=O)NOC1CCCC1)c1cccc(OC)c1	ZINC000853962107	DF	On-Demand	Anodyne	PDE4A	15	40
COc1cccc(C2(NC(=O)NOC3CCCC3)CCC2)c1	ZINC000853962137	DG	On-Demand	Anodyne	NPBWR1	43	30
O=C(NOC1CCCC1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853962142	FF	On-Demand	Anodyne	HTR1A	29	41
O=C(NOC1CCCC1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853962142	FF	On-Demand	Anodyne	DRD2	16	43
O=C(NOC1CCCC1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853962142	FF	On-Demand	Anodyne	DRD3	17	43
O=C(NOC1CCCC1)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853962142	FF	On-Demand	Anodyne	SLC12A5	52	38
O=C(NOC1CCCC1)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853962177	EG	On-Demand	Anodyne	CPT1A	41	37
O=C(NOC1CCCC1)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853962178	EG	On-Demand	Anodyne	CPT1A	41	37
COCCc1ccc(OC[C@@H](O)CNC(=O)NOC2CCCC2)cc1	ZINC000853962193	FD	On-Demand	Anodyne	ADRB2	45	57
COCCc1ccc(OC[C@@H](O)CNC(=O)NOC2CCCC2)cc1	ZINC000853962193	FD	On-Demand	Anodyne	ADRB1	80	58
COCCc1ccc(OC[C@@H](O)CNC(=O)NOC2CCCC2)cc1	ZINC000853962193	FD	On-Demand	Anodyne	ADRB3	55	43
COCCc1ccc(OC[C@H](O)CNC(=O)NOC2CCCC2)cc1	ZINC000853962194	FD	On-Demand	Anodyne	ADRB2	45	57
COCCc1ccc(OC[C@H](O)CNC(=O)NOC2CCCC2)cc1	ZINC000853962194	FD	On-Demand	Anodyne	ADRB1	80	58
COCCc1ccc(OC[C@H](O)CNC(=O)NOC2CCCC2)cc1	ZINC000853962194	FD	On-Demand	Anodyne	ADRB3	55	43
O=C(NNc1ccc([N+](=O)[O-])cc1F)NOC1CCCC1	ZINC000853962222	CE	On-Demand	Reactive	SLC27A4	52	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOC1CCCC1	ZINC000853962238	ED	On-Demand	Anodyne	OPRK1	21	40
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOC1CCCC1	ZINC000853962238	ED	On-Demand	Anodyne	SIGMAR1	21	42
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOC1CCCC1	ZINC000853962238	ED	On-Demand	Anodyne	CCR3	28	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOC1CCCC1	ZINC000853962238	ED	On-Demand	Anodyne	TPSAB1	15	41
O=C(NCc1ccc(CN2CC[C@H](O)C2)cc1)NOC1CCCC1	ZINC000853962238	ED	On-Demand	Anodyne	MCHR1	21	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOC1CCCC1	ZINC000853962239	ED	On-Demand	Anodyne	OPRK1	21	40
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOC1CCCC1	ZINC000853962239	ED	On-Demand	Anodyne	SIGMAR1	21	42
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOC1CCCC1	ZINC000853962239	ED	On-Demand	Anodyne	CCR3	28	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOC1CCCC1	ZINC000853962239	ED	On-Demand	Anodyne	TPSAB1	15	41
O=C(NCc1ccc(CN2CC[C@@H](O)C2)cc1)NOC1CCCC1	ZINC000853962239	ED	On-Demand	Anodyne	MCHR1	21	41
O=C(NOC1CCCC1)N1CCN(S(=O)(=O)NCc2ccccc2)CC1	ZINC000853962257	GD	On-Demand	Anodyne	GRIN2B	42	42
O=C(NOC1CCCC1)N1CCN(S(=O)(=O)NCc2ccccc2)CC1	ZINC000853962257	GD	On-Demand	Anodyne	PREP	42	41
O=C(NOC1CCCC1)N1CCN(S(=O)(=O)NCc2ccccc2)CC1	ZINC000853962257	GD	On-Demand	Anodyne	TGM2	41	42
O=C(NOC1CCCC1)N1CCN(S(=O)(=O)NCc2ccccc2)CC1	ZINC000853962257	GD	On-Demand	Anodyne	F13A1	58	42
O=C(NOC1CCCC1)N1CCN(S(=O)(=O)NCc2ccccc2)CC1	ZINC000853962257	GD	On-Demand	Anodyne	TMPRSS11D	55	34
O=C(NOC1CCCC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853962274	CD	On-Demand	Anodyne	L3MBTL3	40	32
O=C(NOC1CCCC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853962275	CD	On-Demand	Anodyne	L3MBTL3	40	32
COC(=O)c1sc(N2CCC[C@@H](C(=O)NC(C)C)C2)nc1Cl	ZINC000853962312	EE	On-Demand	Anodyne	PARE	77	34
COC(=O)c1sc(N2CCC[C@H](C(=O)NC(C)C)C2)nc1Cl	ZINC000853962313	EE	On-Demand	Anodyne	PARE	77	34
Nc1nc(Cl)cc(N2CCc3nccnc3C2)n1	ZINC000853962314	CD	On-Demand	Anodyne	HRH4	28	40
COc1ccc2c(N3CCC[C@H](C(=O)NC(C)C)C3)ccnc2c1	ZINC000853962317	EF	On-Demand	Anodyne	NTSR2	22	42
COc1ccc2c(N3CCC[C@H](C(=O)NC(C)C)C3)ccnc2c1	ZINC000853962317	EF	On-Demand	Anodyne	KDR	32	41
COc1ccc2c(N3CCC[C@@H](C(=O)NC(C)C)C3)ccnc2c1	ZINC000853962318	EF	On-Demand	Anodyne	NTSR2	22	42
COc1ccc2c(N3CCC[C@@H](C(=O)NC(C)C)C3)ccnc2c1	ZINC000853962318	EF	On-Demand	Anodyne	KDR	32	41
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853962322	EE	On-Demand	Bother	CACNA1C	40	34
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853962322	EE	On-Demand	Bother	CACNA1D	58	34
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853962323	EE	On-Demand	Bother	CACNA1C	40	34
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853962323	EE	On-Demand	Bother	CACNA1D	58	34
COC(=O)c1cccc(N2C[C@H]3CC[C@@H](C3)C2)n1	ZINC000853962452	BE	On-Demand	Anodyne	HSD11B1	18	41
O=C(NOC1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853962498	DF	On-Demand	Anodyne	SLC6A3	22	43
O=C(NOC1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853962498	DF	On-Demand	Anodyne	CCR5	35	42
O=C(NOC1CCCC1)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853962498	DF	On-Demand	Anodyne	EPHX2	25	42
CCOC(=O)c1nnc2ccccc2c1N1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853962516	FF	On-Demand	Anodyne	SSTR2	42	37
CCOC(=O)c1nnc2ccccc2c1N1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853962516	FF	On-Demand	Anodyne	ELANE	15	43
CCOC(=O)c1nnc2ccccc2c1N1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853962516	FF	On-Demand	Anodyne	NTSR1	41	31
CCOC(=O)c1nnc2ccccc2c1N1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853962517	FF	On-Demand	Anodyne	SSTR2	42	37
CCOC(=O)c1nnc2ccccc2c1N1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853962517	FF	On-Demand	Anodyne	ELANE	15	43
CCOC(=O)c1nnc2ccccc2c1N1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853962517	FF	On-Demand	Anodyne	NTSR1	41	31
CC(=O)c1ccc(N2CCC[C@H](C(=O)NC(C)C)C2)c([N+](=O)[O-])c1	ZINC000853962526	EF	On-Demand	Bother	TAAR1	20	47
CC(=O)c1ccc(N2CCC[C@@H](C(=O)NC(C)C)C2)c([N+](=O)[O-])c1	ZINC000853962527	EF	On-Demand	Bother	TAAR1	20	47
C#CCCN(CCOC)C(=O)N[C@@H](C)CN(C)Cc1ccccc1	ZINC000853962531	EE	On-Demand	Mild	PTGES	25	40
C#CCCN(CCOC)C(=O)N[C@H](C)CN(C)Cc1ccccc1	ZINC000853962532	EE	On-Demand	Mild	PTGES	25	40
CN(C)c1nccc(CNC(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853962536	GD	On-Demand	Anodyne	GPR119	34	40
C[C@H](Cc1ccccc1Cl)NC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853962685	GF	On-Demand	Anodyne	CARM1	59	37
C[C@@H](Cc1ccccc1Cl)NC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853962686	GF	On-Demand	Anodyne	CARM1	59	37
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NCc2ccc(Cl)cn2)C3)cn1	ZINC000853962752	GE	On-Demand	Anodyne	MAPK1	47	40
c1cc(N2CCCC2)nc(N2C[C@H]3CC[C@@H](C3)C2)n1	ZINC000853962777	CE	On-Demand	Anodyne	SORD	80	37
O=C(NOC1CCCC1)N(CCN1CCOCC1)CC1CC1	ZINC000853962800	DD	On-Demand	Anodyne	CASR	48	36
c1cc(N2CCCC2)nc(N2CCc3nccnc3C2)n1	ZINC000853962803	CD	On-Demand	Anodyne	SORD	60	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1cccc(F)c1	ZINC000853962805	FD	On-Demand	Anodyne	CARM1	61	38
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1cccc(F)c1	ZINC000853962807	FD	On-Demand	Anodyne	CARM1	61	38
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000853962832	GG	On-Demand	Anodyne	RBP4	49	42
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000853962832	GG	On-Demand	Anodyne	SFRP1	117	35
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC[C@H](c2ccccc2)CC1	ZINC000853962832	GG	On-Demand	Anodyne	WNT3	82	35
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000853962834	GG	On-Demand	Anodyne	RBP4	49	42
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000853962834	GG	On-Demand	Anodyne	SFRP1	117	35
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC[C@@H](c2ccccc2)CC1	ZINC000853962834	GG	On-Demand	Anodyne	WNT3	82	35
O=C(NOC1CCCC1)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853962835	DD	On-Demand	Anodyne	L3MBTL3	56	40
O=C(NOC1CCCC1)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853962836	DD	On-Demand	Anodyne	L3MBTL3	56	40
COCCN(CCF)C(=O)NC[C@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2	ZINC000853962843	GD	On-Demand	Anodyne	ACKR3	52	33
COCCN(CCF)C(=O)NC[C@@H]1CN(C(=O)c2ccccc2)[C@H]2CCN1C2	ZINC000853962845	GD	On-Demand	Anodyne	ACKR3	52	33
O=C(NC[C@H]1COC2(CCCCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853962858	EE	On-Demand	Anodyne	CPT1A	68	35
O=C(NC[C@@H]1COC2(CCCCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853962860	EE	On-Demand	Anodyne	CPT1A	68	35
O=C(NC[C@H]1COC2(CCCCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853962862	EE	On-Demand	Anodyne	CPT1A	68	35
O=C(NC[C@@H]1COC2(CCCCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853962865	EE	On-Demand	Anodyne	CPT1A	68	35
FC(F)(F)c1nc(N2CCc3nccnc3C2)c2ccccc2n1	ZINC000853962877	EG	On-Demand	Anodyne	METAP1	20	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCC(=O)NCc1ccccc1	ZINC000853962934	GC	On-Demand	Anodyne	CARM1	82	44
O=C(NOC1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853962952	CF	On-Demand	Anodyne	CHRM2	15	45
O=C(NOC1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853962952	CF	On-Demand	Anodyne	CHRM3	27	45
O=C(NOC1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853962952	CF	On-Demand	Anodyne	GRIN2B	30	45
O=C(NOC1CCCC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853962952	CF	On-Demand	Anodyne	EPHX2	28	52
Cc1ccc(CC2CN(C(=O)NOC3CCCC3)C2)cc1	ZINC000853963020	CG	On-Demand	Anodyne	GRIN2B	26	42
COCc1cc([N+](=O)[O-])ccc1N1C[C@H]2CC[C@@H](C2)C1	ZINC000853963028	CF	On-Demand	Bother	CACNA1D	45	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccc(OCC#N)cc1	ZINC000853963069	GD	On-Demand	Mild	CARM1	51	35
C#Cc1cccnc1N1CCC[C@H](C(=O)NC(C)C)C1	ZINC000853963070	CD	On-Demand	Mild	GPBAR1	20	43
C#Cc1cccnc1N1CCC[C@@H](C(=O)NC(C)C)C1	ZINC000853963071	CD	On-Demand	Mild	GPBAR1	20	43
O=C(NOC1CCCC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853963105	CD	On-Demand	Anodyne	CPT1A	71	36
O=C(NOC1CCCC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853963106	CD	On-Demand	Anodyne	CPT1A	71	36
CC(C)(C)N1C[C@@H](CNC(=O)NOC2CCCC2)CC1=O	ZINC000853963116	CD	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)N1C[C@H](CNC(=O)NOC2CCCC2)CC1=O	ZINC000853963117	CD	On-Demand	Anodyne	CACNA1I	40	31
CN(C)c1nccc(CNC(=O)NNc2cccc3c2OC(F)(F)O3)n1	ZINC000853963187	FD	On-Demand	Reactive	KIT	18	51
CN(C)c1nccc(CNC(=O)NNc2cccc3c2OC(F)(F)O3)n1	ZINC000853963187	FD	On-Demand	Reactive	BRAF	15	51
CON(C)CCNC(=O)NCc1ccc(Cl)cn1	ZINC000853963203	CD	On-Demand	Anodyne	F10	48	33
Cc1cc(N2CCc3nccnc3C2)nc(N)n1	ZINC000853963216	BC	On-Demand	Anodyne	HRH4	37	55
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCC1CCCCCCC1	ZINC000853963235	FF	On-Demand	Anodyne	CACNA1I	42	38
COC(=O)c1cccc(N2CCC[C@@H](C(=O)NC(C)C)C2)n1	ZINC000853963278	DD	On-Demand	Anodyne	ALK	16	42
COC(=O)c1cccc(N2CCC[C@@H](C(=O)NC(C)C)C2)n1	ZINC000853963278	DD	On-Demand	Anodyne	GPBAR1	20	46
COC(=O)c1cccc(N2CCC[C@H](C(=O)NC(C)C)C2)n1	ZINC000853963279	DD	On-Demand	Anodyne	ALK	16	42
COC(=O)c1cccc(N2CCC[C@H](C(=O)NC(C)C)C2)n1	ZINC000853963279	DD	On-Demand	Anodyne	GPBAR1	20	46
C#CCNC(=O)c1ccc(N2CCC[C@H](C(=O)NC(C)C)C2)nc1	ZINC000853963293	ED	On-Demand	Mild	GPBAR1	21	40
C#CCNC(=O)c1ccc(N2CCC[C@H](C(=O)NC(C)C)C2)nc1	ZINC000853963293	ED	On-Demand	Mild	HPGDS	15	43
C#CCNC(=O)c1ccc(N2CCC[C@@H](C(=O)NC(C)C)C2)nc1	ZINC000853963294	ED	On-Demand	Mild	GPBAR1	21	40
C#CCNC(=O)c1ccc(N2CCC[C@@H](C(=O)NC(C)C)C2)nc1	ZINC000853963294	ED	On-Demand	Mild	HPGDS	15	43
O=C(NOC1CCCC1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853963341	EC	On-Demand	Anodyne	TGM2	42	41
O=C(NOC1CCCC1)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853963341	EC	On-Demand	Anodyne	F13A1	45	41
CON(C)CCNC(=O)NCCOCc1ccc(Cl)cc1Cl	ZINC000853963390	FE	On-Demand	Anodyne	ALPL	34	41
O=C(COC(=O)CCCn1c(=O)oc2ccccc21)Nc1ccc(N2CCCCC2)nc1	ZINC000853963436	IF	On-Demand	Anodyne	DGAT1	37	40
C#Cc1cnc(N2CCC[C@@H](C(=O)NC(C)C)C2)nc1	ZINC000853963437	CD	On-Demand	Mild	GPBAR1	20	44
C#Cc1cnc(N2CCC[C@H](C(=O)NC(C)C)C2)nc1	ZINC000853963438	CD	On-Demand	Mild	GPBAR1	20	44
Cc1cc(N2CCC[C@H](C(=O)NC(C)C)C2)nc(N)n1	ZINC000853963454	CD	On-Demand	Anodyne	HRH4	51	41
Cc1cc(N2CCC[C@H](C(=O)NC(C)C)C2)nc(N)n1	ZINC000853963454	CD	On-Demand	Anodyne	GPBAR1	21	43
Cn1cccc1CNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853963477	ED	On-Demand	Anodyne	CARM1	55	35
C#Cc1cnc(N2CC[C@@H](N3CCOCC3)C2)nc1	ZINC000853963482	CC	On-Demand	Mild	L3MBTL3	19	40
C#Cc1cnc(N2CC[C@H](N3CCOCC3)C2)nc1	ZINC000853963483	CC	On-Demand	Mild	L3MBTL3	19	40
O=C(NC[C@@H]1COC2(CCCCCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853963488	FF	On-Demand	Anodyne	CPT1A	68	35
O=C(NC[C@H]1COC2(CCCCCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853963489	FF	On-Demand	Anodyne	CPT1A	68	35
O=C(NC[C@@H]1COC2(CCCCCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853963490	FF	On-Demand	Anodyne	CPT1A	68	35
O=C(NC[C@H]1COC2(CCCCCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853963491	FF	On-Demand	Anodyne	CPT1A	68	35
CCOC(=O)C12CC(CN1c1ccnc(C(C)C)n1)C2	ZINC000853963684	CE	On-Demand	Anodyne	SORD	91	36
C[Si](C)(C)c1ccc(CNC(=O)N[C@H]2CCCOCC2)cc1	ZINC000853963869	DF	On-Demand	Anodyne	EPHX2	17	44
C[Si](C)(C)c1ccc(CNC(=O)N[C@@H]2CCCOCC2)cc1	ZINC000853963870	DF	On-Demand	Anodyne	EPHX2	17	44
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1S(C)(=O)=O)C2	ZINC000853963927	FD	On-Demand	Bother	CACNA1D	44	34
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1F)C2	ZINC000853963950	CE	On-Demand	Bother	CACNA1C	49	37
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1F)C2	ZINC000853963950	CE	On-Demand	Bother	CACNA1D	72	36
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1F)C2	ZINC000853963950	CE	On-Demand	Bother	SLC27A4	46	34
C[C@H](O)c1ccc(CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)cc1	ZINC000853963992	FD	On-Demand	Anodyne	TRPV1	44	33
C[C@H](O)c1ccc(CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)cc1	ZINC000853963992	FD	On-Demand	Anodyne	CARM1	75	40
COC(=O)c1cccc(N2[C@H]3CC[C@H]2CC(C)C3)n1	ZINC000853964009	CF	On-Demand	Anodyne	GLRA1	42	31
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1)C2	ZINC000853964086	CE	On-Demand	Bother	CACNA1D	46	36
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1)C2	ZINC000853964086	CE	On-Demand	Bother	SLC27A4	55	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@](C)(O)c1ccccc1	ZINC000853964194	FD	On-Demand	Anodyne	CARM1	46	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@](C)(O)c1ccccc1	ZINC000853964195	FD	On-Demand	Anodyne	CARM1	46	37
Cc1ccccc1[C@H](O)CNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853964215	FD	On-Demand	Anodyne	CARM1	61	37
Cc1ccccc1[C@@H](O)CNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853964216	FD	On-Demand	Anodyne	CARM1	61	37
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H]1CCCOCC1	ZINC000853964220	EF	On-Demand	Anodyne	MAPK1	49	38
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H]1CCCOCC1	ZINC000853964220	EF	On-Demand	Anodyne	EPHX2	15	40
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@H]1CCCOCC1	ZINC000853964221	EF	On-Demand	Anodyne	MAPK1	49	38
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@H]1CCCOCC1	ZINC000853964221	EF	On-Demand	Anodyne	EPHX2	15	40
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H]1CCCOCC1	ZINC000853964222	EF	On-Demand	Anodyne	MAPK1	49	38
O=C(NC[C@H](O)c1ccc(Cl)c(Cl)c1)N[C@@H]1CCCOCC1	ZINC000853964222	EF	On-Demand	Anodyne	EPHX2	15	40
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@H]1CCCOCC1	ZINC000853964223	EF	On-Demand	Anodyne	MAPK1	49	38
O=C(NC[C@@H](O)c1ccc(Cl)c(Cl)c1)N[C@H]1CCCOCC1	ZINC000853964223	EF	On-Demand	Anodyne	EPHX2	15	40
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@H]1CCCOCC1	ZINC000853964227	EG	On-Demand	Reactive	LCK	21	46
O=C(NNc1nc2ccc(Cl)cc2s1)N[C@@H]1CCCOCC1	ZINC000853964228	EG	On-Demand	Reactive	LCK	21	46
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853964237	JG	On-Demand	Anodyne	DRD4	29	46
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853964237	JG	On-Demand	Anodyne	ACHE	32	45
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853964237	JG	On-Demand	Anodyne	KCNH2	15	42
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853964237	JG	On-Demand	Anodyne	HTR4	48	42
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853964237	JG	On-Demand	Anodyne	SIGMAR1	42	51
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853964237	JG	On-Demand	Anodyne	SSTR5	50	35
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000853964237	JG	On-Demand	Anodyne	MCHR1	41	42
COc1cccc([C@H](O)CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)c1	ZINC000853964240	GD	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@H](O)CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)c1	ZINC000853964240	GD	On-Demand	Anodyne	CARM1	59	40
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853964243	JE	On-Demand	Anodyne	HTR1A	15	52
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N1CCN(c2ccccc2O)CC1	ZINC000853964243	JE	On-Demand	Anodyne	HTR7	23	52
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCC1Cc2ccccc2C1	ZINC000853964265	FD	On-Demand	Anodyne	CARM1	42	34
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853964383	IG	On-Demand	Anodyne	SSTR2	47	36
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853964383	IG	On-Demand	Anodyne	CCKAR	41	42
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853964383	IG	On-Demand	Anodyne	NMBR	22	44
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)NCCc1c[nH]c2ccccc12	ZINC000853964383	IG	On-Demand	Anodyne	GRPR	51	31
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853964610	JF	On-Demand	Anodyne	DRD4	30	44
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853964610	JF	On-Demand	Anodyne	ACHE	26	41
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853964610	JF	On-Demand	Anodyne	HTR4	39	40
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853964610	JF	On-Demand	Anodyne	SIGMAR1	35	49
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853964610	JF	On-Demand	Anodyne	MCHR1	28	40
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853964610	JF	On-Demand	Anodyne	BIRC2	33	40
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853964611	JF	On-Demand	Anodyne	DRD4	30	44
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853964611	JF	On-Demand	Anodyne	ACHE	26	41
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853964611	JF	On-Demand	Anodyne	HTR4	39	40
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853964611	JF	On-Demand	Anodyne	SIGMAR1	35	49
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853964611	JF	On-Demand	Anodyne	MCHR1	28	40
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853964611	JF	On-Demand	Anodyne	BIRC2	33	40
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000853964619	IG	On-Demand	Mild	VIPR1	28	43
CC1C[C@@H]2CC[C@H](C1)N2c1nccc(N2CCCC2)n1	ZINC000853964634	CF	On-Demand	Anodyne	SORD	90	37
CCOC(=O)C12CC(CN1c1nc3ccc([N+](=O)[O-])cc3s1)C2	ZINC000853964677	EF	On-Demand	Bother	CACNA1D	46	33
O=C(NC[C@@H]1COC2(CCOCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853964685	FC	On-Demand	Anodyne	CPT1A	56	35
O=C(NC[C@@H]1COC2(CCOCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853964686	FC	On-Demand	Anodyne	CPT1A	56	35
O=C(NC[C@H]1COC2(CCOCC2)O1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853964687	FC	On-Demand	Anodyne	CPT1A	56	35
O=C(NC[C@H]1COC2(CCOCC2)O1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853964688	FC	On-Demand	Anodyne	CPT1A	56	35
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000853964741	DE	On-Demand	Bother	CACNA1C	47	36
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2	ZINC000853964741	DE	On-Demand	Bother	CACNA1D	68	36
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1C#N)C2	ZINC000853964746	DD	On-Demand	Mild	CACNA1D	52	38
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1ccccc1Cl	ZINC000853964747	GD	On-Demand	Anodyne	CARM1	56	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1ccccc1Cl	ZINC000853964748	GD	On-Demand	Anodyne	CARM1	56	37
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1Cl)C2	ZINC000853964757	DF	On-Demand	Bother	CACNA1C	40	36
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1Cl)C2	ZINC000853964757	DF	On-Demand	Bother	CACNA1D	58	36
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853964798	FH	On-Demand	Anodyne	KCNQ2	71	40
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853964798	FH	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853964798	FH	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853964799	FH	On-Demand	Anodyne	KCNQ2	71	40
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853964799	FH	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853964799	FH	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853964800	FH	On-Demand	Anodyne	KCNQ2	71	40
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853964800	FH	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853964800	FH	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853964801	FH	On-Demand	Anodyne	KCNQ2	71	40
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853964801	FH	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853964801	FH	On-Demand	Anodyne	SCN10A	15	43
C#CCNC(=O)c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)nc1	ZINC000853964816	EC	On-Demand	Mild	HPGDS	16	42
C#CCNC(=O)c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)nc1	ZINC000853964817	EC	On-Demand	Mild	HPGDS	16	42
COCc1cc([N+](=O)[O-])ccc1N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853964824	ED	On-Demand	Bother	CACNA1D	55	34
COCc1cc([N+](=O)[O-])ccc1N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853964825	ED	On-Demand	Bother	CACNA1D	55	34
C[C@@H]1CN(C)C[C@H](C(=O)NNC(=O)NCc2ccccc2N2CCCCC2)O1	ZINC000853964838	GD	On-Demand	Reactive	KCNQ2	62	38
C[C@@H]1CN(C)C[C@@H](C(=O)NNC(=O)NCc2ccccc2N2CCCCC2)O1	ZINC000853964840	GD	On-Demand	Reactive	KCNQ2	62	38
O=C(NCC(=O)N1CCOCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853964874	FD	On-Demand	Reactive	CASR	21	50
O=C(NCC(=O)N1CCOCC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853964874	FD	On-Demand	Reactive	CSNK1D	30	41
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853964890	IH	On-Demand	Anodyne	KCNQ2	16	43
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1Br)C2	ZINC000853965006	FF	On-Demand	Bother	CACNA1C	44	36
CCOC(=O)C12CC(CN1c1ccc([N+](=O)[O-])cc1Br)C2	ZINC000853965006	FF	On-Demand	Bother	CACNA1D	65	36
O=C(NCc1ccccc1N1CCCCC1)N1CCC(N2CCOC2=O)CC1	ZINC000853965056	GF	On-Demand	Anodyne	KCNQ2	48	37
O[C@@H]1CCN(C2CCN(c3ccnc(Cl)c3)CC2)C1	ZINC000853965082	CD	On-Demand	Anodyne	L3MBTL3	32	40
O[C@H]1CCN(C2CCN(c3ccnc(Cl)c3)CC2)C1	ZINC000853965083	CD	On-Demand	Anodyne	L3MBTL3	32	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@@H](O)c1c(F)cccc1F	ZINC000853965101	GD	On-Demand	Anodyne	CARM1	62	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[C@H](O)c1c(F)cccc1F	ZINC000853965109	GD	On-Demand	Anodyne	CARM1	62	37
O=S(=O)(c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)cc1)C(F)(F)F	ZINC000853965132	GE	On-Demand	Anodyne	L3MBTL3	35	43
O=S(=O)(c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)cc1)C(F)(F)F	ZINC000853965133	GE	On-Demand	Anodyne	L3MBTL3	35	43
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853965139	FE	On-Demand	Anodyne	KCNQ2	43	36
O=C(NCc1ccccc1N1CCCCC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853965140	FE	On-Demand	Anodyne	KCNQ2	43	36
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853965143	GE	On-Demand	Anodyne	ACE	18	45
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853965143	GE	On-Demand	Anodyne	PYGL	31	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853965143	GE	On-Demand	Anodyne	PYGM	28	44
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853965144	GE	On-Demand	Anodyne	ACE	18	45
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853965144	GE	On-Demand	Anodyne	PYGL	31	44
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853965144	GE	On-Demand	Anodyne	PYGM	28	44
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853965145	GE	On-Demand	Anodyne	ACE	18	45
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853965145	GE	On-Demand	Anodyne	PYGL	31	44
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1Cc2ccccc2N(C)C1=O	ZINC000853965145	GE	On-Demand	Anodyne	PYGM	28	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853965146	GE	On-Demand	Anodyne	ACE	18	45
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853965146	GE	On-Demand	Anodyne	PYGL	31	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1Cc2ccccc2N(C)C1=O	ZINC000853965146	GE	On-Demand	Anodyne	PYGM	28	44
O=C(NCc1ccccc1N1CCCCC1)NNC(=O)c1cccc(F)n1	ZINC000853965153	FE	On-Demand	Reactive	KCNQ2	66	38
O=C(NCc1ccccc1N1CCCCC1)NNC(=O)c1cccc(F)n1	ZINC000853965153	FE	On-Demand	Reactive	SCN2A	19	45
O=C(NCc1ccccc1N1CCCCC1)NNC(=O)c1cccc(F)n1	ZINC000853965153	FE	On-Demand	Reactive	SCN10A	15	45
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)c2nonc12	ZINC000853965154	ED	On-Demand	Bother	GSTM2	107	39
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)c2nonc12	ZINC000853965154	ED	On-Demand	Bother	GSTP1	64	39
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)c2nonc12	ZINC000853965155	ED	On-Demand	Bother	GSTM2	107	39
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)c2nonc12	ZINC000853965155	ED	On-Demand	Bother	GSTP1	64	39
CON(C)CCNC(=O)N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	ZINC000853965167	FE	On-Demand	Anodyne	UTS2R	23	41
CON(C)CCNC(=O)N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1	ZINC000853965168	FE	On-Demand	Anodyne	UTS2R	23	41
CC1C[C@@H]2CC[C@H](C1)N2c1ccnc(C(C)C)n1	ZINC000853965182	BG	On-Demand	Anodyne	SORD	111	47
CC1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c2nonc12	ZINC000853965244	CF	On-Demand	Bother	GSTM2	111	44
CC1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c2nonc12	ZINC000853965244	CF	On-Demand	Bother	GSTP1	67	44
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@H]1CCCOCC1	ZINC000853965258	EE	On-Demand	Clean	EPHX2	17	49
O=C(NCc1ccc(N2CCC(O)CC2)cc1)N[C@@H]1CCCOCC1	ZINC000853965259	EE	On-Demand	Clean	EPHX2	17	49
COCc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[C@](C)(CO)C1	ZINC000853965261	CE	On-Demand	Bother	CACNA1C	47	35
COCc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[C@](C)(CO)C1	ZINC000853965261	CE	On-Demand	Bother	CACNA1D	75	35
COCc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[C@@](C)(CO)C1	ZINC000853965262	CE	On-Demand	Bother	CACNA1C	47	35
COCc1cc([N+](=O)[O-])ccc1N1C[C@@H](C)[C@@](C)(CO)C1	ZINC000853965262	CE	On-Demand	Bother	CACNA1D	75	35
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)[C@](C)(CO)C1	ZINC000853965263	CE	On-Demand	Bother	CACNA1C	47	35
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)[C@](C)(CO)C1	ZINC000853965263	CE	On-Demand	Bother	CACNA1D	75	35
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)[C@@](C)(CO)C1	ZINC000853965264	CE	On-Demand	Bother	CACNA1C	47	35
COCc1cc([N+](=O)[O-])ccc1N1C[C@H](C)[C@@](C)(CO)C1	ZINC000853965264	CE	On-Demand	Bother	CACNA1D	75	35
COc1cc(N2CCC(N3CC[C@@H](O)C3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853965273	FD	On-Demand	Clean	CCR4	27	40
COc1cc(N2CCC(N3CC[C@H](O)C3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853965274	FD	On-Demand	Clean	CCR4	27	40
Cn1c(S)nnc1CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853965275	FE	On-Demand	Anodyne	KCNQ2	62	37
Cn1c(S)nnc1CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853965275	FE	On-Demand	Anodyne	SCN2A	17	41
C#C[C@H](NC(=O)NCc1ccccc1N1CCCCC1)C1CCOCC1	ZINC000853965288	FF	On-Demand	Mild	KCNQ2	70	37
C#C[C@@H](NC(=O)NCc1ccccc1N1CCCCC1)C1CCOCC1	ZINC000853965289	FF	On-Demand	Mild	KCNQ2	70	37
CCOC(=O)C12CC(CN1c1nn3cc(-c4ccccc4)nc3s1)C2	ZINC000853965405	FF	On-Demand	Anodyne	P2RY12	68	34
C#CCCN(CCOC)C(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000853965415	EH	On-Demand	Mild	AMY2	44	30
C#CCCN(CCOC)C(=O)N[C@H](CC1CCC1)c1ccccc1	ZINC000853965417	EH	On-Demand	Mild	AMY2	44	30
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC(c2ccc(F)cc2)CC1	ZINC000853965445	GF	On-Demand	Anodyne	CCR2	16	42
C[C@@H](OC(=O)CCCn1c(=O)oc2ccccc21)C(=O)N1CCN(c2ccc(F)cc2)CC1	ZINC000853965538	JF	On-Demand	Anodyne	HTR7	24	52
COc1ccc(O)c(CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)c1	ZINC000853965582	FD	On-Demand	Clean	CARM1	47	36
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1COC2(CCC2)C1	ZINC000853965595	EG	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1COC2(CCC2)C1	ZINC000853965595	EG	On-Demand	Anodyne	SCN2A	17	41
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1COC2(CCC2)C1	ZINC000853965596	EG	On-Demand	Anodyne	KCNQ2	63	38
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1COC2(CCC2)C1	ZINC000853965596	EG	On-Demand	Anodyne	SCN2A	17	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCC[C@@H](O)c1ccccc1	ZINC000853965598	FD	On-Demand	Anodyne	CARM1	49	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCC[C@H](O)c1ccccc1	ZINC000853965600	FD	On-Demand	Anodyne	CARM1	49	37
C#CCCN(CCOC)C(=O)NCc1ccccc1N1CCCCC1	ZINC000853965631	EF	On-Demand	Mild	KCNQ2	65	37
C#CCCN(CCOC)C(=O)NCc1ccccc1N1CCCCC1	ZINC000853965631	EF	On-Demand	Mild	SCN2A	18	42
O=C(NCCC1SCCS1)NCc1ccccc1N1CCCCC1	ZINC000853965650	FH	On-Demand	Anodyne	KCNQ2	69	40
O=C(NCCC1SCCS1)NCc1ccccc1N1CCCCC1	ZINC000853965650	FH	On-Demand	Anodyne	SCN2A	18	43
O=C(NCCC1SCCS1)NCc1ccccc1N1CCCCC1	ZINC000853965650	FH	On-Demand	Anodyne	SCN10A	15	43
COCCN(CCF)C(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000853965656	DH	On-Demand	Anodyne	AMY2	46	31
COCCN(CCF)C(=O)N[C@@H](CC1CCC1)c1ccccc1	ZINC000853965656	DH	On-Demand	Anodyne	REN	23	41
COC(=O)c1sc(N2CCC(N3CC[C@H](O)C3)CC2)nc1Cl	ZINC000853965663	ED	On-Demand	Anodyne	PARE	80	35
COC(=O)c1sc(N2CCC(N3CC[C@@H](O)C3)CC2)nc1Cl	ZINC000853965665	ED	On-Demand	Anodyne	PARE	80	35
O=C(NCc1ccccc1N1CCCCC1)NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853965679	GG	On-Demand	Anodyne	KCNQ2	64	38
O=C(NCc1ccccc1N1CCCCC1)NC[C@]12OCCC[C@H]1C2(F)F	ZINC000853965679	GG	On-Demand	Anodyne	SCN2A	17	41
CCCn1cc(NC(=O)C(=O)Nc2ccn(CC(=O)OC(C)(C)C)n2)cn1	ZINC000853965695	GD	On-Demand	Anodyne	PANC	44	32
C#CCN(CC(=O)OC(C)(C)C)C(=O)NCc1ccccc1N1CCCCC1	ZINC000853965712	GG	On-Demand	Mild	KCNQ2	63	37
O=C1CCC2=C(CCN(C(=O)NCc3ccccc3N3CCCCC3)C2)N1	ZINC000853965714	FF	On-Demand	Anodyne	KCNQ2	59	39
O=C1CCC2=C(CCN(C(=O)NCc3ccccc3N3CCCCC3)C2)N1	ZINC000853965714	FF	On-Demand	Anodyne	SCN2A	18	42
O=C(NCC[S@@](=O)CC(F)(F)F)NCc1ccccc1N1CCCCC1	ZINC000853965747	GF	On-Demand	Anodyne	KCNQ2	67	38
O=C(NCC[S@@](=O)CC(F)(F)F)NCc1ccccc1N1CCCCC1	ZINC000853965747	GF	On-Demand	Anodyne	SCN2A	17	41
O=C(NCC[S@](=O)CC(F)(F)F)NCc1ccccc1N1CCCCC1	ZINC000853965780	GF	On-Demand	Anodyne	KCNQ2	67	38
O=C(NCC[S@](=O)CC(F)(F)F)NCc1ccccc1N1CCCCC1	ZINC000853965780	GF	On-Demand	Anodyne	SCN2A	17	41
O[C@H]1CCN(C2CCN(c3nccc(N4CCCC4)n3)CC2)C1	ZINC000853965809	DD	On-Demand	Anodyne	SORD	51	38
O[C@@H]1CCN(C2CCN(c3nccc(N4CCCC4)n3)CC2)C1	ZINC000853965810	DD	On-Demand	Anodyne	SORD	51	38
O[C@@H]1CCN(C2CCN(c3nc(-c4ccncc4)nc4ccccc34)CC2)C1	ZINC000853965825	GF	On-Demand	Anodyne	METAP1	15	41
O[C@H]1CCN(C2CCN(c3nc(-c4ccncc4)nc4ccccc34)CC2)C1	ZINC000853965826	GF	On-Demand	Anodyne	METAP1	15	41
O=C(NC[C@@H]1COC2(CCOCC2)O1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853965895	FD	On-Demand	Anodyne	EPHX2	17	42
O=C(NC[C@H]1COC2(CCOCC2)O1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853965896	FD	On-Demand	Anodyne	EPHX2	17	42
O[C@@H]1CCN(C2CCN(c3nc(-c4cccnc4)nc4ccccc34)CC2)C1	ZINC000853965904	GF	On-Demand	Anodyne	PIK3CA	15	44
O[C@@H]1CCN(C2CCN(c3nc(-c4cccnc4)nc4ccccc34)CC2)C1	ZINC000853965904	GF	On-Demand	Anodyne	MTOR	21	44
O[C@H]1CCN(C2CCN(c3nc(-c4cccnc4)nc4ccccc34)CC2)C1	ZINC000853965908	GF	On-Demand	Anodyne	PIK3CA	15	44
O[C@H]1CCN(C2CCN(c3nc(-c4cccnc4)nc4ccccc34)CC2)C1	ZINC000853965908	GF	On-Demand	Anodyne	MTOR	21	44
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC(c2cccc(F)c2)CC1	ZINC000853965995	GF	On-Demand	Anodyne	CCR5	41	32
CCCCCCCCNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853966001	EF	On-Demand	Mild	EST1_PIG	49	29
CCCCCCCCNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853966001	EF	On-Demand	Mild	ASAH1	95	39
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966019	FF	On-Demand	Mild	PAPA1_CARPA	36	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966019	FF	On-Demand	Mild	CTSG	22	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966019	FF	On-Demand	Mild	CTRB1	21	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966019	FF	On-Demand	Mild	CELA2A	19	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966019	FF	On-Demand	Mild	CTRB_BOVIN	62	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966021	FF	On-Demand	Mild	PAPA1_CARPA	36	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966021	FF	On-Demand	Mild	CTSG	22	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966021	FF	On-Demand	Mild	CTRB1	21	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966021	FF	On-Demand	Mild	CELA2A	19	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccc(C#N)cc1	ZINC000853966021	FF	On-Demand	Mild	CTRB_BOVIN	62	43
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)C1	ZINC000853966039	GH	On-Demand	Anodyne	REN	19	41
Cn1c(S)nnc1[C@@H]1CCCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)C1	ZINC000853966042	GH	On-Demand	Anodyne	REN	19	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@@H](CC2CCC2)c2ccccc2)C1	ZINC000853966044	GH	On-Demand	Anodyne	REN	19	41
Cn1c(S)nnc1[C@H]1CCCN(C(=O)N[C@H](CC2CCC2)c2ccccc2)C1	ZINC000853966046	GH	On-Demand	Anodyne	REN	19	41
COc1ccc2c(N3CCC(N4CC[C@H](O)C4)CC3)ccnc2c1	ZINC000853966051	EE	On-Demand	Anodyne	CCR4	31	43
COc1ccc2c(N3CCC(N4CC[C@H](O)C4)CC3)ccnc2c1	ZINC000853966051	EE	On-Demand	Anodyne	PDE3B	43	38
COc1ccc2c(N3CCC(N4CC[C@@H](O)C4)CC3)ccnc2c1	ZINC000853966054	EE	On-Demand	Anodyne	CCR4	31	43
COc1ccc2c(N3CCC(N4CC[C@@H](O)C4)CC3)ccnc2c1	ZINC000853966054	EE	On-Demand	Anodyne	PDE3B	43	38
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)c(Cl)c1	ZINC000853966056	EE	On-Demand	Bother	WDR5	33	41
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)c(Cl)c1	ZINC000853966058	EE	On-Demand	Bother	WDR5	33	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccc(N2CC=CC2)cc1	ZINC000853966084	GE	On-Demand	Clean	CARM1	73	40
CC(=O)c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000853966109	ED	On-Demand	Bother	L3MBTL3	38	43
CC(=O)c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)c([N+](=O)[O-])c1	ZINC000853966110	ED	On-Demand	Bother	L3MBTL3	38	43
O=S(=O)(c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)cc1)C(F)F	ZINC000853966184	FD	On-Demand	Anodyne	L3MBTL3	33	42
O=S(=O)(c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)cc1)C(F)F	ZINC000853966185	FD	On-Demand	Anodyne	L3MBTL3	33	42
NC(=O)c1cc(N2CCC(N3CC[C@@H](O)C3)CC2)ccn1	ZINC000853966187	CC	On-Demand	Anodyne	L3MBTL3	47	38
NC(=O)c1cc(N2CCC(N3CC[C@H](O)C3)CC2)ccn1	ZINC000853966188	CC	On-Demand	Anodyne	L3MBTL3	47	38
COC(=O)N(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853966232	EE	On-Demand	Anodyne	AVPR2	19	40
COC(=O)N(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853966232	EE	On-Demand	Anodyne	KCNQ2	72	39
COC(=O)N(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853966232	EE	On-Demand	Anodyne	SCN2A	17	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	MME	51	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CTSD	18	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	PGC	31	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CTSB	37	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	PAPA1_CARPA	67	46
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CCKAR	42	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CTSK	25	47
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CTSL	24	46
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	PGA	24	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	TACR3	20	45
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CAPNS1	52	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	REN	54	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	NPY5R	20	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CAPN1	35	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	FPR1	66	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	CTRB_BOVIN	55	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966286	GF	On-Demand	Anodyne	NPR	51	34
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	MME	51	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CTSD	18	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	PGC	31	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CTSB	37	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	PAPA1_CARPA	67	46
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CCKAR	42	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CTSK	25	47
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CTSL	24	46
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	PGA	24	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	TACR3	20	45
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CAPNS1	52	34
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	REN	54	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	NPY5R	20	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CAPN1	35	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	FPR1	66	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	CTRB_BOVIN	55	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853966287	GF	On-Demand	Anodyne	NPR	51	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	MME	51	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CTSD	18	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	PGC	31	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CTSB	37	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	PAPA1_CARPA	67	46
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CCKAR	42	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CTSK	25	47
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CTSL	24	46
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	PGA	24	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	TACR3	20	45
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CAPNS1	52	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	REN	54	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	NPY5R	20	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CAPN1	35	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	FPR1	66	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	CTRB_BOVIN	55	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966288	GF	On-Demand	Anodyne	NPR	51	34
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	MME	51	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CTSD	18	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	PGC	31	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CTSB	37	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	PAPA1_CARPA	67	46
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CCKAR	42	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CTSK	25	47
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CTSL	24	46
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	PGA	24	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	TACR3	20	45
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CAPNS1	52	34
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	REN	54	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	NPY5R	20	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CAPN1	35	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	FPR1	66	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	CTRB_BOVIN	55	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853966289	GF	On-Demand	Anodyne	NPR	51	34
Cc1nc(N2CCC(N3CC[C@@H](O)C3)CC2)c2cnn(-c3ccccc3)c2n1	ZINC000853966304	GE	On-Demand	Anodyne	MTOR	15	42
Cc1nc(N2CCC(N3CC[C@H](O)C3)CC2)c2cnn(-c3ccccc3)c2n1	ZINC000853966307	GE	On-Demand	Anodyne	MTOR	15	42
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccc(C(C)(C)O)cc1	ZINC000853966308	GD	On-Demand	Anodyne	CARM1	59	37
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853966321	GC	On-Demand	Anodyne	L3MBTL3	44	36
NS(=O)(=O)c1cc(C(=O)C2CC2)ccc1N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853966323	GC	On-Demand	Anodyne	L3MBTL3	44	36
O=C(NCc1ncccn1)NCc1ccccc1N1CCCCC1	ZINC000853966325	EE	On-Demand	Anodyne	KCNQ2	77	44
O=C(NCc1ncccn1)NCc1ccccc1N1CCCCC1	ZINC000853966325	EE	On-Demand	Anodyne	SCN2A	22	49
O=C(NCc1ncccn1)NCc1ccccc1N1CCCCC1	ZINC000853966325	EE	On-Demand	Anodyne	SCN10A	25	49
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853966372	FG	On-Demand	Mild	CTRB_BOVIN	44	32
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCC(O)(c2ccccc2)CC1	ZINC000853966373	GD	On-Demand	Anodyne	OPRL1	17	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853966374	FG	On-Demand	Mild	CTRB_BOVIN	44	32
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000853966401	DD	On-Demand	Anodyne	NQO2	18	46
CC[C@@H](O)CNC(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000853966401	DD	On-Demand	Anodyne	MTNR1A	18	48
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	ADORA1	121	53
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	SLC29A1	130	52
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	ADORA2A	42	53
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	ADK	37	53
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	AHCY	52	40
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	P2RX4	33	40
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	P2RX1	44	38
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	P2RY1	27	41
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	ADORA3	90	53
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	OXGR1	109	36
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	DNMT3B	54	36
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	Q4VQ11_PIG	70	48
OC[C@H]1O[C@@H](n2cnc3c(Oc4cnc(Cl)c(F)c4)ncnc32)[C@H](O)[C@@H]1O	ZINC000853966438	GC	On-Demand	Anodyne	DOT1L	74	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CCc1ccccc1	ZINC000853966471	GD	On-Demand	Reactive	CARM1	43	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCC(=O)OCc1ccccc1	ZINC000853966483	GD	On-Demand	Anodyne	CAPN2	42	32
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCC(=O)OCc1ccccc1	ZINC000853966483	GD	On-Demand	Anodyne	CARM1	72	47
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C=CCC1	ZINC000853966495	CG	On-Demand	Anodyne	KCNQ2	68	40
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C=CCC1	ZINC000853966495	CG	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C=CCC1	ZINC000853966495	CG	On-Demand	Anodyne	EPHX2	16	42
O=C(NCc1ccccc1N1CCCCC1)N[C@H]1C=CCC1	ZINC000853966495	CG	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C=CCC1	ZINC000853966496	CG	On-Demand	Anodyne	KCNQ2	68	40
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C=CCC1	ZINC000853966496	CG	On-Demand	Anodyne	SCN2A	18	43
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C=CCC1	ZINC000853966496	CG	On-Demand	Anodyne	EPHX2	16	42
O=C(NCc1ccccc1N1CCCCC1)N[C@@H]1C=CCC1	ZINC000853966496	CG	On-Demand	Anodyne	SCN10A	15	43
O=C(NCc1ccccc1N1CCCCC1)NCC1SCCS1	ZINC000853966518	FG	On-Demand	Anodyne	KCNQ2	74	42
O=C(NCc1ccccc1N1CCCCC1)NCC1SCCS1	ZINC000853966518	FG	On-Demand	Anodyne	SCN2A	19	44
O=C(NCc1ccccc1N1CCCCC1)NCC1SCCS1	ZINC000853966518	FG	On-Demand	Anodyne	SCN10A	15	44
COc1ccc2c(NC[C@H]3CCOC3(C)C)ccnc2c1	ZINC000853966533	CG	On-Demand	Anodyne	HRP1_PLAFA	89	40
COc1ccc2c(NC[C@H]3CCOC3(C)C)ccnc2c1	ZINC000853966533	CG	On-Demand	Anodyne	HNMT	57	33
COc1ccc2c(NC[C@@H]3CCOC3(C)C)ccnc2c1	ZINC000853966535	CG	On-Demand	Anodyne	HRP1_PLAFA	89	40
COc1ccc2c(NC[C@@H]3CCOC3(C)C)ccnc2c1	ZINC000853966535	CG	On-Demand	Anodyne	HNMT	57	33
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966576	GF	On-Demand	Anodyne	SCN2A	17	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966576	GF	On-Demand	Anodyne	REN	44	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966576	GF	On-Demand	Anodyne	SCN10A	31	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966576	GF	On-Demand	Anodyne	FPR1	44	36
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966577	GF	On-Demand	Anodyne	SCN2A	17	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966577	GF	On-Demand	Anodyne	REN	44	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966577	GF	On-Demand	Anodyne	SCN10A	31	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1cccnc1N1CCCC1	ZINC000853966577	GF	On-Demand	Anodyne	FPR1	44	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)CCCc1ccccc1	ZINC000853966615	GD	On-Demand	Reactive	CARM1	40	39
Nc1nc(Cl)cc(N2CCC(N3CC[C@H](O)C3)CC2)n1	ZINC000853966719	CC	On-Demand	Anodyne	HRH4	44	37
Nc1nc(Cl)cc(N2CCC(N3CC[C@@H](O)C3)CC2)n1	ZINC000853966721	CC	On-Demand	Anodyne	HRH4	44	37
COCCN(CCF)C(=O)NCc1ccccc1N1CCCCC1	ZINC000853966735	EF	On-Demand	Anodyne	KCNQ2	71	38
COCCN(CCF)C(=O)NCc1ccccc1N1CCCCC1	ZINC000853966735	EF	On-Demand	Anodyne	SCN2A	18	43
COCCN(CCF)C(=O)NCc1ccccc1N1CCCCC1	ZINC000853966735	EF	On-Demand	Anodyne	SCN10A	15	43
CC[C@H](C)N(CC)C(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000853966766	DG	On-Demand	Anodyne	CTSK	15	41
CC[C@H](C)N(CC)C(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000853966770	DG	On-Demand	Anodyne	CTSK	15	41
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000853966785	DF	On-Demand	Anodyne	SLC12A5	43	37
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000853966785	DF	On-Demand	Anodyne	HCN1	50	31
CON(C)CCNC(=O)NCC1(Cc2ccccc2)CCCC1	ZINC000853966785	DF	On-Demand	Anodyne	HCN4	48	31
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1ccncc1	ZINC000853966807	ED	On-Demand	Anodyne	CARM1	48	35
COC(=O)c1cccc(N2CCC(N3CC[C@@H](O)C3)CC2)n1	ZINC000853966818	DC	On-Demand	Anodyne	HSD11B1	16	43
COC(=O)c1cccc(N2CCC(N3CC[C@H](O)C3)CC2)n1	ZINC000853966820	DC	On-Demand	Anodyne	HSD11B1	16	43
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NNC(=O)COCc1ccccc1	ZINC000853966829	GC	On-Demand	Reactive	CARM1	63	43
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966831	ED	On-Demand	Anodyne	DRD2	17	40
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966831	ED	On-Demand	Anodyne	DRD4	42	40
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966831	ED	On-Demand	Anodyne	ACHE	38	43
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966831	ED	On-Demand	Anodyne	SIGMAR1	39	45
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966831	ED	On-Demand	Anodyne	CCR5	44	38
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966831	ED	On-Demand	Anodyne	MCHR1	25	40
CON(C)CCNC(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966831	ED	On-Demand	Anodyne	BIRC2	28	42
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966832	ED	On-Demand	Anodyne	DRD2	17	40
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966832	ED	On-Demand	Anodyne	DRD4	42	40
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966832	ED	On-Demand	Anodyne	ACHE	38	43
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966832	ED	On-Demand	Anodyne	SIGMAR1	39	45
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966832	ED	On-Demand	Anodyne	CCR5	44	38
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966832	ED	On-Demand	Anodyne	MCHR1	25	40
CON(C)CCNC(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853966832	ED	On-Demand	Anodyne	BIRC2	28	42
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966834	ED	On-Demand	Anodyne	DRD2	17	40
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966834	ED	On-Demand	Anodyne	DRD4	42	40
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966834	ED	On-Demand	Anodyne	ACHE	38	43
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966834	ED	On-Demand	Anodyne	SIGMAR1	39	45
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966834	ED	On-Demand	Anodyne	CCR5	44	38
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966834	ED	On-Demand	Anodyne	MCHR1	25	40
CON(C)CCNC(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966834	ED	On-Demand	Anodyne	BIRC2	28	42
CON(C)CCNC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966836	ED	On-Demand	Anodyne	DRD2	17	40
CON(C)CCNC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966836	ED	On-Demand	Anodyne	DRD4	42	40
CON(C)CCNC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966836	ED	On-Demand	Anodyne	ACHE	38	43
CON(C)CCNC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966836	ED	On-Demand	Anodyne	SIGMAR1	39	45
CON(C)CCNC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966836	ED	On-Demand	Anodyne	CCR5	44	38
CON(C)CCNC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966836	ED	On-Demand	Anodyne	MCHR1	25	40
CON(C)CCNC(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853966836	ED	On-Demand	Anodyne	BIRC2	28	42
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)cc1	ZINC000853966849	CD	On-Demand	Bother	SSTR1	40	38
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@H](O)C3)CC2)cc1	ZINC000853966849	CD	On-Demand	Bother	L3MBTL3	47	45
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)cc1	ZINC000853966851	CD	On-Demand	Bother	SSTR1	40	38
O=[N+]([O-])c1ccc(N2CCC(N3CC[C@@H](O)C3)CC2)cc1	ZINC000853966851	CD	On-Demand	Bother	L3MBTL3	47	45
O=C(NCCc1nnc(S)n1C1CC1)N[C@@H](CC1CCC1)c1ccccc1	ZINC000853966853	GH	On-Demand	Anodyne	CCR5	16	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)Nc1cccc(N2CCCCC2)c1	ZINC000853966857	GG	On-Demand	Anodyne	TAAR1	27	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853966904	GF	On-Demand	Anodyne	CACNA1I	40	30
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853966905	GF	On-Demand	Anodyne	CACNA1I	40	30
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853966906	GF	On-Demand	Anodyne	CACNA1I	40	30
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853966907	GF	On-Demand	Anodyne	CACNA1I	40	30
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccnc2ccccc12	ZINC000853966908	GG	On-Demand	Anodyne	MTNR1A	20	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCCc1ccnc2ccccc12	ZINC000853966909	GG	On-Demand	Anodyne	MTNR1A	20	42
CC[C@@H](O)CNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000853966910	DD	On-Demand	Anodyne	CTSK	16	41
CC[C@@H](O)CNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000853966911	DD	On-Demand	Anodyne	CTSK	16	41
O=C(NOC1CCCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853966968	FG	On-Demand	Anodyne	EPHX2	37	40
O=C(NCCc1nnc(S)n1C1CC1)N[C@H](CC1CCC1)c1ccccc1	ZINC000853966978	GH	On-Demand	Anodyne	CCR5	16	41
CON(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853966979	DD	On-Demand	Anodyne	KCNQ2	76	40
CON(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853966979	DD	On-Demand	Anodyne	SCN2A	18	43
CON(C)CCNC(=O)NCc1ccccc1N1CCCCC1	ZINC000853966979	DD	On-Demand	Anodyne	SCN10A	15	43
OC[C@H](Nc1ncc2c(n1)CCCC2)c1ccc(F)cc1F	ZINC000853967082	DF	On-Demand	Anodyne	MAPK1	48	42
OC[C@@H](Nc1ncc2c(n1)CCCC2)c1ccc(F)cc1F	ZINC000853967084	DF	On-Demand	Anodyne	MAPK1	48	42
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCNc1ccccc1	ZINC000853967152	FD	On-Demand	Anodyne	CARM1	56	38
CCN1CC[C@H](N(CC)C(=O)NCCc2c[nH]c3cccc(OC)c23)C1	ZINC000853967174	FF	On-Demand	Anodyne	MBTPS1	48	32
CCN1CC[C@@H](N(CC)C(=O)NCCc2c[nH]c3cccc(OC)c23)C1	ZINC000853967175	FF	On-Demand	Anodyne	MBTPS1	48	32
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967226	GG	On-Demand	Anodyne	FPR1	43	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967226	GG	On-Demand	Anodyne	GPR119	18	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967226	GG	On-Demand	Anodyne	SFRP1	47	34
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967226	GG	On-Demand	Anodyne	WNT3	50	31
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967227	GG	On-Demand	Anodyne	FPR1	43	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967227	GG	On-Demand	Anodyne	GPR119	18	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967227	GG	On-Demand	Anodyne	SFRP1	47	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967227	GG	On-Demand	Anodyne	WNT3	50	31
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967228	GG	On-Demand	Anodyne	FPR1	43	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967228	GG	On-Demand	Anodyne	GPR119	18	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967228	GG	On-Demand	Anodyne	SFRP1	47	34
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](N(C)c2ccccc2)C1	ZINC000853967228	GG	On-Demand	Anodyne	WNT3	50	31
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967229	GG	On-Demand	Anodyne	FPR1	43	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967229	GG	On-Demand	Anodyne	GPR119	18	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967229	GG	On-Demand	Anodyne	SFRP1	47	34
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@H](N(C)c2ccccc2)C1	ZINC000853967229	GG	On-Demand	Anodyne	WNT3	50	31
O=C(CNC(=O)NNc1cc(F)cc(Cl)c1)NCC1CC1	ZINC000853967270	DD	On-Demand	Reactive	CACNA1I	66	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCc2nccnc2C1	ZINC000853967278	ED	On-Demand	Anodyne	MAPK1	43	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CCc2nccnc2C1	ZINC000853967279	ED	On-Demand	Anodyne	MAPK1	43	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967286	GG	On-Demand	Anodyne	SSTR2	45	35
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967286	GG	On-Demand	Anodyne	CHRM3	16	45
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967286	GG	On-Demand	Anodyne	CTSK	15	44
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967286	GG	On-Demand	Anodyne	REN	46	38
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967286	GG	On-Demand	Anodyne	EPHX2	21	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967286	GG	On-Demand	Anodyne	FPR1	44	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967287	GG	On-Demand	Anodyne	SSTR2	45	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967287	GG	On-Demand	Anodyne	CHRM3	16	45
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967287	GG	On-Demand	Anodyne	CTSK	15	44
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967287	GG	On-Demand	Anodyne	REN	46	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967287	GG	On-Demand	Anodyne	EPHX2	21	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853967287	GG	On-Demand	Anodyne	FPR1	44	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H](c1ccccc1)[C@@H](C)O	ZINC000853967290	FF	On-Demand	Anodyne	CTSK	20	45
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H](c1ccccc1)[C@@H](C)O	ZINC000853967290	FF	On-Demand	Anodyne	FPR1	50	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H](c1ccccc1)[C@@H](C)O	ZINC000853967291	FF	On-Demand	Anodyne	CTSK	20	45
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H](c1ccccc1)[C@@H](C)O	ZINC000853967291	FF	On-Demand	Anodyne	FPR1	50	38
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC[C@@H](C)N(C)C	ZINC000853967294	ED	On-Demand	Anodyne	CTSK	16	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC[C@@H](C)N(C)C	ZINC000853967294	ED	On-Demand	Anodyne	CHRNA4	20	45
C[C@@H](CCNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)N(C)C	ZINC000853967295	ED	On-Demand	Anodyne	CTSK	16	40
C[C@@H](CCNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)N(C)C	ZINC000853967295	ED	On-Demand	Anodyne	CHRNA4	20	45
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC[C@@H](C)N(C)C	ZINC000853967296	ED	On-Demand	Anodyne	CTSK	16	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC[C@@H](C)N(C)C	ZINC000853967296	ED	On-Demand	Anodyne	CHRNA4	20	45
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC[C@H](C)N(C)C	ZINC000853967297	ED	On-Demand	Anodyne	CTSK	16	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC[C@H](C)N(C)C	ZINC000853967297	ED	On-Demand	Anodyne	CHRNA4	20	45
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853967299	GF	On-Demand	Reactive	DHODH	16	45
O=C(NNC(=O)C1CCCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853967299	GF	On-Demand	Reactive	EPHX2	31	40
O=C(NOC1CCCCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853967316	GH	On-Demand	Anodyne	EPHX2	35	42
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCC[C@](C)(O)c1ccccc1	ZINC000853967328	GD	On-Demand	Anodyne	CARM1	43	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCC[C@@](C)(O)c1ccccc1	ZINC000853967329	GD	On-Demand	Anodyne	CARM1	43	36
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967350	GF	On-Demand	Mild	ACHE	25	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967350	GF	On-Demand	Mild	SIGMAR1	25	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967351	GF	On-Demand	Mild	ACHE	25	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967351	GF	On-Demand	Mild	SIGMAR1	25	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967352	GF	On-Demand	Mild	ACHE	25	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967352	GF	On-Demand	Mild	SIGMAR1	25	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967353	GF	On-Demand	Mild	ACHE	25	42
C#CCN(CC(=O)OC(C)(C)C)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967353	GF	On-Demand	Mild	SIGMAR1	25	42
C#CCCN(CCOC)C(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000853967376	EE	On-Demand	Mild	NQO2	18	46
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000853967431	GF	On-Demand	Anodyne	CTSD	15	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000853967431	GF	On-Demand	Anodyne	PGC	19	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000853967431	GF	On-Demand	Anodyne	CTSK	17	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000853967431	GF	On-Demand	Anodyne	PGA	25	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000853967431	GF	On-Demand	Anodyne	SOAT1	18	47
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000853967431	GF	On-Demand	Anodyne	FPR1	45	35
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000853967433	GF	On-Demand	Anodyne	CTSD	15	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000853967433	GF	On-Demand	Anodyne	PGC	19	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000853967433	GF	On-Demand	Anodyne	CTSK	17	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000853967433	GF	On-Demand	Anodyne	PGA	25	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000853967433	GF	On-Demand	Anodyne	SOAT1	18	47
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H](O)[C@H](C)c1ccccc1	ZINC000853967433	GF	On-Demand	Anodyne	FPR1	45	35
C#CCCN(CCOC)C(=O)N[C@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1	ZINC000853967449	GF	On-Demand	Mild	DRD4	40	30
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(C2CC2)[C@@H]1c1cccc(OC)c1	ZINC000853967450	GF	On-Demand	Mild	DRD4	40	30
C#CCCN(CCOC)C(=O)N[C@@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1	ZINC000853967451	GF	On-Demand	Mild	DRD4	40	30
C#CCCN(CCOC)C(=O)N[C@H]1CCN(C2CC2)[C@H]1c1cccc(OC)c1	ZINC000853967452	GF	On-Demand	Mild	DRD4	40	30
C[Si](C)(C)c1ccc(CNC(=O)NCC(=O)NCC2CC2)cc1	ZINC000853967458	ED	On-Demand	Anodyne	TPSAB1	19	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1ccc2occc2c1	ZINC000853967488	FH	On-Demand	Anodyne	FPR1	43	33
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCc1ccc2occc2c1	ZINC000853967489	FH	On-Demand	Anodyne	FPR1	43	33
O=C(NNC(=O)C1CCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853967555	GE	On-Demand	Reactive	DHODH	17	45
C#CCCN(CCOC)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967557	FF	On-Demand	Mild	DRD4	23	41
C#CCCN(CCOC)C(=O)N[C@@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967557	FF	On-Demand	Mild	SIGMAR1	28	43
C#CCCN(CCOC)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967559	FF	On-Demand	Mild	DRD4	23	41
C#CCCN(CCOC)C(=O)N[C@@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967559	FF	On-Demand	Mild	SIGMAR1	28	43
C#CCCN(CCOC)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967562	FF	On-Demand	Mild	DRD4	23	41
C#CCCN(CCOC)C(=O)N[C@H](C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967562	FF	On-Demand	Mild	SIGMAR1	28	43
C#CCCN(CCOC)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967564	FF	On-Demand	Mild	DRD4	23	41
C#CCCN(CCOC)C(=O)N[C@H](C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967564	FF	On-Demand	Mild	SIGMAR1	28	43
CC[C@@H](C)C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853967576	EC	On-Demand	Reactive	CARM1	48	39
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000853967597	GG	On-Demand	Anodyne	CPT1A	41	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000853967597	GG	On-Demand	Anodyne	SFRP1	107	35
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCCC[C@@H]1c1ccccc1	ZINC000853967597	GG	On-Demand	Anodyne	WNT3	78	35
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000853967599	GG	On-Demand	Anodyne	CPT1A	41	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000853967599	GG	On-Demand	Anodyne	SFRP1	107	35
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CCCC[C@H]1c1ccccc1	ZINC000853967599	GG	On-Demand	Anodyne	WNT3	78	35
C=C[C@H](CO)Nc1nccc(N2CCCC2)n1	ZINC000853967600	BD	On-Demand	Mild	SORD	70	41
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3cccc(OC)c23)C1	ZINC000853967633	ED	On-Demand	Anodyne	MTNR1A	31	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCc2c[nH]c3cccc(OC)c23)C1	ZINC000853967633	ED	On-Demand	Anodyne	MTNR1B	24	47
Cn1nccc1CCNC(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853967674	GE	On-Demand	Anodyne	GCGR	24	40
CC[C@@H](C)CCNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000853967702	DG	On-Demand	Anodyne	CTSK	18	45
CC[C@@H](C)CCNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000853967705	DG	On-Demand	Anodyne	CTSK	18	45
Cc1ccccc1CC(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853967710	GD	On-Demand	Reactive	CARM1	60	38
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCCc1ccc(O)c(O)c1	ZINC000853967800	FD	On-Demand	Clean	CARM1	40	34
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C)c1ccccc1	ZINC000853967842	GD	On-Demand	Reactive	KCNQ2	44	39
CC[C@@H](C(=O)NNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C)c1ccccc1	ZINC000853967842	GD	On-Demand	Reactive	CARM1	42	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000853967859	GF	On-Demand	Anodyne	NPY2R	93	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000853967859	GF	On-Demand	Anodyne	TAAR1	25	40
CC[C@H](C)N(CC)C(=O)NCCc1c[nH]c2cccc(OC)c12	ZINC000853967889	DH	On-Demand	Anodyne	NQO2	18	45
COC[C@H](NC(=O)NCCc1c[nH]c2cccc(OC)c12)c1cccc(OC)c1	ZINC000853967900	GG	On-Demand	Anodyne	NQO2	25	42
COC[C@H](NC(=O)NCCc1c[nH]c2cccc(OC)c12)c1cccc(OC)c1	ZINC000853967900	GG	On-Demand	Anodyne	MTNR1A	68	48
COC[C@H](NC(=O)NCCc1c[nH]c2cccc(OC)c12)c1cccc(OC)c1	ZINC000853967900	GG	On-Demand	Anodyne	MTNR1B	56	43
COC[C@@H](NC(=O)NCCc1c[nH]c2cccc(OC)c12)c1cccc(OC)c1	ZINC000853967902	GG	On-Demand	Anodyne	NQO2	25	42
COC[C@@H](NC(=O)NCCc1c[nH]c2cccc(OC)c12)c1cccc(OC)c1	ZINC000853967902	GG	On-Demand	Anodyne	MTNR1A	68	48
COC[C@@H](NC(=O)NCCc1c[nH]c2cccc(OC)c12)c1cccc(OC)c1	ZINC000853967902	GG	On-Demand	Anodyne	MTNR1B	56	43
C[C@@H](NC(=O)NCCc1nnc(S)n1C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853967948	GD	On-Demand	Anodyne	SIGMAR1	23	41
C[C@@H](NC(=O)NCCc1nnc(S)n1C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000853967951	GD	On-Demand	Anodyne	SIGMAR1	23	41
CC[C@@](C)(NC(=O)NCCc1c[nH]c2cccc(OC)c12)C1CC1	ZINC000853967953	EH	On-Demand	Anodyne	MTNR1A	24	41
OC[C@H](Nc1nccc(N2CCCC2)n1)c1ccc(F)cc1F	ZINC000853968052	DF	On-Demand	Anodyne	SORD	52	37
OC[C@@H](Nc1nccc(N2CCCC2)n1)c1ccc(F)cc1F	ZINC000853968053	DF	On-Demand	Anodyne	SORD	52	37
O=C(CNC(=O)NNc1nc2ccc(Cl)cc2s1)NCC1CC1	ZINC000853968059	FE	On-Demand	Reactive	LCK	22	41
O=C(CNC(=O)NNc1nc2ccc(Cl)cc2s1)NCC1CC1	ZINC000853968059	FE	On-Demand	Reactive	CSNK1D	44	46
COc1cccc([C@H]2[C@H](NC(=O)NCCN(C)OC)CCN2C2CC2)c1	ZINC000853968084	FD	On-Demand	Anodyne	DRD4	41	31
COc1cccc([C@H]2[C@@H](NC(=O)NCCN(C)OC)CCN2C2CC2)c1	ZINC000853968086	FD	On-Demand	Anodyne	DRD4	41	31
C=C[C@H](CO)NC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000853968099	DD	On-Demand	Mild	CTSK	17	43
C=C[C@H](CO)NC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000853968100	DD	On-Demand	Mild	CTSK	17	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC/C=C\CO	ZINC000853968101	DD	On-Demand	Anodyne	CTSK	15	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC/C=C\CO	ZINC000853968102	DD	On-Demand	Anodyne	CTSK	15	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC/C=C/CO	ZINC000853968103	DD	On-Demand	Anodyne	CTSK	15	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC/C=C/CO	ZINC000853968104	DD	On-Demand	Anodyne	CTSK	15	41
C=CCCNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C	ZINC000853968192	CE	On-Demand	Mild	CTSK	16	42
C=CCCNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C	ZINC000853968193	CE	On-Demand	Mild	CTSK	16	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC1CCN(CC2CC2)CC1	ZINC000853968220	GF	On-Demand	Anodyne	CACNA1I	59	37
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NCC1CCN(CC2CC2)CC1	ZINC000853968221	GF	On-Demand	Anodyne	CACNA1I	59	37
O=C(Nc1ccc(OC(F)(F)F)cc1Cl)C(=O)N1CCC2(C1)OCCO2	ZINC000853968262	GE	On-Demand	Anodyne	EPHX2	44	42
O=C(Nc1ccc(OC(F)(F)F)cc1Cl)C(=O)N1CCC2(C1)OCCO2	ZINC000853968262	GE	On-Demand	Anodyne	TRPM8	15	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968310	GF	On-Demand	Anodyne	DRD2	18	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968310	GF	On-Demand	Anodyne	ACHE	15	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968310	GF	On-Demand	Anodyne	PGC	47	36
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968310	GF	On-Demand	Anodyne	SIGMAR1	15	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968310	GF	On-Demand	Anodyne	CCKAR	19	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968310	GF	On-Demand	Anodyne	REN	41	39
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968310	GF	On-Demand	Anodyne	FPR1	52	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968311	GF	On-Demand	Anodyne	DRD2	18	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968311	GF	On-Demand	Anodyne	ACHE	15	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968311	GF	On-Demand	Anodyne	PGC	47	36
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968311	GF	On-Demand	Anodyne	SIGMAR1	15	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968311	GF	On-Demand	Anodyne	CCKAR	19	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968311	GF	On-Demand	Anodyne	REN	41	39
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968311	GF	On-Demand	Anodyne	FPR1	52	37
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968312	GF	On-Demand	Anodyne	DRD2	18	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968312	GF	On-Demand	Anodyne	ACHE	15	43
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968312	GF	On-Demand	Anodyne	PGC	47	36
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968312	GF	On-Demand	Anodyne	SIGMAR1	15	42
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968312	GF	On-Demand	Anodyne	CCKAR	19	40
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968312	GF	On-Demand	Anodyne	REN	41	39
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000853968312	GF	On-Demand	Anodyne	FPR1	52	37
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968313	GF	On-Demand	Anodyne	DRD2	18	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968313	GF	On-Demand	Anodyne	ACHE	15	43
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968313	GF	On-Demand	Anodyne	PGC	47	36
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968313	GF	On-Demand	Anodyne	SIGMAR1	15	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968313	GF	On-Demand	Anodyne	CCKAR	19	40
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968313	GF	On-Demand	Anodyne	REN	41	39
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000853968313	GF	On-Demand	Anodyne	FPR1	52	37
COC(=O)c1ccc(CNC(=O)N[C@H](C)CCNC(=O)OC(C)(C)C)c(F)c1	ZINC000853968327	GF	On-Demand	Anodyne	BDKRB1	21	42
COC(=O)c1ccc(CNC(=O)N[C@@H](C)CCNC(=O)OC(C)(C)C)c(F)c1	ZINC000853968328	GF	On-Demand	Anodyne	BDKRB1	21	42
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853968340	FF	On-Demand	Anodyne	NQO2	18	41
C[C@@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853968341	FF	On-Demand	Anodyne	NQO2	18	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@@H]1CCc2ccc(O)cc21	ZINC000853968342	FF	On-Demand	Anodyne	NQO2	18	41
C[C@H](CCNC(=O)OC(C)(C)C)NC(=O)N[C@H]1CCc2ccc(O)cc21	ZINC000853968343	FF	On-Demand	Anodyne	NQO2	18	41
O=C(NNC(=O)C1CC1)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853968357	FD	On-Demand	Reactive	DHODH	19	44
CO[C@H]1Cc2ccc(NC(=O)C(=O)Nc3cc(C(F)(F)F)nn3C)cc2C1	ZINC000853968378	GE	On-Demand	Anodyne	MTTP	41	37
CCCCCNC(=O)[C@@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968419	DE	On-Demand	Anodyne	PLA2G4B	87	37
CCCCCNC(=O)[C@@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968419	DE	On-Demand	Anodyne	FAAH	22	44
CCCCCNC(=O)[C@@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968419	DE	On-Demand	Anodyne	ASAH1	85	34
CCCCCNC(=O)[C@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968420	DE	On-Demand	Anodyne	PLA2G4B	87	37
CCCCCNC(=O)[C@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968420	DE	On-Demand	Anodyne	FAAH	22	44
CCCCCNC(=O)[C@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968420	DE	On-Demand	Anodyne	ASAH1	85	34
O=C1OCCN1C1CCN(c2ncc(C(F)(F)F)s2)CC1	ZINC000853968482	DF	On-Demand	Anodyne	MLYCD	67	42
O=C1OCCN1C1CCN(c2ncnc3c2ncn3C2CC2)CC1	ZINC000853968500	ED	On-Demand	Anodyne	OXGR1	40	32
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)COc3ccc(F)cc3)CC2)cc1	ZINC000853968511	JD	On-Demand	Anodyne	TGM2	44	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@H](C)OC(=O)COc3ccc(F)cc3)CC2)cc1	ZINC000853968511	JD	On-Demand	Anodyne	F13A1	47	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)COc3ccc(F)cc3)CC2)cc1	ZINC000853968512	JD	On-Demand	Anodyne	TGM2	44	38
Cc1ccc(S(=O)(=O)N2CCN(C(=O)[C@@H](C)OC(=O)COc3ccc(F)cc3)CC2)cc1	ZINC000853968512	JD	On-Demand	Anodyne	F13A1	47	38
COc1c(C)ncnc1N1CCC(N2CCOC2=O)CC1	ZINC000853968556	CD	On-Demand	Anodyne	PDE3B	40	32
Cc1cc(N2Cc3ccc(C)c(Br)c3C2)nc(N)n1	ZINC000853968657	DF	On-Demand	Anodyne	HRH4	29	50
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)COc2ccc(F)cc2)cc1	ZINC000853968661	FH	On-Demand	Anodyne	ACACA	26	42
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)COc2ccc(F)cc2)cc1	ZINC000853968661	FH	On-Demand	Anodyne	ACACB	28	45
CCc1ccc([C@H](C)NC(=O)[C@@H](C)OC(=O)COc2ccc(F)cc2)cc1	ZINC000853968661	FH	On-Demand	Anodyne	ACE2	30	42
O=C1OCCN1C1CCN(c2ccc(-c3ccc(Cl)s3)nn2)CC1	ZINC000853968676	FG	On-Demand	Anodyne	SCD1	34	46
O=C1OCCN1C1CCN(c2ccc(-c3ccc(Cl)s3)nn2)CC1	ZINC000853968676	FG	On-Demand	Anodyne	SCD	23	46
C=CCN(CC=C)C(=O)[C@@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968809	DE	On-Demand	Mild	LSS	30	46
C=CCN(CC=C)C(=O)[C@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853968810	DE	On-Demand	Mild	LSS	30	46
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@@H]1Cc1ccccc1	ZINC000853968821	FE	On-Demand	Anodyne	TACR1	15	45
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@@H]1Cc1ccccc1	ZINC000853968821	FE	On-Demand	Anodyne	MAPK14	15	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@@H]1Cc1ccccc1	ZINC000853968821	FE	On-Demand	Anodyne	CARM1	40	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@@H]1Cc1ccccc1	ZINC000853968821	FE	On-Demand	Anodyne	SFRP1	44	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@H]1Cc1ccccc1	ZINC000853968822	FE	On-Demand	Anodyne	TACR1	15	45
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@H]1Cc1ccccc1	ZINC000853968822	FE	On-Demand	Anodyne	MAPK14	15	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@H]1Cc1ccccc1	ZINC000853968822	FE	On-Demand	Anodyne	CARM1	40	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@H]1Cc1ccccc1	ZINC000853968822	FE	On-Demand	Anodyne	SFRP1	44	36
Cc1ccc2c(c1Br)CN(c1nccc(N3CCCC3)n1)C2	ZINC000853968860	FH	On-Demand	Anodyne	SORD	41	37
CS(=O)(=O)c1ccc2ncnc(N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853968879	GD	On-Demand	Anodyne	PDE3B	41	32
CC(C)c1ccc2ncnc(N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853968883	EG	On-Demand	Anodyne	PDE3A	41	40
CC(C)c1ccc2ncnc(N3CCC(N4CCOC4=O)CC3)c2c1	ZINC000853968883	EG	On-Demand	Anodyne	PDE3B	45	40
O=C1OCCN1C1CCN(c2nc3ccccc3n3cccc23)CC1	ZINC000853968884	EF	On-Demand	Anodyne	HTR3A	28	44
CC(C)(C)C(F)(F)CNc1ccc(S(N)(=O)=O)cc1C#N	ZINC000853968973	DE	On-Demand	Mild	CA2	38	43
COC(=O)c1cccc(N2CCC(N3CCOC3=O)CC2)n1	ZINC000853969070	DD	On-Demand	Anodyne	GLRA1	40	30
Cc1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853969079	CD	On-Demand	Anodyne	SCD1	32	40
Cc1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853969079	CD	On-Demand	Anodyne	SCD	26	40
Cc1ccc(NC(=O)c2ccc(N3CCC(N4CCOC4=O)CC3)nc2)cc1	ZINC000853969095	GG	On-Demand	Anodyne	PIK3CA	25	40
Cc1ccc(NC(=O)c2ccc(N3CCC(N4CCOC4=O)CC3)nc2)cc1	ZINC000853969095	GG	On-Demand	Anodyne	PRNP	51	40
Cc1ccc(NC(=O)c2ccc(N3CCC(N4CCOC4=O)CC3)nc2)cc1	ZINC000853969095	GG	On-Demand	Anodyne	MTOR	67	34
Cc1ccc(NC(=O)c2ccc(N3CCC(N4CCOC4=O)CC3)nc2)cc1	ZINC000853969095	GG	On-Demand	Anodyne	DGAT1	40	39
CNS(=O)(=O)c1ccc(N2CCC(N3CCOC3=O)CC2)c(F)c1	ZINC000853969102	FD	On-Demand	Anodyne	SLC6A9	19	45
N#Cc1cnc(N2CCC(N3CCOC3=O)CC2)c(Cl)c1	ZINC000853969113	DE	On-Demand	Mild	CXCR3	18	40
O=C1OCCN1C1CCN(c2ncnc3ccc(Br)cc23)CC1	ZINC000853969117	GF	On-Demand	Anodyne	PDE3B	41	32
O=C1OCCN1C1CCN(c2nc3ccccc3o2)CC1	ZINC000853969148	CE	On-Demand	Anodyne	HTR3A	17	57
O=C1OCCN1C1CCN(c2nc3ccccc3o2)CC1	ZINC000853969148	CE	On-Demand	Anodyne	CHRNA7	16	57
O=C1OCCN1C1CCN(c2nc3ccccc3nc2N2CCOCC2)CC1	ZINC000853969159	GD	On-Demand	Anodyne	PIK3CA	24	46
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(N2CCOC2=O)CC1	ZINC000853969203	ED	On-Demand	Bother	WDR5	35	40
O=C1OCCN1C1CCN(c2ncnc3ccsc23)CC1	ZINC000853969212	DE	On-Demand	Anodyne	SIRT3	63	35
O=C1OCCN1C1CCN(c2ncnc3ccsc23)CC1	ZINC000853969212	DE	On-Demand	Anodyne	SIRT2	53	35
O=C1OCCN1C1CCN(c2ncnc3ccsc23)CC1	ZINC000853969212	DE	On-Demand	Anodyne	SIRT1	52	35
O=C(Nc1ccccc1)c1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853969249	FE	On-Demand	Anodyne	SCD1	70	48
O=C(Nc1ccccc1)c1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853969249	FE	On-Demand	Anodyne	SCD	51	48
COC(=O)NCc1ccc(NC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)cc1	ZINC000853969308	GD	On-Demand	Anodyne	CARM1	60	40
O=C1OCCN1C1CCN(c2ccnc(Cc3ccccc3)n2)CC1	ZINC000853969311	EE	On-Demand	Anodyne	SORD	39	40
O=C(c1cnc(N2CCC(N3CCOC3=O)CC2)c(Cl)c1)N1CCCCC1	ZINC000853969331	GF	On-Demand	Anodyne	CXCR3	30	49
O=C(c1cnc(N2CCC(N3CCOC3=O)CC2)c(Cl)c1)N1CCCCC1	ZINC000853969331	GF	On-Demand	Anodyne	L3MBTL3	60	38
O=C1OCCN1C1CCN(c2ccc(C(F)(F)F)nn2)CC1	ZINC000853969408	DD	On-Demand	Anodyne	SCD1	28	44
O=C1OCCN1C1CCN(c2ccc(C(F)(F)F)nn2)CC1	ZINC000853969408	DD	On-Demand	Anodyne	SCD	26	44
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000853969429	GI	On-Demand	Anodyne	IMDH_CRYPV	40	35
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	CHRM2	16	40
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	DRD2	23	56
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	DRD4	45	56
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	ACHE	28	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	SLC6A3	26	40
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	KCNH2	17	42
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	CHRM3	27	40
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	LTA4H	41	49
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	SIGMAR1	52	51
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	SSTR5	46	39
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	CACNA1B	16	43
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	CCR1	27	44
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	CCR3	84	52
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	UTS2R	21	43
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	SLC18A3	18	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	MLNR	89	42
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	CCR2	19	42
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	SLC6A5	32	44
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	BACE1	21	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	MCHR1	41	45
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	CACNA1G	51	48
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000853969432	HF	On-Demand	Anodyne	BIRC2	47	46
N#Cc1ccc(N2CCC(N3CCOC3=O)CC2)c(C(F)(F)F)c1	ZINC000853969435	EF	On-Demand	Mild	AR	16	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	CHRM2	16	40
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	DRD2	23	56
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	DRD4	45	56
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	ACHE	28	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	SLC6A3	26	40
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	KCNH2	17	42
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	CHRM3	27	40
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	LTA4H	41	49
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	SIGMAR1	52	51
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	SSTR5	46	39
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	CACNA1B	16	43
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	CCR1	27	44
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	CCR3	84	52
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	UTS2R	21	43
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	SLC18A3	18	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	MLNR	89	42
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	CCR2	19	42
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	SLC6A5	32	44
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	BACE1	21	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	MCHR1	41	45
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	CACNA1G	51	48
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000853969438	HF	On-Demand	Anodyne	BIRC2	47	46
COc1ccc2c(N3CCC(N4CCOC4=O)CC3)ccnc2c1	ZINC000853969483	EF	On-Demand	Anodyne	CCR8	15	43
Nc1nc(N2CCC(N3CCOC3=O)CC2)nc2ccccc12	ZINC000853969488	DD	On-Demand	Anodyne	HTR3A	18	55
O=C(c1cccnc1N1CCC(N2CCOC2=O)CC1)N1CCc2ccccc21	ZINC000853969506	GF	On-Demand	Anodyne	GPBAR1	40	39
O=C(NC1CCCC1)c1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853969509	FD	On-Demand	Anodyne	SCD1	59	39
O=C(NC1CCCC1)c1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853969509	FD	On-Demand	Anodyne	SCD	51	37
N#Cc1ccc(N2CCC(N3CCOC3=O)CC2)cc1Cl	ZINC000853969548	DF	On-Demand	Mild	AR	29	48
O=C1OCCN1C1CCN(c2nc(Nc3ccccc3)c3nc[nH]c3n2)CC1	ZINC000853969575	GF	On-Demand	Anodyne	TTK	28	40
O=C(c1cc(N2CCC(N3CCOC3=O)CC2)ccc1[N+](=O)[O-])N1CCCC1	ZINC000853969582	GE	On-Demand	Bother	L3MBTL3	51	44
O=C(c1cccnc1N1CCC(N2CCOC2=O)CC1)N1CCCCC1	ZINC000853969583	FE	On-Demand	Anodyne	L3MBTL3	66	42
CC1(C)CCN1C(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853969641	FG	On-Demand	Anodyne	P2RY1	48	41
CC1(C)CCN1C(=O)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853969641	FG	On-Demand	Anodyne	EPHX2	45	37
O=C(COC(=O)COc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853969648	GF	On-Demand	Anodyne	MCHR1	21	46
O=C(COC(=O)COc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853969648	GF	On-Demand	Anodyne	DGAT1	39	43
O=C(COC(=O)COc1ccc(F)cc1)Nc1ccc(N2CCCCC2)nc1	ZINC000853969648	GF	On-Demand	Anodyne	SLC27A1	47	41
O=C1OCCN1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853969663	CD	On-Demand	Anodyne	AKT2	62	62
O=C1OCCN1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853969663	CD	On-Demand	Anodyne	AKT3	36	45
O=C1OCCN1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853969663	CD	On-Demand	Anodyne	JAK3	22	55
O=C1OCCN1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853969663	CD	On-Demand	Anodyne	JAK1	63	36
O=C1OCCN1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853969663	CD	On-Demand	Anodyne	ROCK2	16	45
O=C1OCCN1C1CCN(c2ncnc3[nH]ccc23)CC1	ZINC000853969663	CD	On-Demand	Anodyne	AKT1	25	45
O=C1OCCN1C1CCN(c2ncccc2C(F)(F)F)CC1	ZINC000853969664	DF	On-Demand	Anodyne	TRPV1	30	47
O=C1OCCN1C1CCN(c2nc3ccccc3s2)CC1	ZINC000853969712	DF	On-Demand	Anodyne	LTA4H	24	57
Cc1nc(N2CCC(N3CCOC3=O)CC2)c2cnn(-c3ccccc3)c2n1	ZINC000853969733	GF	On-Demand	Anodyne	PIK3CA	16	45
CCn1c(=O)c(N2CCC(N3CCOC3=O)CC2)nc2ccccc21	ZINC000853969781	ED	On-Demand	Anodyne	HRH1	28	43
CCn1c(=O)c(N2CCC(N3CCOC3=O)CC2)nc2ccccc21	ZINC000853969781	ED	On-Demand	Anodyne	PDE6D	42	35
CC(C)(C)C(F)(F)CNc1nccc(N2CCCC2)n1	ZINC000853969789	CG	On-Demand	Anodyne	SORD	62	37
Cc1nc(N2CCC(N3CCOC3=O)CC2)c2cc[nH]c2n1	ZINC000853969792	DD	On-Demand	Anodyne	AKT2	25	40
Cc1nc(N2CCC(N3CCOC3=O)CC2)c2cc[nH]c2n1	ZINC000853969792	DD	On-Demand	Anodyne	JAK1	46	33
N#Cc1ccc(N2CCC(N3CCOC3=O)CC2)cc1C(F)(F)F	ZINC000853969817	EF	On-Demand	Mild	AR	67	57
O=C1OCCN1C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000853969834	FG	On-Demand	Bother	LIPG	44	32
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853969864	GG	On-Demand	Anodyne	KIT	24	41
C[C@@H](OC(=O)COc1ccc(F)cc1)C(=O)Nc1ccc2c(c1)OC(F)(F)O2	ZINC000853969864	GG	On-Demand	Anodyne	BRAF	21	41
CC[C@H](C)NC(=O)[C@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853969972	CE	On-Demand	Anodyne	ACE2	27	42
CC[C@H](C)NC(=O)[C@@H](C)OC(=O)COc1ccc(F)cc1	ZINC000853969973	CE	On-Demand	Anodyne	ACE2	27	42
CN1CCN(c2nc3ccccc3nc2N2CCC(N3CCOC3=O)CC2)CC1	ZINC000853970019	GD	On-Demand	Anodyne	HTR3A	30	48
CN1CCN(c2nc3ccccc3nc2N2CCC(N3CCOC3=O)CC2)CC1	ZINC000853970019	GD	On-Demand	Anodyne	HRH4	23	48
O=C1OCCN1C1CCN(c2ncnc3cc(Br)sc23)CC1	ZINC000853970040	GF	On-Demand	Anodyne	SIRT3	81	39
O=C1OCCN1C1CCN(c2ncnc3cc(Br)sc23)CC1	ZINC000853970040	GF	On-Demand	Anodyne	SIRT2	68	37
O=C1OCCN1C1CCN(c2ncnc3cc(Br)sc23)CC1	ZINC000853970040	GF	On-Demand	Anodyne	SIRT1	59	35
NC(=O)c1cnc(N2CCC(N3CCOC3=O)CC2)c(Cl)c1	ZINC000853970087	DD	On-Demand	Anodyne	CXCR3	29	46
O=C1OCCN1C1CCN(c2ncc(-c3ccc(Cl)cc3)s2)CC1	ZINC000853970098	FH	On-Demand	Anodyne	LUCI_LUCLA	19	45
COc1cccc([N+](=O)[O-])c1NC[C@H](O)[C@H](C)c1ccccc1	ZINC000853970109	DG	On-Demand	Bother	COLA	74	33
COc1cccc([N+](=O)[O-])c1NC[C@@H](O)[C@H](C)c1ccccc1	ZINC000853970111	DG	On-Demand	Bother	COLA	74	33
O=C1OCCN1C1CCN(c2ncnc3ccc(F)cc23)CC1	ZINC000853970112	DE	On-Demand	Anodyne	PDE3B	42	32
COc1cccc([N+](=O)[O-])c1NC[C@@H](O)[C@@H](C)c1ccccc1	ZINC000853970113	DG	On-Demand	Bother	COLA	74	33
COc1cccc([N+](=O)[O-])c1NC[C@H](O)[C@@H](C)c1ccccc1	ZINC000853970114	DG	On-Demand	Bother	COLA	74	33
CCCc1cc(N2CCC(N3CCOC3=O)CC2)c2ccccc2n1	ZINC000853970221	EH	On-Demand	Anodyne	HTR1A	20	40
CCCc1cc(N2CCC(N3CCOC3=O)CC2)c2ccccc2n1	ZINC000853970221	EH	On-Demand	Anodyne	HTR1D	39	40
CCCc1cc(N2CCC(N3CCOC3=O)CC2)c2ccccc2n1	ZINC000853970221	EH	On-Demand	Anodyne	HTR1B	36	40
CCCc1cc(N2CCC(N3CCOC3=O)CC2)c2ccccc2n1	ZINC000853970221	EH	On-Demand	Anodyne	METAP1	40	35
O=C1OCCN1C1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000853970231	EG	On-Demand	Anodyne	LUCI_LUCLA	20	47
O=C1OCCN1C1CCN(c2ncc(-c3ccccc3)s2)CC1	ZINC000853970231	EG	On-Demand	Anodyne	MLYCD	42	36
NC(=O)c1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853970255	CB	On-Demand	Anodyne	SCD1	52	47
NC(=O)c1ccc(N2CCC(N3CCOC3=O)CC2)nn1	ZINC000853970255	CB	On-Demand	Anodyne	SCD	44	35
O=C1OCCN1C1CCN(c2nc(-c3cccc(Cl)c3)no2)CC1	ZINC000853970261	EF	On-Demand	Anodyne	GRM5	21	46
COC(=O)c1sc(N2CCC(N3CCOC3=O)CC2)nc1Cl	ZINC000853970263	EE	On-Demand	Anodyne	PARE	86	32
N#Cc1cc(C(F)(F)F)ccc1N1CCC(N2CCOC2=O)CC1	ZINC000853970265	EF	On-Demand	Mild	LIPG	46	35
O=C(c1cnc(N2CCC(N3CCOC3=O)CC2)c(Cl)c1)N1CCOCC1	ZINC000853970291	GD	On-Demand	Anodyne	CXCR3	30	42
N#Cc1cc(N2CCC(N3CCOC3=O)CC2)ccc1C(F)(F)F	ZINC000853970295	EF	On-Demand	Mild	AR	30	46
CCCNC(=O)c1ccc(N2CCC(N3CCOC3=O)CC2)nc1	ZINC000853970307	ED	On-Demand	Anodyne	HPGDS	24	43
O=C1OCCN1C1CCN(c2nc(-c3ccncc3)nc3ccccc23)CC1	ZINC000853970316	GG	On-Demand	Anodyne	MTOR	42	37
O=C1OCCN1C1CCN(c2ccnc3cc(Cl)ccc23)CC1	ZINC000853970337	EG	On-Demand	Anodyne	HRP1_PLAFA	94	36
Cc1ccc(-c2csc3ncnc(N4CCC(N5CCOC5=O)CC4)c23)cc1	ZINC000853970360	GI	On-Demand	Anodyne	ADRB3	17	57
O=C1OCCN1C1CCN(c2ncnc3cc(Cl)ccc23)CC1	ZINC000853970510	EF	On-Demand	Anodyne	PDE3B	41	35
O=C1OCCN1C1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853970718	GG	On-Demand	Anodyne	PIK3CA	26	49
O=C1OCCN1C1CCN(c2nc(-c3cccnc3)nc3ccccc23)CC1	ZINC000853970718	GG	On-Demand	Anodyne	MTOR	34	49
Cc1nc2c(s1)[C@H](NC(=O)N1CC[C@@H](Oc3ccccc3)C1)CCC2	ZINC000853970756	FH	On-Demand	Anodyne	EPHX2	24	44
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@H](CCO)Cc1ccccc1	ZINC000853970760	GD	On-Demand	Anodyne	CARM1	49	38
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@H](CCO)Cc1ccccc1	ZINC000853970760	GD	On-Demand	Anodyne	GPR142	20	40
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@@H](CCO)Cc1ccccc1	ZINC000853970761	GD	On-Demand	Anodyne	CARM1	49	38
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@@H](CCO)Cc1ccccc1	ZINC000853970761	GD	On-Demand	Anodyne	GPR142	20	40
O=C1OCCN1C1CCN(c2nc3ccccc3[nH]2)CC1	ZINC000853970901	CD	On-Demand	Anodyne	KCNN3	16	44
Cc1nc2c(s1)[C@H](NC(=O)NC[C@@H]1CCCN(CC3CC3)C1)CCC2	ZINC000853970952	FG	On-Demand	Anodyne	CCR3	49	38
Cc1nc2c(s1)[C@H](NC(=O)NC[C@H]1CCCN(CC3CC3)C1)CCC2	ZINC000853970953	FG	On-Demand	Anodyne	CCR3	49	38
O=C1OCCN1C1CCN(c2ccccn2)CC1	ZINC000853970985	BD	On-Demand	Anodyne	DRD4	24	40
O=C1OCCN1C1CCN(c2ccccn2)CC1	ZINC000853970985	BD	On-Demand	Anodyne	EBP	29	47
O=C1OCCN1C1CCN(c2ccc([N+](=O)[O-])c3nonc23)CC1	ZINC000853970998	ED	On-Demand	Bother	GSTM2	102	40
O=C1OCCN1C1CCN(c2ccc([N+](=O)[O-])c3nonc23)CC1	ZINC000853970998	ED	On-Demand	Bother	GSTP1	58	39
COc1ccccc1CONC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853971009	FD	On-Demand	Anodyne	CARM1	69	43
N#Cc1ccnc(N2CCC(N3CCOC3=O)CC2)c1	ZINC000853971078	CD	On-Demand	Mild	MAP3K12	52	39
O=C1OCCN1C1CCN(c2ccc3ccccc3n2)CC1	ZINC000853971147	CF	On-Demand	Anodyne	HTR3A	25	48
O=C(NC1CC1)c1ccc(N2CCC(N3CCOC3=O)CC2)nc1	ZINC000853971161	ED	On-Demand	Anodyne	HPGDS	36	52
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@H](c2ccccn2)C1	ZINC000853971200	FD	On-Demand	Anodyne	RBP4	52	37
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N1CC[C@@H](c2ccccn2)C1	ZINC000853971201	FD	On-Demand	Anodyne	RBP4	52	37
O=C1OCCN1C1CCN(c2nc(NCCO)c3ccccc3n2)CC1	ZINC000853971281	FD	On-Demand	Anodyne	HRH4	17	44
O=C(Nc1ccc(OC(F)(F)F)cc1Cl)C(=O)N1CCC(F)(F)CC1	ZINC000853971437	GG	On-Demand	Anodyne	EPHX2	46	42
O=C(Nc1ccc(OC(F)(F)F)cc1Cl)C(=O)N1CCC(F)(F)CC1	ZINC000853971437	GG	On-Demand	Anodyne	TRPM8	15	41
COCC[C@H](NC(=O)N[C@H](C(C)C)[C@H](O)c1ccc(Cl)cc1)c1ccco1	ZINC000853971527	GI	On-Demand	Anodyne	UTS2	42	32
COCC[C@H](NC(=O)N[C@H](C(C)C)[C@@H](O)c1ccc(Cl)cc1)c1ccco1	ZINC000853971528	GI	On-Demand	Anodyne	UTS2	42	32
COCC[C@H](NC(=O)N[C@@H](C(C)C)[C@@H](O)c1ccc(Cl)cc1)c1ccco1	ZINC000853971529	GI	On-Demand	Anodyne	UTS2	42	32
COCC[C@H](NC(=O)N[C@@H](C(C)C)[C@H](O)c1ccc(Cl)cc1)c1ccco1	ZINC000853971530	GI	On-Demand	Anodyne	UTS2	42	32
O=C(NC[C@H]1CC(=O)N(C2CC2)C1)NNc1cc(F)cc(Cl)c1	ZINC000853971534	EE	On-Demand	Reactive	CACNA1I	45	33
O=C(NC[C@@H]1CC(=O)N(C2CC2)C1)NNc1cc(F)cc(Cl)c1	ZINC000853971535	EE	On-Demand	Reactive	CACNA1I	45	33
COC(=O)Nc1cccc(CNC(=O)C(=O)Nc2cc(C(F)(F)F)nn2C)c1	ZINC000853971660	GD	On-Demand	Anodyne	CARM1	74	44
NC(=O)CC1(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCCC1	ZINC000853971804	EF	On-Demand	Bother	NMBR	53	31
Cc1nc2c(s1)[C@H](NC(=O)N[C@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853971822	FF	On-Demand	Anodyne	PYGL	35	47
Cc1nc2c(s1)[C@H](NC(=O)N[C@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853971822	FF	On-Demand	Anodyne	PYGM	30	47
Cc1nc2c(s1)[C@H](NC(=O)N[C@@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853971824	FF	On-Demand	Anodyne	PYGL	35	47
Cc1nc2c(s1)[C@H](NC(=O)N[C@@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853971824	FF	On-Demand	Anodyne	PYGM	30	47
O=C(NCCCOCCOCc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853971894	GG	On-Demand	Anodyne	EPHX2	17	54
O=C(NCCCOCCOCc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853971894	GG	On-Demand	Anodyne	NAAA	31	42
O=C(NCCCOCCOCc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853971895	GG	On-Demand	Anodyne	EPHX2	17	54
O=C(NCCCOCCOCc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853971895	GG	On-Demand	Anodyne	NAAA	31	42
O=C(NCCCOCCOCc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853971896	GG	On-Demand	Anodyne	EPHX2	17	54
O=C(NCCCOCCOCc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853971896	GG	On-Demand	Anodyne	NAAA	31	42
O=C(NCCCOCCOCc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853971897	GG	On-Demand	Anodyne	EPHX2	17	54
O=C(NCCCOCCOCc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853971897	GG	On-Demand	Anodyne	NAAA	31	42
Cc1nc2c(s1)[C@H](NC(=O)NCc1cccnc1N1CCCC1)CCC2	ZINC000853972121	FG	On-Demand	Anodyne	SCN10A	15	43
C#CC[C@H](Cc1ccccc1)NC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853972154	GE	On-Demand	Mild	CARM1	40	37
C#CC[C@@H](Cc1ccccc1)NC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853972155	GE	On-Demand	Mild	CARM1	40	37
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853972220	GI	On-Demand	Anodyne	RBP4	71	41
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853972221	GI	On-Demand	Anodyne	RBP4	71	41
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853972222	GI	On-Demand	Anodyne	RBP4	71	41
C[C@H](Cc1ccccc1C(F)(F)F)NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853972223	GI	On-Demand	Anodyne	RBP4	71	41
O=C(NCC[C@H]1CCCCO1)NNc1nc2ccc(Cl)cc2s1	ZINC000853972317	FH	On-Demand	Reactive	LCK	24	42
O=C(NCC[C@@H]1CCCCO1)NNc1nc2ccc(Cl)cc2s1	ZINC000853972318	FH	On-Demand	Reactive	LCK	24	42
OC1(c2ccc(Br)cc2)CN(c2ncccc2C(F)(F)F)C1	ZINC000853972346	FH	On-Demand	Anodyne	TRPV1	30	55
COCC[C@@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1ccco1	ZINC000853972424	GH	On-Demand	Reactive	CSNK1D	39	43
COCC[C@H](NC(=O)NNc1nc2ccc(Cl)cc2s1)c1ccco1	ZINC000853972425	GH	On-Demand	Reactive	CSNK1D	39	43
NC(=O)CC1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853972426	EE	On-Demand	Bother	GSTM2	117	42
NC(=O)CC1(CNc2ccc([N+](=O)[O-])c3nonc23)CCCCC1	ZINC000853972426	EE	On-Demand	Bother	GSTP1	73	42
Cc1nc2c(s1)[C@H](NC(=O)NCC1CCN(Cc3ccncc3)CC1)CCC2	ZINC000853972464	GG	On-Demand	Anodyne	CACNA1I	53	39
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCCNC(=O)c1cc[nH]n1	ZINC000853972474	GC	On-Demand	Anodyne	GPR119	29	41
CC(C)(C)OC(=O)C1(CNc2nccc(N3CCCC3)n2)CCC1	ZINC000853972620	EG	On-Demand	Anodyne	MRGPRX1	40	35
C[C@@H](Sc1ccc2nnc(C(F)(F)F)n2n1)c1cccc(C(F)(F)F)c1	ZINC000853972647	GK	On-Demand	Anodyne	LRRK2	30	46
C[C@H](Sc1ccc2nnc(C(F)(F)F)n2n1)c1cccc(C(F)(F)F)c1	ZINC000853972648	GK	On-Demand	Anodyne	LRRK2	30	46
O=C1NCCCN1c1ccc(CNc2cc(NC3CC3)ncn2)cc1	ZINC000853972656	EF	On-Demand	Anodyne	PRKD1	40	33
OC1(c2ccc(Br)cc2)CN(c2nccc(N3CCOCC3)n2)C1	ZINC000853972671	GD	On-Demand	Anodyne	SORD	64	36
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NCc1ccc([Si](C)(C)C)cc1	ZINC000853972724	GE	On-Demand	Anodyne	CARM1	71	38
O=C(NOC1CCC1)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000853972833	FF	On-Demand	Anodyne	EPHX2	40	38
OC1(c2ccc(Br)cc2)CN(c2ncc(C(F)(F)F)s2)C1	ZINC000853972917	GH	On-Demand	Anodyne	MLYCD	68	48
CC(C)c1ccc2ncnc(NCc3ccc(N4CCCNC4=O)cc3)c2c1	ZINC000853972948	GI	On-Demand	Anodyne	CLK4	55	36
COc1c(C)ncnc1NCc1ccc(N2CCCNC2=O)cc1	ZINC000853973007	EE	On-Demand	Anodyne	PDE5A	15	40
COc1c(C)ncnc1NCc1ccc(N2CCCNC2=O)cc1	ZINC000853973007	EE	On-Demand	Anodyne	PDE6A	43	32
OC1(c2ccc(Br)cc2)CN(c2cc(N3CCOCC3)ncn2)C1	ZINC000853973056	GD	On-Demand	Anodyne	ADK	26	43
C#CCNC(=O)c1ccc(N2CCC3(C=Cc4ccccc4O3)CC2)nc1	ZINC000853973233	FF	On-Demand	Mild	HDAC1	19	43
C#CCNC(=O)c1ccc(N2CCC3(C=Cc4ccccc4O3)CC2)nc1	ZINC000853973233	FF	On-Demand	Mild	SCD1	16	53
OC1(c2ccc(Br)cc2)CN(c2ccnc(N3CCCCC3)n2)C1	ZINC000853973240	GF	On-Demand	Anodyne	SORD	55	38
C[C@@H](ONC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C)c1ccccc1	ZINC000853973250	FE	On-Demand	Anodyne	CARM1	59	40
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCC2(C=Cc3ccccc3O2)CC1	ZINC000853973258	GG	On-Demand	Bother	WDR5	34	40
O=C(NC1CC1)c1ccc(N2CC(O)(c3ccc(Br)cc3)C2)nc1	ZINC000853973294	GE	On-Demand	Anodyne	HPGDS	34	47
OC1(c2ccc(Br)cc2)CN(c2ccnc(N3CCOCC3)n2)C1	ZINC000853973308	GD	On-Demand	Anodyne	SORD	41	37
COCc1cc([N+](=O)[O-])ccc1N1CC(O)(c2ccc(Br)cc2)C1	ZINC000853973328	GG	On-Demand	Bother	CACNA1D	53	33
OC1(c2ccc(Br)cc2)CN(c2nccc(N3CCCC3)n2)C1	ZINC000853973335	GF	On-Demand	Anodyne	SORD	76	38
CS(=O)(=O)c1ccc(NCc2ccc(N3CCCNC3=O)cc2)cc1	ZINC000853973378	FF	On-Demand	Anodyne	GHSR	22	43
O=C(NCCO)c1ccc(N2CC(O)(c3ccc(Br)cc3)C2)nn1	ZINC000853973397	GC	On-Demand	Anodyne	SCD1	53	45
O=C(NCCO)c1ccc(N2CC(O)(c3ccc(Br)cc3)C2)nn1	ZINC000853973397	GC	On-Demand	Anodyne	SCD	44	41
O=C1NCCCN1c1ccc(CNc2nccc(N3CCOCC3)n2)cc1	ZINC000853973439	FD	On-Demand	Anodyne	EPHB4	63	35
O=C1NCCCN1c1ccc(CNc2nccc(N3CCOCC3)n2)cc1	ZINC000853973439	FD	On-Demand	Anodyne	STAT6	61	38
COC(=O)[C@H](F)CNC(=O)C(=O)Nc1cc(C(F)(F)F)nn1C	ZINC000853973475	EC	On-Demand	Anodyne	CARM1	52	36
O=C1NCCCN1c1ccc(CNc2ccccn2)cc1	ZINC000853973530	CF	On-Demand	Anodyne	CXCR4	15	57
O=C(N[C@@H]1CCCC[C@H]1Nc1cnc(F)cn1)c1ccccc1	ZINC000853973535	DF	On-Demand	Anodyne	SSTR3	35	48
O=C(NC1CC1)c1ccc(NCc2ccc(N3CCCNC3=O)cc2)nc1	ZINC000853973538	FF	On-Demand	Anodyne	SSTR5	36	43
COC[C@@H](CNC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1)OC	ZINC000853973558	FE	On-Demand	Anodyne	PDS	59	33
Cn1cnc2c(NCc3ccc(N4CCCNC4=O)cc3)ncnc21	ZINC000853973574	ED	On-Demand	Anodyne	ADORA1	20	41
Cn1cnc2c(NCc3ccc(N4CCCNC4=O)cc3)ncnc21	ZINC000853973574	ED	On-Demand	Anodyne	ADORA3	49	39
O=C(N[C@@H]1CCCC[C@H]1Nc1cc(F)ncn1)c1ccccc1	ZINC000853973588	DF	On-Demand	Anodyne	SSTR3	36	50
C#Cc1cnc(N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)nc1	ZINC000853973627	DF	On-Demand	Mild	SSTR3	30	46
COC[C@@H](CNC(=O)NC[C@H](O)c1ccc(Cl)c(Cl)c1)OC	ZINC000853973666	FD	On-Demand	Anodyne	ADRB1	16	49
COC[C@@H](CNC(=O)NC[C@@H](O)c1ccc(Cl)c(Cl)c1)OC	ZINC000853973667	FD	On-Demand	Anodyne	ADRB1	16	49
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)NC[Si](C)(C)c1ccccc1	ZINC000853973669	GD	On-Demand	Anodyne	CARM1	61	37
COc1ccc(-c2nnc(NCc3ccc(N4CCCNC4=O)cc3)s2)cc1	ZINC000853973691	GH	On-Demand	Anodyne	PROKR1	46	30
C1=CC2(CCN(c3nccc(N4CCCC4)n3)CC2)Oc2ccccc21	ZINC000853973778	EH	On-Demand	Anodyne	SORD	50	40
N#Cc1c(Cl)nsc1N[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC000853973809	FH	On-Demand	Mild	SSTR3	30	47
Cc1csc2c(NCc3ccc(N4CCCNC4=O)cc3)ncnc12	ZINC000853973845	FH	On-Demand	Anodyne	LPAR2	19	45
COC[C@@H](CNC(=O)NNc1nc2ccc(Cl)cc2s1)OC	ZINC000853973865	EE	On-Demand	Reactive	CSNK1D	43	50
O=C1NCCCN1c1ccc(CNc2ncnc3c2ncn3C2CC2)cc1	ZINC000853973910	FF	On-Demand	Anodyne	ADORA1	68	43
O=C1NCCCN1c1ccc(CNc2ncnc3c2ncn3C2CC2)cc1	ZINC000853973910	FF	On-Demand	Anodyne	SLC29A1	19	47
O=C1NCCCN1c1ccc(CNc2ncnc3c2ncn3C2CC2)cc1	ZINC000853973910	FF	On-Demand	Anodyne	CDK1	18	43
O=C1NCCCN1c1ccc(CNc2ncnc3c2ncn3C2CC2)cc1	ZINC000853973910	FF	On-Demand	Anodyne	ADORA3	97	45
O=C1NCCCN1c1ccc(CNc2ncnc3c2ncn3C2CC2)cc1	ZINC000853973910	FF	On-Demand	Anodyne	OXGR1	43	33
O=C1NCCCN1c1ccc(CNc2ncnc3c2ncn3C2CC2)cc1	ZINC000853973910	FF	On-Demand	Anodyne	DNMT3B	43	41
COC(=O)c1cccc(NC[C@H]2CN(C)CCN2Cc2ccccc2)n1	ZINC000853973931	FE	On-Demand	Anodyne	SIGMAR1	18	44
COC(=O)c1cccc(NC[C@@H]2CN(C)CCN2Cc2ccccc2)n1	ZINC000853973932	FE	On-Demand	Anodyne	SIGMAR1	18	44
COCCc1nsc(N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)n1	ZINC000853974070	FF	On-Demand	Anodyne	SSTR3	31	44
N#Cc1ccc(NCc2ccc(N3CCCNC3=O)cc2)cc1C(F)(F)F	ZINC000853974084	FI	On-Demand	Mild	AR	58	44
C#CC1CCN(C(=O)C(=O)Nc2ccc(OC(F)(F)F)cc2Cl)CC1	ZINC000853974171	FG	On-Demand	Mild	EPHX2	40	40
NC(=O)c1cc(Cl)nnc1NCc1ccc(N2CCCNC2=O)cc1	ZINC000853974180	FD	On-Demand	Anodyne	STAT6	58	37
CC(=O)c1ccc(N2CCC3(C=Cc4ccccc4O3)CC2)c([N+](=O)[O-])c1	ZINC000853974182	FI	On-Demand	Bother	TAAR1	15	42
O=C(N[C@@H]1CCCC[C@H]1Nc1ncnc(F)c1Br)c1ccccc1	ZINC000853974210	GH	On-Demand	Anodyne	SSTR3	33	46
Cc1nc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)sc1S(N)(=O)=O	ZINC000853974263	GD	On-Demand	Anodyne	PARE	67	35
CC(=O)c1nc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)sc1C	ZINC000853974286	FG	On-Demand	Anodyne	PARE	78	39
O=C(N[C@@H]1CCCC[C@H]1Nc1nccc(N2CCCC2)n1)c1ccccc1	ZINC000853974332	FG	On-Demand	Anodyne	PRKD1	42	34
O=C(N[C@@H]1CCCC[C@H]1Nc1nccc(N2CCCC2)n1)c1ccccc1	ZINC000853974332	FG	On-Demand	Anodyne	SSTR3	30	44
O=C(N[C@@H]1CCCC[C@H]1Nc1nccc(N2CCCC2)n1)c1ccccc1	ZINC000853974332	FG	On-Demand	Anodyne	MAPK9	28	41
NC(=O)c1cc(=N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)cc[nH]1	ZINC000853974402	ED	On-Demand	Anodyne	SSTR3	26	40
O=C(N[C@@H]1CCCC[C@H]1Nc1cccc(F)n1)c1ccccc1	ZINC000853974444	DG	On-Demand	Anodyne	SSTR3	37	49
O=C(N[C@@H]1CCCC[C@H]1Nc1ncnc2c1CCC2)c1ccccc1	ZINC000853974450	EG	On-Demand	Anodyne	SSTR3	31	46
COC(=O)c1sc(N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)nc1Cl	ZINC000853974470	GH	On-Demand	Anodyne	SSTR3	31	47
COc1ccc(N2CC[C@H](NC(=O)NC[C@H](C)C#N)C2)cc1	ZINC000853974512	DD	On-Demand	Mild	MTNR1A	15	45
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H](C)C#N)C2)cc1	ZINC000853974514	DD	On-Demand	Mild	MTNR1A	15	45
Cc1nc(N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c2cnn(C)c2n1	ZINC000853974556	FF	On-Demand	Anodyne	SSTR3	29	41
N#Cc1sc(N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)nc1Cl	ZINC000853974570	FH	On-Demand	Mild	SSTR3	32	47
Nc1nc(NCc2ccc(N3CCCNC3=O)cc2)ncc1[N+](=O)[O-]	ZINC000853974581	ED	On-Demand	Bother	PRKCQ	28	45
C[C@@H](NC(=O)N1CCc2nnc(-c3cnn(C)c3)cc2C1)c1cncc(F)c1	ZINC000853974602	GE	On-Demand	Anodyne	MAPK1	43	40
COc1c(C)ncnc1N1CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000853974681	EE	On-Demand	Anodyne	PDE3B	41	34
COc1c(C)ncnc1N1CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000853974681	EE	On-Demand	Anodyne	SIRT3	37	40
COc1c(C)ncnc1N1CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000853974681	EE	On-Demand	Anodyne	SIRT2	28	40
COc1c(C)ncnc1N1CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000853974681	EE	On-Demand	Anodyne	SIRT1	28	40
CON(C)CCNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000853974690	EC	On-Demand	Anodyne	OPRK1	21	41
CON(C)CCNC(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000853974690	EC	On-Demand	Anodyne	MCHR1	15	41
CON(C)CCNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000853974691	EC	On-Demand	Anodyne	OPRK1	21	41
CON(C)CCNC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000853974691	EC	On-Demand	Anodyne	MCHR1	15	41
C[C@H](C#N)CNC(=O)N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853974698	GG	On-Demand	Mild	GPR119	29	42
C[C@H](C#N)CNC(=O)N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853974700	GG	On-Demand	Mild	GPR119	29	42
C[C@H](C#N)CNC(=O)N[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1c1ccccc1	ZINC000853974747	GG	On-Demand	Mild	GPR119	30	44
O=C(Nc1ccc(OC(F)(F)F)cc1Cl)C(=O)N[C@H]1COC2(CCC2)C1	ZINC000853974763	GG	On-Demand	Anodyne	ENV	42	37
O=C(Nc1ccc(OC(F)(F)F)cc1Cl)C(=O)N[C@@H]1COC2(CCC2)C1	ZINC000853974764	GG	On-Demand	Anodyne	ENV	42	37
Cc1nsc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000853974782	DE	On-Demand	Anodyne	PARE	40	31
C[C@H](C#N)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853974826	DF	On-Demand	Reactive	CSNK1D	42	47
Cc1csc2c(N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)ncnc12	ZINC000853974845	FG	On-Demand	Anodyne	SIRT3	66	42
Cc1csc2c(N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)ncnc12	ZINC000853974845	FG	On-Demand	Anodyne	SIRT2	57	42
Cc1csc2c(N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)ncnc12	ZINC000853974845	FG	On-Demand	Anodyne	SIRT1	52	42
Nc1nc(Cl)cc(N[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)n1	ZINC000853974856	EF	On-Demand	Anodyne	SSTR3	36	55
COC(=O)c1nc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)sc1C	ZINC000853974892	FF	On-Demand	Anodyne	PARE	93	41
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853974900	FD	On-Demand	Anodyne	RBP4	50	32
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853974901	FD	On-Demand	Anodyne	RBP4	50	32
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853974902	FD	On-Demand	Anodyne	RBP4	50	32
Cn1nc(C(F)(F)F)cc1NC(=O)C(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853974903	FD	On-Demand	Anodyne	RBP4	50	32
Cn1nnc2c(N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853974915	FD	On-Demand	Anodyne	SIRT3	36	41
Cn1nnc2c(N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853974915	FD	On-Demand	Anodyne	SIRT2	32	41
Cn1nnc2c(N3CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C3)ncnc21	ZINC000853974915	FD	On-Demand	Anodyne	SIRT1	28	41
C[C@H](C#N)CNC(=O)NCc1cccc(NC(=O)OC(C)(C)C)c1	ZINC000853974919	EF	On-Demand	Mild	PAPA1_CARPA	33	40
O=C(N[C@@H]1CCCC[C@H]1Nc1ccc(Cl)nn1)c1ccccc1	ZINC000853974926	EG	On-Demand	Anodyne	SSTR3	35	55
O=C(NCc1ccccc1CN1CC[C@@H](O)C1)NNc1cc(F)cc(Cl)c1	ZINC000853974935	GF	On-Demand	Reactive	MCHR1	21	42
O=C(NCc1ccccc1CN1CC[C@H](O)C1)NNc1cc(F)cc(Cl)c1	ZINC000853974936	GF	On-Demand	Reactive	MCHR1	21	42
COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1	ZINC000853974974	GF	On-Demand	Bother	TAAR1	15	40
Cc1cc(C#N)nc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000853975046	EE	On-Demand	Mild	GPR119	17	41
CC(=O)c1ccc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c([N+](=O)[O-])c1	ZINC000853975048	GG	On-Demand	Bother	TAAR1	18	46
O=C(N[C@@H]1CCCC[C@H]1Nc1cncc(Cl)n1)c1ccccc1	ZINC000853975061	EG	On-Demand	Anodyne	SSTR3	36	54
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853975078	DD	On-Demand	Anodyne	EPHX2	37	64
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1C[C@H](O)C1	ZINC000853975078	DD	On-Demand	Anodyne	SLC12A5	57	34
O=C(NCCCCC(=O)OCc1ccccc1)NC[C@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853975086	FF	On-Demand	Anodyne	EPHX2	33	63
O=C(NCCCCC(=O)OCc1ccccc1)NC[C@@]1(O)C[C@H]2C=C[C@H]1C2	ZINC000853975087	FF	On-Demand	Anodyne	EPHX2	33	63
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975099	FF	On-Demand	Anodyne	FKBP1A	22	40
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975099	FF	On-Demand	Anodyne	PREP	22	41
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1C[C@@H](O)C12CCC2	ZINC000853975100	FF	On-Demand	Anodyne	EPHX2	25	58
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](O)C12CCC2	ZINC000853975101	FF	On-Demand	Anodyne	EPHX2	25	58
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1C[C@H](O)C12CCC2	ZINC000853975102	FF	On-Demand	Anodyne	EPHX2	25	58
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1C[C@H](O)C12CCC2	ZINC000853975103	FF	On-Demand	Anodyne	EPHX2	25	58
Cc1nc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c2cc[nH]c2n1	ZINC000853975116	EF	On-Demand	Anodyne	JAK1	15	41
O=C(CCCCNC(=O)N1C[C@@H]2CCCC[C@@H]21)OCc1ccccc1	ZINC000853975139	EG	On-Demand	Anodyne	ACE	27	43
O=C(CCCCNC(=O)N1C[C@@H]2CCCC[C@@H]21)OCc1ccccc1	ZINC000853975139	EG	On-Demand	Anodyne	FKBP1A	39	42
O=C(CCCCNC(=O)N1C[C@@H]2CCCC[C@@H]21)OCc1ccccc1	ZINC000853975139	EG	On-Demand	Anodyne	PREP	49	43
O=C(CCCCNC(=O)N1C[C@@H]2CCCC[C@@H]21)OCc1ccccc1	ZINC000853975139	EG	On-Demand	Anodyne	SLC12A5	49	34
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2cc(C(F)(F)F)ccn2)n1	ZINC000853975149	GG	On-Demand	Anodyne	PDS	40	35
C[C@H]1CC[C@@H](NC(=O)NCCCCC(=O)OCc2ccccc2)CS1(=O)=O	ZINC000853975162	GE	On-Demand	Anodyne	EPHX2	22	53
C[C@H]1CC[C@H](NC(=O)NCCCCC(=O)OCc2ccccc2)CS1(=O)=O	ZINC000853975164	GE	On-Demand	Anodyne	EPHX2	22	53
C[C@@H]1CC[C@H](NC(=O)NCCCCC(=O)OCc2ccccc2)CS1(=O)=O	ZINC000853975165	GE	On-Demand	Anodyne	EPHX2	22	53
CN1C[C@H](CNC(=O)NCCCCC(=O)OCc2ccccc2)CC1=O	ZINC000853975191	FD	On-Demand	Anodyne	HTR4	20	41
CN1C[C@H](CNC(=O)NCCCCC(=O)OCc2ccccc2)CC1=O	ZINC000853975191	FD	On-Demand	Anodyne	EPHX2	17	52
CN1C[C@@H](CNC(=O)NCCCCC(=O)OCc2ccccc2)CC1=O	ZINC000853975192	FD	On-Demand	Anodyne	HTR4	20	41
CN1C[C@@H](CNC(=O)NCCCCC(=O)OCc2ccccc2)CC1=O	ZINC000853975192	FD	On-Demand	Anodyne	EPHX2	17	52
O=C(NCCCCC(=O)OCc1ccccc1)NCC1(O)CCC(F)(F)CC1	ZINC000853975198	GG	On-Demand	Anodyne	EPHX2	17	57
O=C(CCCCNC(=O)N1CCC[C@@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975211	FF	On-Demand	Anodyne	FKBP1A	36	44
O=C(CCCCNC(=O)N1CCC[C@@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975211	FF	On-Demand	Anodyne	PREP	53	47
O=C(CCCCNC(=O)N1CCC[C@@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975211	FF	On-Demand	Anodyne	EPHX2	19	48
O=C(CCCCNC(=O)N1CCC[C@@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975211	FF	On-Demand	Anodyne	SLC12A5	74	39
O=C(CCCCNC(=O)N1CCC[C@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975212	FF	On-Demand	Anodyne	FKBP1A	36	44
O=C(CCCCNC(=O)N1CCC[C@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975212	FF	On-Demand	Anodyne	PREP	53	47
O=C(CCCCNC(=O)N1CCC[C@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975212	FF	On-Demand	Anodyne	EPHX2	19	48
O=C(CCCCNC(=O)N1CCC[C@](O)(C2CC2)C1)OCc1ccccc1	ZINC000853975212	FF	On-Demand	Anodyne	SLC12A5	74	39
O=C(CCCCNC(=O)N1CCC2(COC2)C1)OCc1ccccc1	ZINC000853975218	EE	On-Demand	Anodyne	SLC12A5	66	38
CS(=O)(=O)C1CN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975219	FD	On-Demand	Anodyne	CYSP_TRYCR	42	35
CS(=O)(=O)C1CN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975219	FD	On-Demand	Anodyne	PREP	17	43
CS(=O)(=O)C1CN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975219	FD	On-Demand	Anodyne	CAPN1	49	37
CS(=O)(=O)C1CN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975219	FD	On-Demand	Anodyne	CAPN2	74	37
CS(=O)(=O)C1CN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975219	FD	On-Demand	Anodyne	TGM2	40	42
CS(=O)(=O)C1CN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975219	FD	On-Demand	Anodyne	NPR	57	37
CS(=O)(=O)C1CN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975219	FD	On-Demand	Anodyne	TMPRSS11D	50	36
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853975223	GG	On-Demand	Anodyne	EPHX2	24	60
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853975224	GG	On-Demand	Anodyne	EPHX2	24	60
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853975225	GG	On-Demand	Anodyne	EPHX2	24	60
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853975226	GG	On-Demand	Anodyne	EPHX2	24	60
O=C(CCCCNC(=O)N1CC[C@@H](Oc2ccccc2)C1)OCc1ccccc1	ZINC000853975230	GH	On-Demand	Anodyne	PREP	27	43
O=C(CCCCNC(=O)N1CC[C@@H](Oc2ccccc2)C1)OCc1ccccc1	ZINC000853975230	GH	On-Demand	Anodyne	EPHX2	29	52
O=C(CCCCNC(=O)N1CC[C@@H](Oc2ccccc2)C1)OCc1ccccc1	ZINC000853975230	GH	On-Demand	Anodyne	TGM2	39	43
COCCc1nsc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)n1	ZINC000853975234	FE	On-Demand	Anodyne	PARE	43	32
O=C(CCCCNC(=O)N1CC[C@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975274	FE	On-Demand	Anodyne	PREP	20	42
O=C(CCCCNC(=O)N1CC[C@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975274	FE	On-Demand	Anodyne	EPHX2	20	50
O=C(CCCCNC(=O)N1CC[C@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975274	FE	On-Demand	Anodyne	TGM2	34	40
O=C(CCCCNC(=O)N1CC[C@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975274	FE	On-Demand	Anodyne	SLC12A5	58	34
O=C(CCCCNC(=O)N1CC[C@@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975275	FE	On-Demand	Anodyne	PREP	20	42
O=C(CCCCNC(=O)N1CC[C@@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975275	FE	On-Demand	Anodyne	EPHX2	20	50
O=C(CCCCNC(=O)N1CC[C@@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975275	FE	On-Demand	Anodyne	TGM2	34	40
O=C(CCCCNC(=O)N1CC[C@@H](O)C(F)(F)C1)OCc1ccccc1	ZINC000853975275	FE	On-Demand	Anodyne	SLC12A5	58	34
O=C(NCCCCC(=O)OCc1ccccc1)NCC1CCC(O)CC1	ZINC000853975311	FF	On-Demand	Anodyne	EPHX2	25	59
COC(=O)c1sc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)nc1Cl	ZINC000853975313	GG	On-Demand	Anodyne	PARE	106	37
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1C[C@@H](O)[C@@H]1n1cccn1	ZINC000853975314	GD	On-Demand	Anodyne	EPHX2	17	53
O=C(NCCCCC(=O)OCc1ccccc1)N[C@H]1CCc2ccc(O)cc21	ZINC000853975325	GH	On-Demand	Anodyne	EPHX2	20	55
O=C(NCCCCC(=O)OCc1ccccc1)N[C@@H]1CCc2ccc(O)cc21	ZINC000853975326	GH	On-Demand	Anodyne	EPHX2	20	55
CCc1ncnc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1F	ZINC000853975328	EF	On-Demand	Anodyne	SIRT3	39	40
CCc1ncnc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1F	ZINC000853975328	EF	On-Demand	Anodyne	SIRT2	34	40
CCc1ncnc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)c1F	ZINC000853975328	EF	On-Demand	Anodyne	SIRT1	32	40
Cc1nc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)sc1C	ZINC000853975329	EG	On-Demand	Anodyne	PARE	88	37
C=CCNC(=O)c1ccc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)nc1	ZINC000853975330	GE	On-Demand	Mild	HPGDS	23	40
O=C(CCCCNC(=O)N1CC[C@@H](Cn2ccnn2)C1)OCc1ccccc1	ZINC000853975347	GE	On-Demand	Anodyne	GRIN2B	25	41
O=C(CCCCNC(=O)N1CC[C@H](Cn2ccnn2)C1)OCc1ccccc1	ZINC000853975348	GE	On-Demand	Anodyne	GRIN2B	25	41
CO[C@]1(CO)CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975367	GE	On-Demand	Anodyne	FKBP1A	17	40
CO[C@]1(CO)CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975367	GE	On-Demand	Anodyne	PREP	20	43
CO[C@]1(CO)CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975367	GE	On-Demand	Anodyne	EPHX2	17	46
CO[C@]1(CO)CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975367	GE	On-Demand	Anodyne	TGM2	20	41
CO[C@]1(CO)CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)C1	ZINC000853975367	GE	On-Demand	Anodyne	SLC12A5	77	42
O=C(CCCCNC(=O)N1CCC(CO)(CO)C1)OCc1ccccc1	ZINC000853975395	FD	On-Demand	Anodyne	EPHX2	18	51
O=C(CCCCNC(=O)N1CCC(CO)(CO)C1)OCc1ccccc1	ZINC000853975395	FD	On-Demand	Anodyne	TGM2	25	41
O=C(CCCCNC(=O)N1CCC(CO)(CO)C1)OCc1ccccc1	ZINC000853975395	FD	On-Demand	Anodyne	SLC12A5	71	38
CCCNC(=O)c1ccc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)nc1	ZINC000853975402	GF	On-Demand	Anodyne	HPGDS	36	43
O=C(NCCCCC(=O)OCc1ccccc1)NC1CC(CO)C1	ZINC000853975415	ED	On-Demand	Anodyne	EPHX2	33	62
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@@H]1CCO	ZINC000853975418	GG	On-Demand	Anodyne	ACE	23	41
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@@H]1CCO	ZINC000853975418	GG	On-Demand	Anodyne	FKBP1A	48	43
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@@H]1CCO	ZINC000853975418	GG	On-Demand	Anodyne	PREP	62	38
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@@H]1CCO	ZINC000853975418	GG	On-Demand	Anodyne	LGMN	45	37
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@H]1CCO	ZINC000853975419	GG	On-Demand	Anodyne	ACE	23	41
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@H]1CCO	ZINC000853975419	GG	On-Demand	Anodyne	FKBP1A	48	43
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@H]1CCO	ZINC000853975419	GG	On-Demand	Anodyne	PREP	62	38
C[C@@H]1CCCN(C(=O)NCCCCC(=O)OCc2ccccc2)[C@H]1CCO	ZINC000853975419	GG	On-Demand	Anodyne	LGMN	45	37
N#C[C@H]1CCCC[C@@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975458	FG	On-Demand	Mild	PREP	15	40
N#C[C@H]1CCCC[C@@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975458	FG	On-Demand	Mild	EPHX2	19	54
N#C[C@H]1CCCC[C@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975459	FG	On-Demand	Mild	PREP	15	40
N#C[C@H]1CCCC[C@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975459	FG	On-Demand	Mild	EPHX2	19	54
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975460	FG	On-Demand	Mild	PREP	15	40
N#C[C@@H]1CCCC[C@@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975460	FG	On-Demand	Mild	EPHX2	19	54
N#C[C@@H]1CCCC[C@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975461	FG	On-Demand	Mild	PREP	15	40
N#C[C@@H]1CCCC[C@H]1NC(=O)NCCCCC(=O)OCc1ccccc1	ZINC000853975461	FG	On-Demand	Mild	EPHX2	19	54
Cc1nnc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)s1	ZINC000853975475	DE	On-Demand	Anodyne	PARE	101	35
O=C1CC[C@@H](CNC(=O)NCCCCC(=O)OCc2ccccc2)N1	ZINC000853975481	ED	On-Demand	Anodyne	EPHX2	18	55
C#CCNC(=O)c1ccc(N2CC[C@@H](F)[C@H](NC(=O)OC(C)(C)C)C2)nc1	ZINC000853975528	GD	On-Demand	Mild	HPGDS	30	41
CC(C)(C#N)CNC(=O)N1CCC[C@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853975534	GH	On-Demand	Mild	GPR119	29	43
CC(C)(C#N)CNC(=O)N1CCC[C@@H](C2CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC000853975535	GH	On-Demand	Mild	GPR119	29	43
O=C(CCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1)OCc1ccccc1	ZINC000853975563	EE	On-Demand	Anodyne	GHRHR	52	32
O=C(CCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1)OCc1ccccc1	ZINC000853975563	EE	On-Demand	Anodyne	EPHX2	15	53
O=C(CCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1)OCc1ccccc1	ZINC000853975563	EE	On-Demand	Anodyne	TGM2	27	41
O=C(CCCCNC(=O)N1CC[C@@]2(O)C[C@H]2C1)OCc1ccccc1	ZINC000853975563	EE	On-Demand	Anodyne	SLC12A5	51	34
COc1ccc(N2CC[C@H](NC(=O)NCC(C)(C)C#N)C2)cc1	ZINC000853975569	DE	On-Demand	Mild	MTNR1A	16	45
CN1CCN(C(=O)NCCCCC(=O)OCc2ccccc2)CCC1=O	ZINC000853975589	FD	On-Demand	Anodyne	TGM2	36	44
O=C(CCCCNC(=O)N1CCC(O)(CO)CC1)OCc1ccccc1	ZINC000853975604	FD	On-Demand	Anodyne	GHRHR	43	31
O=C(CCCCNC(=O)N1CCC(O)(CO)CC1)OCc1ccccc1	ZINC000853975604	FD	On-Demand	Anodyne	TGM2	28	41
O=C(CCCCNC(=O)N1CCC(O)(CO)CC1)OCc1ccccc1	ZINC000853975604	FD	On-Demand	Anodyne	SLC12A5	62	36
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2nccn(C(F)F)c2=O)n1	ZINC000853975608	GD	On-Demand	Anodyne	CASP3	46	32
CC(C)(C#N)CNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853975609	DG	On-Demand	Reactive	CSNK1D	43	45
O=C(CCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1)OCc1ccccc1	ZINC000853975612	GF	On-Demand	Anodyne	FKBP1A	43	42
O=C(CCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1)OCc1ccccc1	ZINC000853975612	GF	On-Demand	Anodyne	CPT1A	105	37
O=C(CCCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1)OCc1ccccc1	ZINC000853975612	GF	On-Demand	Anodyne	PREP	59	43
O=C(CCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)OCc1ccccc1	ZINC000853975613	GF	On-Demand	Anodyne	FKBP1A	43	42
O=C(CCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)OCc1ccccc1	ZINC000853975613	GF	On-Demand	Anodyne	CPT1A	105	37
O=C(CCCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1)OCc1ccccc1	ZINC000853975613	GF	On-Demand	Anodyne	PREP	59	43
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2cnc3ccccc3n2)n1	ZINC000853975690	GF	On-Demand	Anodyne	METG	48	33
COc1cc(NCc2cccc(OC)c2C)c([N+](=O)[O-])cc1OC	ZINC000853975702	EH	On-Demand	Bother	TAAR1	20	44
COc1cccc(CNc2nccc(N3CCCC3)n2)c1C	ZINC000853975706	CG	On-Demand	Anodyne	GALR2	48	38
COCCN(CCF)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853975719	FH	On-Demand	Mild	MCHR1	23	44
COCCN(CCF)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853975720	FH	On-Demand	Mild	MCHR1	23	44
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2ncccc2C(F)(F)F)n1	ZINC000853975731	GG	On-Demand	Anodyne	SCN10A	20	40
Fc1ncnc(NCc2cccc(COC[C@@H]3CCCO3)c2)c1Br	ZINC000853975814	GH	On-Demand	Anodyne	TNK2	44	34
Fc1ncnc(NCc2cccc(COC[C@H]3CCCO3)c2)c1Br	ZINC000853975815	GH	On-Demand	Anodyne	TNK2	44	34
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2ccc([N+](=O)[O-])cc2)n1	ZINC000853975901	GF	On-Demand	Bother	NMBR	47	30
C[C@@H]1[C@@H](C)N(c2cc(Cl)nc(N)n2)CCN1c1cc(Cl)nc(N)n1	ZINC000853975970	FD	On-Demand	Anodyne	HRH4	46	34
C[C@H]1[C@H](C)N(c2cc(Cl)nc(N)n2)CCN1c1cc(Cl)nc(N)n1	ZINC000853975975	FD	On-Demand	Anodyne	HRH4	46	34
C=CCS(=O)(=O)CCNC(=O)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853976013	GB	On-Demand	Mild	TGM2	47	33
C=CCS(=O)(=O)CCNC(=O)N1CCN(S(=O)(=O)c2cc[nH]n2)CC1	ZINC000853976013	GB	On-Demand	Mild	F13A1	50	33
c1cc(CNc2nccc(N3CCCC3)n2)cc(COC[C@@H]2CCCO2)c1	ZINC000853976028	FG	On-Demand	Anodyne	MRGPRX1	17	41
c1cc(CNc2nccc(N3CCCC3)n2)cc(COC[C@H]2CCCO2)c1	ZINC000853976029	FG	On-Demand	Anodyne	MRGPRX1	17	41
CN(C(=O)NC[C@@H]1COC(C)(C)O1)[C@@H](CO)Cc1ccccc1	ZINC000853976097	DD	On-Demand	Anodyne	NPY5R	15	40
CN(C(=O)NC[C@@H]1COC(C)(C)O1)[C@H](CO)Cc1ccccc1	ZINC000853976100	DD	On-Demand	Anodyne	NPY5R	15	40
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2ncnc3ccccc23)n1	ZINC000853976102	GF	On-Demand	Anodyne	EGFR	18	43
COc1cccc(CNc2nnc(C)cc2C(F)(F)F)c1C	ZINC000853976150	DH	On-Demand	Anodyne	PTK2	40	32
CON(C)CCNC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976211	FG	On-Demand	Mild	MCHR1	25	50
CON(C)CCNC(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976211	FG	On-Demand	Mild	UTS2	51	35
CON(C)CCNC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976212	FG	On-Demand	Mild	MCHR1	25	50
CON(C)CCNC(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976212	FG	On-Demand	Mild	UTS2	51	35
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2nc(O)c3ccccc3n2)n1	ZINC000853976413	GE	On-Demand	Anodyne	METG	70	33
COc1cccc(CNc2nccc(C)n2)c1C	ZINC000853976454	BF	On-Demand	Anodyne	DRTS_TOXGO	19	41
COc1cccc(CNc2nccc(C)n2)c1C	ZINC000853976454	BF	On-Demand	Anodyne	DYR_PNECA	18	40
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2cc(Cl)nc(N)n2)n1	ZINC000853976492	GD	On-Demand	Anodyne	AGPAT2	42	35
COc1cccc(CNc2nc(C)ccc2[N+](=O)[O-])c1C	ZINC000853976534	CG	On-Demand	Bother	PRKCQ	21	45
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2nc3ccccc3[nH]2)n1	ZINC000853976587	FF	On-Demand	Anodyne	KCNN3	18	42
COC(=O)c1sc(NCc2cccc(OC)c2C)nc1Cl	ZINC000853976592	EH	On-Demand	Anodyne	CSNK1D	21	40
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2ccnc3cc(F)ccc23)n1	ZINC000853976596	GH	On-Demand	Anodyne	HRP1_PLAFA	71	35
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976607	GH	On-Demand	Mild	ACACA	22	40
C#CCCN(CCOC)C(=O)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976607	GH	On-Demand	Mild	MCHR1	17	41
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976608	GH	On-Demand	Mild	ACACA	22	40
C#CCCN(CCOC)C(=O)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000853976608	GH	On-Demand	Mild	MCHR1	17	41
CC(C)(C)OC(=O)NCc1cc(O)nc(CNc2ccc(Cl)cn2)n1	ZINC000853976623	FF	On-Demand	Anodyne	F10	46	29
COc1cccc([C@]2(C)CCN(C(=O)NC[C@H]3COC(C)(C)O3)C2)c1	ZINC000853976640	EF	On-Demand	Anodyne	DRD4	40	31
COc1cccc([C@]2(C)CCN(C(=O)NC[C@@H]3COC(C)(C)O3)C2)c1	ZINC000853976641	EF	On-Demand	Anodyne	DRD4	40	31
c1cc(CNc2ncnc3c2CCC3)cc(COC[C@@H]2CCCO2)c1	ZINC000853976658	EG	On-Demand	Anodyne	TNK2	51	34
c1cc(CNc2ncnc3c2CCC3)cc(COC[C@H]2CCCO2)c1	ZINC000853976659	EG	On-Demand	Anodyne	TNK2	51	34
CCCn1cc(NC(=O)C(=O)NCc2ccc(F)c(S(N)(=O)=O)c2)cn1	ZINC000853976883	GC	On-Demand	Anodyne	PANC	44	35
C=CCS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1c1n[nH]c(COC)n1	ZINC000853977015	FC	On-Demand	Mild	CPT1A	45	34
C=CCS(=O)(=O)CCNC(=O)N1CCCC[C@H]1c1n[nH]c(COC)n1	ZINC000853977016	FC	On-Demand	Mild	CPT1A	45	34
Cc1cc(N2CCn3c(nnc3C(C)(C)C)C2)nc(N)n1	ZINC000853977044	CD	On-Demand	Anodyne	HRH4	31	51
C=CCS(=O)(=O)CCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853977136	FD	On-Demand	Mild	MTNR1A	46	38
C=CCS(=O)(=O)CCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853977136	FD	On-Demand	Mild	MTNR1B	42	38
C=CCS(=O)(=O)CCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853977137	FD	On-Demand	Mild	MTNR1A	46	38
C=CCS(=O)(=O)CCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853977137	FD	On-Demand	Mild	MTNR1B	42	38
O=[N+]([O-])c1ccc(NCc2cccc(COC[C@@H]3CCCO3)c2)c2nonc12	ZINC000853977218	GG	On-Demand	Bother	GSTM2	96	38
O=[N+]([O-])c1ccc(NCc2cccc(COC[C@@H]3CCCO3)c2)c2nonc12	ZINC000853977218	GG	On-Demand	Bother	GSTP1	61	38
O=[N+]([O-])c1ccc(NCc2cccc(COC[C@H]3CCCO3)c2)c2nonc12	ZINC000853977219	GG	On-Demand	Bother	GSTM2	96	38
O=[N+]([O-])c1ccc(NCc2cccc(COC[C@H]3CCCO3)c2)c2nonc12	ZINC000853977219	GG	On-Demand	Bother	GSTP1	61	38
N#CCCCNC(=O)NNc1nc2ccc(Cl)cc2s1	ZINC000853977325	DF	On-Demand	Reactive	CSNK1D	38	43
COC(=O)[C@@H]1C[C@@H](NC(=O)NCCCCCCSC)C1	ZINC000853977498	DE	On-Demand	Anodyne	EPHX2	19	46
COCCc1ccc(OC[C@@H](O)CNC(=O)NC[C@@H]2COC(C)(C)O2)cc1	ZINC000853977548	GD	On-Demand	Anodyne	ADRB2	24	49
COCCc1ccc(OC[C@@H](O)CNC(=O)NC[C@@H]2COC(C)(C)O2)cc1	ZINC000853977548	GD	On-Demand	Anodyne	ADRB1	59	49
COCCc1ccc(OC[C@H](O)CNC(=O)NC[C@@H]2COC(C)(C)O2)cc1	ZINC000853977549	GD	On-Demand	Anodyne	ADRB2	24	49
COCCc1ccc(OC[C@H](O)CNC(=O)NC[C@@H]2COC(C)(C)O2)cc1	ZINC000853977549	GD	On-Demand	Anodyne	ADRB1	59	49
COCCc1ccc(OC[C@@H](O)CNC(=O)NC[C@H]2COC(C)(C)O2)cc1	ZINC000853977550	GD	On-Demand	Anodyne	ADRB2	24	49
COCCc1ccc(OC[C@@H](O)CNC(=O)NC[C@H]2COC(C)(C)O2)cc1	ZINC000853977550	GD	On-Demand	Anodyne	ADRB1	59	49
COCCc1ccc(OC[C@H](O)CNC(=O)NC[C@H]2COC(C)(C)O2)cc1	ZINC000853977551	GD	On-Demand	Anodyne	ADRB2	24	49
COCCc1ccc(OC[C@H](O)CNC(=O)NC[C@H]2COC(C)(C)O2)cc1	ZINC000853977551	GD	On-Demand	Anodyne	ADRB1	59	49
C=CCS(=O)(=O)CCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853977566	EC	On-Demand	Mild	CPT1A	63	33
C=CCS(=O)(=O)CCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853977567	EC	On-Demand	Mild	CPT1A	63	33
COc1cccc(OC)c1CNC(=O)NC[C@@H]1COC(C)(C)O1	ZINC000853977766	DD	On-Demand	Anodyne	ADRA1D	23	40
COc1cccc(OC)c1CNC(=O)NC[C@@H]1COC(C)(C)O1	ZINC000853977766	DD	On-Demand	Anodyne	ADRA1A	18	40
COc1cccc(OC)c1CNC(=O)NC[C@@H]1COC(C)(C)O1	ZINC000853977766	DD	On-Demand	Anodyne	ADRA1B	23	40
COc1cccc(OC)c1CNC(=O)NC[C@H]1COC(C)(C)O1	ZINC000853977767	DD	On-Demand	Anodyne	ADRA1D	23	40
COc1cccc(OC)c1CNC(=O)NC[C@H]1COC(C)(C)O1	ZINC000853977767	DD	On-Demand	Anodyne	ADRA1A	18	40
COc1cccc(OC)c1CNC(=O)NC[C@H]1COC(C)(C)O1	ZINC000853977767	DD	On-Demand	Anodyne	ADRA1B	23	40
C=CCS(=O)(=O)CCNC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000853977773	GD	On-Demand	Mild	TGM2	35	41
C=CCS(=O)(=O)CCNC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000853977774	GD	On-Demand	Mild	TGM2	35	41
COc1ccc(N2CC[C@H](NC(=O)NC[C@H]3COC(C)(C)O3)C2)cc1	ZINC000853977778	ED	On-Demand	Clean	MTNR1A	15	47
COc1ccc(N2CC[C@H](NC(=O)NC[C@@H]3COC(C)(C)O3)C2)cc1	ZINC000853977781	ED	On-Demand	Clean	MTNR1A	15	47
FC(F)(F)C[C@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1	ZINC000853977840	FH	On-Demand	Anodyne	PIK3CA	20	43
FC(F)(F)C[C@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1	ZINC000853977840	FH	On-Demand	Anodyne	MTOR	22	43
FC(F)(F)C[C@@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1	ZINC000853977841	FH	On-Demand	Anodyne	PIK3CA	20	43
FC(F)(F)C[C@@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1	ZINC000853977841	FH	On-Demand	Anodyne	MTOR	22	43
CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2ccc(C)cc2C)CC1	ZINC000853977928	FF	On-Demand	Bother	WDR5	40	45
C#CCNC(=O)c1ccc(N2CCN(c3ccc(C)cc3C)CC2)nc1	ZINC000853977958	EE	On-Demand	Mild	DRD3	18	40
O=C(NC/C=C/CO)NCc1ccc(N2CCOC2=O)cc1	ZINC000853978126	DC	On-Demand	Anodyne	DGAT1	17	40
O=C(NC/C=C\CO)NCc1ccc(N2CCOC2=O)cc1	ZINC000853978127	DC	On-Demand	Anodyne	DGAT1	17	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853978262	GG	On-Demand	Anodyne	SPHK1	30	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853978263	GG	On-Demand	Anodyne	SPHK1	30	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853978264	GG	On-Demand	Anodyne	SPHK1	30	40
O=C(NCCCc1nc(-c2ccc(F)cc2)no1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853978265	GG	On-Demand	Anodyne	SPHK1	30	40
COCC1(NC(=O)NCCCCCCSC)CCCC1	ZINC000853978274	DG	On-Demand	Anodyne	EPHX2	23	41
CCOC(=O)c1nccc(N2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853978552	EF	On-Demand	Anodyne	SORD	78	45
COC(=O)c1nccc(N2CCN(c3ccc(C)cc3C)CC2)n1	ZINC000853978581	EE	On-Demand	Anodyne	SORD	81	44
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4cc(OC)ccc4C3)C2)cc1	ZINC000853978629	GG	On-Demand	Clean	MTNR1A	23	48
COc1ccc(N2CC[C@H](NC(=O)N[C@@H]3CCc4cc(OC)ccc4C3)C2)cc1	ZINC000853978629	GG	On-Demand	Clean	MTNR1B	24	48
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4cc(OC)ccc4C3)C2)cc1	ZINC000853978630	GG	On-Demand	Clean	MTNR1A	23	48
COc1ccc(N2CC[C@H](NC(=O)N[C@H]3CCc4cc(OC)ccc4C3)C2)cc1	ZINC000853978630	GG	On-Demand	Clean	MTNR1B	24	48
COc1ccc2c(c1)CC[C@H](NC(=O)NCC[S@](=O)CC(F)(F)F)C2	ZINC000853978637	GE	On-Demand	Anodyne	NQO2	28	43
COc1ccc2c(c1)CC[C@H](NC(=O)NCC[S@@](=O)CC(F)(F)F)C2	ZINC000853978640	GE	On-Demand	Anodyne	NQO2	28	43
COc1ccc([C@@H]2CCCN2C(=O)NC[C@@H]2COC(C)(C)O2)cc1F	ZINC000853978652	FF	On-Demand	Anodyne	ACKR3	63	33
COc1ccc([C@@H]2CCCN2C(=O)NC[C@H]2COC(C)(C)O2)cc1F	ZINC000853978654	FF	On-Demand	Anodyne	ACKR3	63	33
CCN1CC[C@H](N(CC)C(=O)NCc2ccc(N3CCOC3=O)cc2)C1	ZINC000853978803	FE	On-Demand	Anodyne	CCR5	16	49
CCN1CC[C@@H](N(CC)C(=O)NCc2ccc(N3CCOC3=O)cc2)C1	ZINC000853978804	FE	On-Demand	Anodyne	CCR5	16	49
COC(=O)c1sc(N2CCO[C@@H](CC(F)(F)F)C2)nc1Cl	ZINC000853978843	EF	On-Demand	Anodyne	PARE	52	33
COC(=O)c1sc(N2CCO[C@H](CC(F)(F)F)C2)nc1Cl	ZINC000853978844	EF	On-Demand	Anodyne	PARE	52	33
COC(=O)Nc1cccc(NC(=O)C(=O)N2CC3CC2(c2ccccc2)C3)c1	ZINC000853978854	GF	On-Demand	Anodyne	KCNK3	47	34
COc1c(C)ncnc1N1CCN(c2ccc(C)cc2C)CC1	ZINC000853978899	DF	On-Demand	Anodyne	PDE3B	40	34
O=C(Nc1ccc(N2CCCC2)c(F)c1)C(=O)N1CC2CC1(c1ccccc1)C2	ZINC000853978922	GH	On-Demand	Anodyne	KCNQ2	44	32
O=C(Nc1ccc(N2CCCC2)c(F)c1)C(=O)N1CC2CC1(c1ccccc1)C2	ZINC000853978922	GH	On-Demand	Anodyne	NPY2R	94	42
O=C1OCCN1c1ccc(CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)cc1	ZINC000853978986	FE	On-Demand	Anodyne	CPT1A	58	35
O=C1OCCN1c1ccc(CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)cc1	ZINC000853978987	FE	On-Demand	Anodyne	CPT1A	58	35
C#CCNC(=O)c1ccc(N2C[C@H](C)O[C@@H](CC(F)(F)F)C2)nc1	ZINC000853978995	ED	On-Demand	Mild	HPGDS	30	41
C#CCNC(=O)c1ccc(N2C[C@@H](C)O[C@H](CC(F)(F)F)C2)nc1	ZINC000853978996	ED	On-Demand	Mild	HPGDS	30	41
C#CCNC(=O)c1ccc(N2C[C@H](C)O[C@H](CC(F)(F)F)C2)nc1	ZINC000853978997	ED	On-Demand	Mild	HPGDS	30	41
C#CCNC(=O)c1ccc(N2C[C@H](CC(F)(F)F)O[C@H](C)C2)nc1	ZINC000853978998	ED	On-Demand	Mild	HPGDS	30	41
C#CCNC(=O)c1ccc(N2CCN(c3ccc(OCC)nn3)CC2)nc1	ZINC000853979028	FC	On-Demand	Mild	SCD1	33	42
C#CCNC(=O)c1ccc(N2CCN(c3ccc(OCC)nn3)CC2)nc1	ZINC000853979028	FC	On-Demand	Mild	SCD	22	42
C#CCNC(=O)c1ccc(N2CCN(c3ccc(OCC)nn3)CC2)nc1	ZINC000853979028	FC	On-Demand	Mild	HPGDS	15	40
COc1ccc2c(c1)CC[C@H](NC(=O)NCCN(C)OC)C2	ZINC000853979039	DD	On-Demand	Anodyne	NQO2	33	43
COc1ccc2c(c1)CC[C@H](NC(=O)NCCN(C)OC)C2	ZINC000853979039	DD	On-Demand	Anodyne	MTNR1A	45	42
O=[N+]([O-])c1ccc(N2CCO[C@H](CC(F)(F)F)C2)c2nonc12	ZINC000853979043	EE	On-Demand	Bother	GSTM2	95	38
O=[N+]([O-])c1ccc(N2CCO[C@H](CC(F)(F)F)C2)c2nonc12	ZINC000853979043	EE	On-Demand	Bother	GSTP1	53	38
O=[N+]([O-])c1ccc(N2CCO[C@@H](CC(F)(F)F)C2)c2nonc12	ZINC000853979045	EE	On-Demand	Bother	GSTM2	95	38
O=[N+]([O-])c1ccc(N2CCO[C@@H](CC(F)(F)F)C2)c2nonc12	ZINC000853979045	EE	On-Demand	Bother	GSTP1	53	38
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@@H](O)c1cc(F)c(F)c(F)c1)C2	ZINC000853979051	GG	On-Demand	Anodyne	ADRB3	20	44
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@@H](O)c1cc(F)c(F)c(F)c1)C2	ZINC000853979051	GG	On-Demand	Anodyne	NQO2	22	40
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@H](O)c1cc(F)c(F)c(F)c1)C2	ZINC000853979055	GG	On-Demand	Anodyne	ADRB3	20	44
COc1ccc2c(c1)CC[C@H](NC(=O)NC[C@H](O)c1cc(F)c(F)c(F)c1)C2	ZINC000853979055	GG	On-Demand	Anodyne	NQO2	22	40
COc1ccc2c(c1)CC[C@H](NC(=O)NCc1ncccn1)C2	ZINC000853979089	DD	On-Demand	Anodyne	NQO2	27	40
COc1ccc2c(c1)CC[C@H](NC(=O)NCc1ncccn1)C2	ZINC000853979089	DD	On-Demand	Anodyne	MTNR1A	35	41
COc1ccc2c(c1)CC[C@H](NC(=O)NCCC1SCCS1)C2	ZINC000853979283	FG	On-Demand	Anodyne	NQO2	30	46
COc1ccc2c(c1)CC[C@H](NC(=O)NCCC1SCCS1)C2	ZINC000853979283	FG	On-Demand	Anodyne	MTNR1A	33	41
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1CC2CC1(c1ccccc1)C2	ZINC000853979309	GF	On-Demand	Anodyne	MTOR	43	39
O=C(N[C@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853979310	GC	On-Demand	Anodyne	CALCRL	38	46
O=C(N[C@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853979311	GC	On-Demand	Anodyne	CALCRL	38	46
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853979312	GC	On-Demand	Anodyne	CALCRL	38	46
O=C(N[C@@H]1CCCN(Cc2ccccn2)C1=O)N1CC[C@H](N2CCOC2=O)C1	ZINC000853979313	GC	On-Demand	Anodyne	CALCRL	38	46
COc1ccc2c(c1)CC[C@H](NC(=O)NCCc1nnc(S)n1C)C2	ZINC000853979347	FD	On-Demand	Anodyne	MTNR1A	43	38
COc1cc(N2CCN(C(=O)c3cccn3C)CC2)c([N+](=O)[O-])cc1OC	ZINC000853979348	FD	On-Demand	Clean	HTR1A	15	43
COC(=O)N(C)CCNC(=O)N[C@H]1CCc2cc(OC)ccc2C1	ZINC000853979349	ED	On-Demand	Anodyne	NQO2	30	41
COC(=O)N(C)CCNC(=O)N[C@H]1CCc2cc(OC)ccc2C1	ZINC000853979349	ED	On-Demand	Anodyne	MTNR1A	36	40
COC(=O)N(C)CCNC(=O)N[C@@H]1CCc2cc(OC)ccc2C1	ZINC000853979350	ED	On-Demand	Anodyne	NQO2	30	41
COC(=O)N(C)CCNC(=O)N[C@@H]1CCc2cc(OC)ccc2C1	ZINC000853979350	ED	On-Demand	Anodyne	MTNR1A	36	40
O=C1CCC2=C(CCN(C(=O)N[C@H]3CCCN(Cc4ccccn4)C3=O)C2)N1	ZINC000853979412	GD	On-Demand	Anodyne	CALCRL	25	41
O=C1CCC2=C(CCN(C(=O)N[C@@H]3CCCN(Cc4ccccn4)C3=O)C2)N1	ZINC000853979415	GD	On-Demand	Anodyne	CALCRL	25	41
COc1ccc2c(c1)CC[C@H](NC(=O)NCCS(=O)(=O)CC(F)(F)F)C2	ZINC000853979457	GD	On-Demand	Anodyne	NQO2	31	44
Cc1nc(N2CCO[C@@H](CC(F)(F)F)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853979503	GG	On-Demand	Anodyne	MTOR	15	47
Cc1nc(N2CCO[C@H](CC(F)(F)F)C2)c2cnn(-c3ccccc3)c2n1	ZINC000853979505	GG	On-Demand	Anodyne	MTOR	15	47
COc1ccc2c(c1)CC[C@H](NC(=O)NCC1SCCS1)C2	ZINC000853979517	EF	On-Demand	Anodyne	NQO2	26	41
COc1ccc2c(c1)CC[C@H](NC(=O)NCC1SCCS1)C2	ZINC000853979517	EF	On-Demand	Anodyne	MTNR1A	28	44
O=C(Nc1cnn(C(F)F)c1)C(=O)N1CC2CC1(c1ccccc1)C2	ZINC000853979554	EE	On-Demand	Anodyne	ITK	53	35
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	CACNA1H	20	42
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	DRD4	29	44
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	HRH2	17	42
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	KCNH2	15	40
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	SIGMAR1	22	46
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	SSTR5	67	43
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	UTS2R	17	44
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	PDK1	50	38
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	CXCR3	30	42
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	MCHR1	49	46
CON(C)CCNC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000853979685	GF	On-Demand	Anodyne	CACNA1I	59	43
COC(=O)c1cccc(NC[C@@H]2CCN2Cc2ccccc2)n1	ZINC000853979724	DF	On-Demand	Anodyne	SIGMAR1	32	41
COC(=O)c1cccc(NC[C@H]2CCN2Cc2ccccc2)n1	ZINC000853979725	DF	On-Demand	Anodyne	SIGMAR1	32	41
NC(=O)c1cc(Cl)nnc1NC[C@H]1CCN1Cc1ccccc1	ZINC000853979750	ED	On-Demand	Anodyne	ACHE	22	41
NC(=O)c1cc(Cl)nnc1NC[C@H]1CCN1Cc1ccccc1	ZINC000853979750	ED	On-Demand	Anodyne	SIGMAR1	24	40
NC(=O)c1cc(Cl)nnc1NC[C@@H]1CCN1Cc1ccccc1	ZINC000853979751	ED	On-Demand	Anodyne	ACHE	22	41
NC(=O)c1cc(Cl)nnc1NC[C@@H]1CCN1Cc1ccccc1	ZINC000853979751	ED	On-Demand	Anodyne	SIGMAR1	24	40
C#CCNC(=O)c1ccc(N2CCO[C@H](CC(F)(F)F)C2)nc1	ZINC000853979774	ED	On-Demand	Mild	HPGDS	31	46
C#CCNC(=O)c1ccc(N2CCO[C@@H](CC(F)(F)F)C2)nc1	ZINC000853979775	ED	On-Demand	Mild	HPGDS	31	46
COC(=O)Nc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1C	ZINC000853979956	GD	On-Demand	Anodyne	EPHX2	31	42
CCOc1cc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)ccc1C	ZINC000853980208	FD	On-Demand	Anodyne	SSTR5	54	44
CCOc1cc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)ccc1C	ZINC000853980208	FD	On-Demand	Anodyne	EPHX2	30	41
CCSCc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853980348	GE	On-Demand	Anodyne	EPHX2	33	46
O=C1CCC2=C(CCN(C(=O)NCCn3c4ccccc4c4ccccc43)C2)N1	ZINC000853980385	GG	On-Demand	Anodyne	FABI	53	34
CCN(C)C(=O)c1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853980396	GD	On-Demand	Anodyne	EPHX2	26	45
C=COc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853980423	ED	On-Demand	Anodyne	EPHX2	40	41
CCC(C)(C)c1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853980448	GF	On-Demand	Anodyne	EPHX2	40	47
COCCOc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c(C)c1	ZINC000853980466	GD	On-Demand	Anodyne	CCR8	58	32
COCCOc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1F	ZINC000853980485	GD	On-Demand	Anodyne	MET	62	38
CCCCN(C)c1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853980489	GE	On-Demand	Anodyne	EPHX2	30	42
CC(C)(C)OC(=O)NC1(CNC(=O)NCC2CCN(CC3CC3)CC2)CCC1	ZINC000853980528	GF	On-Demand	Anodyne	CACNA1I	72	39
COCCCOc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853980552	GD	On-Demand	Anodyne	CCR3	17	40
COCCCOc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853980552	GD	On-Demand	Anodyne	EPHX2	43	46
CC(C)(C)OC(=O)NC1(CNC(=O)N2CCC(c3ccco3)CC2)CCC1	ZINC000853980578	GH	On-Demand	Anodyne	SMO	17	41
COC(=O)/C=C\c1ccc(N(C)CC2=CCSC2)c([N+](=O)[O-])c1	ZINC000853980587	EF	On-Demand	Clean	NR1H4	40	33
O=C(NCCn1c2ccccc2c2ccccc21)N1CC[C@H](N2CCOC2=O)C1	ZINC000853980690	GG	On-Demand	Anodyne	PLD1	43	42
O=C(NCCn1c2ccccc2c2ccccc21)N1CC[C@H](N2CCOC2=O)C1	ZINC000853980690	GG	On-Demand	Anodyne	PLD2	37	42
O=C(NCCn1c2ccccc2c2ccccc21)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853980691	GG	On-Demand	Anodyne	PLD1	43	42
O=C(NCCn1c2ccccc2c2ccccc21)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853980691	GG	On-Demand	Anodyne	PLD2	37	42
CCCOc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1Cl	ZINC000853980731	GE	On-Demand	Anodyne	EPHX2	36	50
CCc1nc2ccc(NC(=O)C(=O)N3CCC(NC(=O)OC)CC3)cc2s1	ZINC000853980736	GE	On-Demand	Anodyne	EPHX2	22	41
COCCOc1ccc(F)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853980765	GD	On-Demand	Anodyne	CCR3	17	47
CCC(=O)Nc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853980811	GD	On-Demand	Anodyne	EPHX2	41	51
CN(CC1=CCSC1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853980840	CE	On-Demand	Bother	GSTM2	104	43
CN(CC1=CCSC1)c1ccc([N+](=O)[O-])c2nonc12	ZINC000853980840	CE	On-Demand	Bother	GSTP1	65	43
CCN(CC)Cc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853980870	GD	On-Demand	Anodyne	EPHX2	33	46
CCOc1cc(Cl)ccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981002	GE	On-Demand	Anodyne	SSTR5	46	37
CCOc1cc(Cl)ccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981002	GE	On-Demand	Anodyne	EPHX2	25	41
COC(=O)[C@@H]1C[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853981130	EG	On-Demand	Anodyne	CHEK2	28	42
COC(=O)[C@@H]1C[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853981130	EG	On-Demand	Anodyne	CYP11B2	22	40
COC(=O)[C@@H]1C[C@@H](Nc2nc(-c3cccnc3)nc3ccccc23)C1	ZINC000853981130	EG	On-Demand	Anodyne	ABCG2	23	40
CCCOc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981227	FD	On-Demand	Anodyne	FAAH	25	45
CCCOc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981227	FD	On-Demand	Anodyne	EPHX2	49	53
COCCc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981273	FD	On-Demand	Anodyne	CCR8	55	33
CCCNC(=O)c1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981355	GD	On-Demand	Anodyne	DRD4	44	34
CCCNC(=O)c1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981355	GD	On-Demand	Anodyne	EPHX2	30	42
CCCNC(=O)c1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981355	GD	On-Demand	Anodyne	KCNK3	43	33
CC(C)(C)OC(=O)NC1(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)CCC1	ZINC000853981378	GF	On-Demand	Reactive	NMBR	46	30
CN(C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1)[C@H](CO)Cc1ccccc1	ZINC000853981463	GF	On-Demand	Anodyne	PAPA1_CARPA	32	42
CN(C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1)[C@H](CO)Cc1ccccc1	ZINC000853981463	GF	On-Demand	Anodyne	FPR1	44	35
CN(C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1)[C@@H](CO)Cc1ccccc1	ZINC000853981464	GF	On-Demand	Anodyne	PAPA1_CARPA	32	42
CN(C(=O)NCC1(NC(=O)OC(C)(C)C)CCC1)[C@@H](CO)Cc1ccccc1	ZINC000853981464	GF	On-Demand	Anodyne	FPR1	44	35
C#CCOc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981489	FC	On-Demand	Mild	EPHX2	40	40
C#CCOc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981562	FC	On-Demand	Mild	EPHX2	39	46
CCOc1ccc(OC)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981572	GD	On-Demand	Anodyne	SSTR5	51	36
CCOc1ccc(OC)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981572	GD	On-Demand	Anodyne	MTNR1A	16	40
CCOc1ccc(OC)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981572	GD	On-Demand	Anodyne	MTNR1B	20	40
CCOc1ccc(OC)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981572	GD	On-Demand	Anodyne	MCHR1	16	41
CNC(=O)Cc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981599	GC	On-Demand	Anodyne	EPHX2	35	45
COCCOc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981605	GC	On-Demand	Anodyne	CCR8	58	35
C=C(C)COc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981631	GD	On-Demand	Mild	EPHX2	37	40
CCc1ccc(Cl)c(CC)c1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981679	GF	On-Demand	Anodyne	EPHX2	25	41
CCn1c(=O)c(N[C@H](C)CN(C)C(=O)OC(C)(C)C)nc2ccccc21	ZINC000853981712	FG	On-Demand	Anodyne	PYGM	19	40
CCn1c(=O)c(N[C@@H](C)CN(C)C(=O)OC(C)(C)C)nc2ccccc21	ZINC000853981713	FG	On-Demand	Anodyne	PYGM	19	40
CCOC(=O)Nc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981729	GD	On-Demand	Anodyne	EPHX2	42	47
Cn1c(S)nnc1CCNC(=O)N[C@@H]1CCCN(c2cccnc2)C1=O	ZINC000853981731	GC	On-Demand	Anodyne	VCP	52	34
Cn1c(S)nnc1CCNC(=O)N[C@H]1CCCN(c2cccnc2)C1=O	ZINC000853981732	GC	On-Demand	Anodyne	VCP	52	34
CCCNC(=O)c1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981773	GD	On-Demand	Anodyne	EPHX2	37	44
C=CCNC(=O)c1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981774	GC	On-Demand	Mild	EPHX2	30	41
CCSCc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981838	GE	On-Demand	Anodyne	EPHX2	23	45
CCCOc1ccc(Cl)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981845	GE	On-Demand	Anodyne	HTR4	20	42
CCCOc1ccc(Cl)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981845	GE	On-Demand	Anodyne	EPHX2	20	42
CCCOc1ccc(Cl)cc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981845	GE	On-Demand	Anodyne	RBP4	17	41
CCCOc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981846	FD	On-Demand	Anodyne	CCR8	56	35
COCCCOc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853981855	GD	On-Demand	Anodyne	CCR8	51	36
CCc1nc2cc(NC(=O)C(=O)N3CCC(NC(=O)OC)CC3)ccc2o1	ZINC000853981860	FD	On-Demand	Anodyne	SSTR5	31	43
COC(=O)[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000853981895	CD	On-Demand	Bother	CACNA1D	41	31
COC(=O)[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1	ZINC000853981895	CD	On-Demand	Bother	KCNMA1	19	41
COCCOc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981917	GC	On-Demand	Anodyne	EPHX2	47	48
C#Cc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981919	EC	On-Demand	Mild	EPHX2	23	41
COC(=O)[C@@H]1C[C@@H](Nc2nc3ccc([N+](=O)[O-])cc3s2)C1	ZINC000853981921	DF	On-Demand	Bother	CSNK1D	40	37
CNC(=O)c1ccc(C)c(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981931	GC	On-Demand	Anodyne	MAPK11	35	42
CNC(=O)c1ccc(C)c(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853981931	GC	On-Demand	Anodyne	MAPK14	45	42
CCCc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853981962	ED	On-Demand	Anodyne	EPHX2	40	48
CN(CC1=CCSC1)c1nccc(N2CCCC2)n1	ZINC000853982002	CE	On-Demand	Anodyne	SORD	44	36
COC(=O)NCc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853982020	GC	On-Demand	Anodyne	EPHX2	37	46
CCCOc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853982023	FD	On-Demand	Anodyne	CCR3	18	41
CCCOc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853982023	FD	On-Demand	Anodyne	EPHX2	46	46
CCN(CC)Cc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853982118	GD	On-Demand	Anodyne	EPHX2	23	43
COC(=O)[C@@H]1C[C@@H](N=c2nc(-c3ccncc3)[nH]c3ccccc23)C1	ZINC000853982171	EE	On-Demand	Anodyne	NR2E3	51	31
CCC(=O)Nc1ccc(C)c(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853982184	GD	On-Demand	Anodyne	EPHX2	28	42
CCOc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853982236	ED	On-Demand	Anodyne	SSTR5	51	36
CCOc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853982236	ED	On-Demand	Anodyne	CCR8	59	38
CCOc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853982236	ED	On-Demand	Anodyne	HCN1	49	33
CCOc1ccccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853982236	ED	On-Demand	Anodyne	HCN4	42	33
CCCOc1cc(C)ccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853982252	GE	On-Demand	Anodyne	EPHX2	21	42
C=CCOc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853982257	FD	On-Demand	Mild	EPHX2	39	41
COC(=O)Nc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853982267	GD	On-Demand	Anodyne	EPHX2	39	46
CCOc1cc(F)ccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853982277	FD	On-Demand	Anodyne	SSTR5	47	40
CCOc1cc(F)ccc1NC(=O)C(=O)N1CCC(NC(=O)OC)CC1	ZINC000853982277	FD	On-Demand	Anodyne	CCR3	25	41
CC(C)(C)OC(=O)NC1(CNC(=O)N2CCC(c3ccon3)CC2)CCC1	ZINC000853982345	GG	On-Demand	Anodyne	SMO	28	46
CCOc1cc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)ccc1OC	ZINC000853982348	GD	On-Demand	Anodyne	SSTR5	71	46
CCOc1cc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)ccc1OC	ZINC000853982348	GD	On-Demand	Anodyne	EPHX2	28	43
CCOc1cc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)ccc1OC	ZINC000853982348	GD	On-Demand	Anodyne	ENPP1	70	35
CNC(=O)COc1ccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)cc1	ZINC000853982352	GC	On-Demand	Anodyne	EPHX2	41	42
CCSc1cccc(NC(=O)C(=O)N2CCC(NC(=O)OC)CC2)c1	ZINC000853982358	FE	On-Demand	Anodyne	EPHX2	25	46
C#CCOCCNC(=O)NC(C)(C)c1cccc(C#N)c1	ZINC000853982448	CD	On-Demand	Mild	IMDH_CRYPV	47	34
C#CCCN(CCOC)c1cc(C)nc2nc(C(F)(F)F)nn12	ZINC000853982465	ED	On-Demand	Mild	CRHR1	18	44
C#CCOCCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853982612	CC	On-Demand	Mild	CPT1A	45	33
C#CCOCCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853982613	CC	On-Demand	Mild	CPT1A	45	33
C#CCCN(CCOC)c1ncc(C(F)(F)F)cc1Cl	ZINC000853982634	DG	On-Demand	Mild	TRPM8	40	35
C#CCCN(CCOC)c1cc(Cl)nc(C)n1	ZINC000853982670	CD	On-Demand	Mild	CRHR1	17	40
C#CCCN(CCOC)c1ncnc2cc(F)c(OC)cc12	ZINC000853982679	DE	On-Demand	Mild	EGFR	19	41
O=C(NCC[C@@H]1CCOC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853982699	EG	On-Demand	Reactive	CSNK1D	27	40
O=C(NCC[C@H]1CCOC1)NNc1nc2ccc(Cl)cc2s1	ZINC000853982700	EG	On-Demand	Reactive	CSNK1D	27	40
C#CCCN(CCOC)c1ncnc2[nH]ccc12	ZINC000853982739	BD	On-Demand	Mild	JAK3	20	41
C#CCCN(CCOC)c1cc(Cl)nc2cc(C)nn12	ZINC000853982759	CE	On-Demand	Mild	CRHR1	15	41
CC(=O)c1ccc(N[C@H](C)CN(C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000853982837	FG	On-Demand	Bother	TAAR1	17	41
CC(=O)c1ccc(N[C@@H](C)CN(C)C(=O)OC(C)(C)C)c([N+](=O)[O-])c1	ZINC000853982839	FG	On-Demand	Bother	TAAR1	17	41
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	ADORA1	126	53
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	SLC29A1	125	51
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	ADORA2A	45	52
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	ADK	36	52
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	AHCY	41	43
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	P2RX4	34	41
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	P2RX1	45	39
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	P2RY1	31	41
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	AMD1	40	45
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	GAPDH	19	40
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	ADORA3	92	52
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	OXGR1	110	39
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	DNMT3B	55	35
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	PANC	32	40
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	Q4VQ11_PIG	59	47
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	GPR17	43	37
C#CCCN(CCOC)c1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O	ZINC000853982939	GA	On-Demand	Mild	DOT1L	80	36
C#CCCN(CCOC)C(=O)NCC1(c2ccc(OC)cc2)CCC1	ZINC000853982956	EF	On-Demand	Mild	KCNA3	40	33
C#CCCN(CCOC)c1cc(C)nc(C)n1	ZINC000853982984	BD	On-Demand	Mild	CRHR1	19	42
C#CCCN(CCOC)c1nc(C)nc2c1cnn2C	ZINC000853983003	CD	On-Demand	Mild	CRHR1	17	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853983026	EC	On-Demand	Anodyne	CACNA1I	49	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853983026	EC	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853983027	EC	On-Demand	Anodyne	CACNA1I	49	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@H]2CCC(=O)N2)C1	ZINC000853983027	EC	On-Demand	Anodyne	GPR119	30	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)C1	ZINC000853983028	GE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCCC[C@H]2c2nc[nH]n2)C1	ZINC000853983029	GE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)C1	ZINC000853983030	GE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCCC[C@@H]2c2nc[nH]n2)C1	ZINC000853983031	GE	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCC(n3cnnc3O)CC2)C1	ZINC000853983038	GD	On-Demand	Anodyne	CACNA1I	42	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCC(n3cnnc3O)CC2)C1	ZINC000853983039	GD	On-Demand	Anodyne	CACNA1I	42	33
O[C@H]1C[C@H](Nc2nc(C(F)(F)F)nc3ccccc23)C1	ZINC000853983045	CF	On-Demand	Anodyne	CHEK2	20	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2CCCC[C@H]2C#N)C1	ZINC000853983062	FF	On-Demand	Mild	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2CCCC[C@@H]2C#N)C1	ZINC000853983065	FF	On-Demand	Mild	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2CCCC[C@H]2C#N)C1	ZINC000853983068	FF	On-Demand	Mild	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2CCCC[C@@H]2C#N)C1	ZINC000853983071	FF	On-Demand	Mild	CACNA1I	40	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H](O)C(F)(F)C2)C1	ZINC000853983088	FD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](O)C(F)(F)C2)C1	ZINC000853983090	FD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H](O)C(F)(F)C2)C1	ZINC000853983092	FD	On-Demand	Anodyne	CACNA1I	42	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](O)C(F)(F)C2)C1	ZINC000853983095	FD	On-Demand	Anodyne	CACNA1I	42	32
C#CCOCCNC(=O)NCC[C@@H](C)N(C)C	ZINC000853983124	BC	On-Demand	Mild	CHRNA4	21	42
C#CCOCCNC(=O)NCC[C@H](C)N(C)C	ZINC000853983127	BC	On-Demand	Mild	CHRNA4	21	42
Cn1nc(Br)c2c(N[C@H]3C[C@H](O)C3)ncnc21	ZINC000853983146	CD	On-Demand	Anodyne	ADORA1	17	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853983148	GG	On-Demand	Reactive	CACNA1H	25	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853983148	GG	On-Demand	Reactive	CACNA1I	91	45
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853983148	GG	On-Demand	Reactive	GPR119	32	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853983152	GG	On-Demand	Reactive	CACNA1H	25	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853983152	GG	On-Demand	Reactive	CACNA1I	91	45
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NNc2cc(F)cc(Cl)c2)C1	ZINC000853983152	GG	On-Demand	Reactive	GPR119	32	44
COc1cc(Br)ccc1CCCNC(=O)NCCN(C)OC	ZINC000853983200	FE	On-Demand	Anodyne	MTNR1A	34	42
COc1cc(Br)ccc1CCCNC(=O)NCCN(C)OC	ZINC000853983200	FE	On-Demand	Anodyne	MTNR1B	31	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC(O)(C2CC2)C2CC2)C1	ZINC000853983212	FE	On-Demand	Anodyne	CACNA1I	47	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC(O)(C2CC2)C2CC2)C1	ZINC000853983216	FE	On-Demand	Anodyne	CACNA1I	47	35
C#CCOCCNC(=O)N(C)[C@H](CO)Cc1ccccc1	ZINC000853983239	CC	On-Demand	Mild	NPY5R	16	42
C#CCOCCNC(=O)N(C)[C@@H](CO)Cc1ccccc1	ZINC000853983241	CC	On-Demand	Mild	NPY5R	16	42
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000853983306	GG	On-Demand	Anodyne	DRD4	17	41
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000853983307	GG	On-Demand	Anodyne	DRD4	17	41
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000853983308	GG	On-Demand	Anodyne	DRD4	17	41
O=C(N[C@@H]1C[C@H](O)c2ccccc21)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000853983309	GG	On-Demand	Anodyne	DRD4	17	41
COCCN(CCF)C(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000853983318	FF	On-Demand	Anodyne	CACNA1B	15	44
COCCN(CCF)C(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC000853983319	FF	On-Demand	Anodyne	CACNA1B	15	44
COCCN(CCF)C(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000853983320	FF	On-Demand	Anodyne	CACNA1B	15	44
COCCN(CCF)C(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC000853983321	FF	On-Demand	Anodyne	CACNA1B	15	44
C=CCC1(NC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCCC1	ZINC000853983366	FG	On-Demand	Mild	CACNA1I	41	35
C=CCC1(NC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CCCC1	ZINC000853983367	FG	On-Demand	Mild	CACNA1I	41	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)C2)C1	ZINC000853983380	DD	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)C2)C1	ZINC000853983380	DD	On-Demand	Anodyne	CACNA1I	46	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2C[C@H](O)C2)C1	ZINC000853983381	DD	On-Demand	Anodyne	EPHX2	15	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2C[C@H](O)C2)C1	ZINC000853983381	DD	On-Demand	Anodyne	CACNA1I	46	35
CC[C@@H](O)CNC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983388	DD	On-Demand	Anodyne	CACNA1I	58	35
CC[C@@H](O)CNC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983388	DD	On-Demand	Anodyne	GPR119	28	42
CC[C@@H](O)CNC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983389	DD	On-Demand	Anodyne	CACNA1I	58	35
CC[C@@H](O)CNC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983389	DD	On-Demand	Anodyne	GPR119	28	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC(C)(C2CC2)C2CC2)C1	ZINC000853983393	FG	On-Demand	Anodyne	CACNA1I	48	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC(C)(C2CC2)C2CC2)C1	ZINC000853983394	FG	On-Demand	Anodyne	CACNA1I	48	36
Cc1nc(N[C@H](C)CN(C)C(=O)OC(C)(C)C)cc(-c2cccnc2)n1	ZINC000853983459	FH	On-Demand	Anodyne	ROS1	41	35
Cc1nc(N[C@@H](C)CN(C)C(=O)OC(C)(C)C)cc(-c2cccnc2)n1	ZINC000853983460	FH	On-Demand	Anodyne	ROS1	41	35
O=C(NCCSCc1ccnc(Cl)c1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853983569	GH	On-Demand	Anodyne	EPHX2	20	46
C#CCOCCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853983595	DC	On-Demand	Mild	L3MBTL3	43	36
C#CCOCCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853983597	DC	On-Demand	Mild	L3MBTL3	43	36
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N[C@@]1(c2ccccc2)CC1(C)C	ZINC000853983598	GF	On-Demand	Anodyne	AKR1C2	40	34
COC(=O)c1cc(OC)ccc1NC(=O)C(=O)N[C@]1(c2ccccc2)CC1(C)C	ZINC000853983600	GF	On-Demand	Anodyne	AKR1C2	40	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@H](CO)CC2CC2)C1	ZINC000853983614	FD	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@H](CO)CC2CC2)C1	ZINC000853983614	FD	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@H](CO)CC2CC2)C1	ZINC000853983615	FD	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@H](CO)CC2CC2)C1	ZINC000853983615	FD	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@H](CO)CC2CC2)C1	ZINC000853983616	FD	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@H](CO)CC2CC2)C1	ZINC000853983616	FD	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@H](CO)CC2CC2)C1	ZINC000853983617	FD	On-Demand	Anodyne	CACNA1I	46	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@H](CO)CC2CC2)C1	ZINC000853983617	FD	On-Demand	Anodyne	GPR119	23	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCCCc2nc[nH]n2)C1	ZINC000853983620	FD	On-Demand	Anodyne	CACNA1I	43	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCCCc2nc[nH]n2)C1	ZINC000853983621	FD	On-Demand	Anodyne	CACNA1I	43	34
CN(C)CCC[C@@H]1CN(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCO1	ZINC000853983652	GD	On-Demand	Anodyne	GPR119	23	42
CN(C)CCC[C@@H]1CN(C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CCO1	ZINC000853983653	GD	On-Demand	Anodyne	GPR119	23	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853983658	EF	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2C[C@@H]3CCCC[C@@H]32)C1	ZINC000853983659	EF	On-Demand	Anodyne	CACNA1I	47	34
C#CCOCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853983661	DD	On-Demand	Mild	MTNR1A	36	41
C#CCOCCNC(=O)N[C@@H](COC)c1cccc(OC)c1	ZINC000853983661	DD	On-Demand	Mild	MTNR1B	35	41
C#CCOCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853983662	DD	On-Demand	Mild	MTNR1A	36	41
C#CCOCCNC(=O)N[C@H](COC)c1cccc(OC)c1	ZINC000853983662	DD	On-Demand	Mild	MTNR1B	35	41
CC[C@H](C)N(CC)C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983668	EG	On-Demand	Anodyne	CACNA1I	43	34
CC[C@H](C)N(CC)C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983668	EG	On-Demand	Anodyne	GPR119	27	42
CC[C@H](C)N(CC)C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983670	EG	On-Demand	Anodyne	CACNA1I	43	34
CC[C@H](C)N(CC)C(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853983670	EG	On-Demand	Anodyne	GPR119	27	42
C#CCOCCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853983676	CD	On-Demand	Mild	EPHX2	19	46
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(S(C)(=O)=O)C2)C1	ZINC000853983682	FC	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC(S(C)(=O)=O)C2)C1	ZINC000853983682	FC	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(S(C)(=O)=O)C2)C1	ZINC000853983683	FC	On-Demand	Anodyne	CACNA1I	43	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC(S(C)(=O)=O)C2)C1	ZINC000853983683	FC	On-Demand	Anodyne	GPR119	42	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC3CC2(C)C3)C1	ZINC000853983689	DE	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC3CC2(C)C3)C1	ZINC000853983690	DE	On-Demand	Anodyne	CACNA1I	41	32
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853983694	FD	On-Demand	Anodyne	CACNA1I	42	34
COC(=O)[C@@H]1C[C@@H](NC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853983695	FD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC2CCC(O)CC2)C1	ZINC000853983696	FE	On-Demand	Anodyne	CACNA1I	56	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC2CCC(O)CC2)C1	ZINC000853983697	FE	On-Demand	Anodyne	CACNA1I	56	37
O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCC1CCN(CC2CC2)CC1	ZINC000853983797	EG	On-Demand	Bother	SIGMAR1	15	51
Fc1cccc2oc(NCC3CCN(CC4CC4)CC3)nc12	ZINC000853983874	DH	On-Demand	Anodyne	SIGMAR1	19	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)C1	ZINC000853983926	FE	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2[C@H]3CC[C@H]2CC(=O)C3)C1	ZINC000853983927	FE	On-Demand	Anodyne	CACNA1I	47	34
CCN1CC[C@H](N(CC)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853983932	FE	On-Demand	Anodyne	CACNA1I	51	34
CCN1CC[C@H](N(CC)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853983933	FE	On-Demand	Anodyne	CACNA1I	51	34
CCN1CC[C@@H](N(CC)C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853983934	FE	On-Demand	Anodyne	CACNA1I	51	34
CCN1CC[C@@H](N(CC)C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1	ZINC000853983935	FE	On-Demand	Anodyne	CACNA1I	51	34
COC(=O)[C@@H]1CCN(C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H]1C	ZINC000853983969	GE	On-Demand	Anodyne	CACNA1I	47	34
COC(=O)[C@@H]1CCN(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C[C@@H]1C	ZINC000853983971	GE	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853983987	GE	On-Demand	Anodyne	CACNA1I	64	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853983989	GE	On-Demand	Anodyne	CACNA1I	64	38
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853983991	GE	On-Demand	Anodyne	CACNA1I	64	38
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@H]2CC(=O)N(C(C)(C)C)C2)C1	ZINC000853983993	GE	On-Demand	Anodyne	CACNA1I	64	38
COC(=O)Nc1cccc(NC(=O)C(=O)N[C@]2(c3ccccc3)CC2(C)C)c1	ZINC000853984005	GG	On-Demand	Anodyne	KCNK3	77	37
COC(=O)Nc1cccc(NC(=O)C(=O)N[C@]2(c3ccccc3)CC2(C)C)c1	ZINC000853984005	GG	On-Demand	Anodyne	KCNK9	50	37
COC(=O)Nc1cccc(NC(=O)C(=O)N[C@@]2(c3ccccc3)CC2(C)C)c1	ZINC000853984007	GG	On-Demand	Anodyne	KCNK3	77	37
COC(=O)Nc1cccc(NC(=O)C(=O)N[C@@]2(c3ccccc3)CC2(C)C)c1	ZINC000853984007	GG	On-Demand	Anodyne	KCNK9	50	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853984033	GF	On-Demand	Anodyne	CACNA1I	51	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853984033	GF	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853984035	GF	On-Demand	Anodyne	CACNA1I	51	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853984035	GF	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853984037	GF	On-Demand	Anodyne	CACNA1I	51	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2CCc3ccc(O)cc32)C1	ZINC000853984037	GF	On-Demand	Anodyne	GPR119	37	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853984039	GF	On-Demand	Anodyne	CACNA1I	51	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2CCc3ccc(O)cc32)C1	ZINC000853984039	GF	On-Demand	Anodyne	GPR119	37	42
C[C@H]1CN(c2ccc(NC(=O)C(=O)N[C@H]3CCNC3=O)cc2F)C[C@H](C)O1	ZINC000853984043	GC	On-Demand	Anodyne	NPY2R	41	33
C[C@H]1CN(c2ccc(NC(=O)C(=O)N[C@H]3CCNC3=O)cc2F)C[C@H](C)O1	ZINC000853984043	GC	On-Demand	Anodyne	ENV	43	36
COc1cc(NCC2CCN(CC3CC3)CC2)c([N+](=O)[O-])cc1OC	ZINC000853984107	EG	On-Demand	Bother	HTR4	22	44
FC(F)(F)c1nnc2ccc(NCC3CCN(CC4CC4)CC3)nn12	ZINC000853984160	FF	On-Demand	Anodyne	IKBKB	17	42
FC(F)(F)c1nnc2ccc(NCC3CCN(CC4CC4)CC3)nn12	ZINC000853984160	FF	On-Demand	Anodyne	PIM1	17	53
O[C@H](CNc1nccc(N[C@@H]2CCCOC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853984184	FF	On-Demand	Anodyne	MAPK1	48	35
O[C@@H](CNc1nccc(N[C@H]2CCCOC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853984185	FF	On-Demand	Anodyne	MAPK1	48	35
O[C@@H](CNc1nccc(N[C@@H]2CCCOC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853984186	FF	On-Demand	Anodyne	MAPK1	48	35
O[C@H](CNc1nccc(N[C@H]2CCCOC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853984187	FF	On-Demand	Anodyne	MAPK1	48	35
Nc1nc(Cl)cc(NCC2CCN(CC3CC3)CC2)n1	ZINC000853984210	CE	On-Demand	Anodyne	HRH4	21	49
Nc1nc(Cl)cc(NCC2CCN(CC3CC3)CC2)n1	ZINC000853984210	CE	On-Demand	Anodyne	CACNA1I	48	36
C=CCCC(C)(C)NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853984290	EG	On-Demand	Mild	CACNA1I	43	35
C=CCCC(C)(C)NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853984292	EG	On-Demand	Mild	CACNA1I	43	35
O[C@H]1C[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853984326	CG	On-Demand	Anodyne	CHEK1	16	43
O[C@H]1C[C@H](Nc2ncnc3sc(-c4ccccc4)cc23)C1	ZINC000853984326	CG	On-Demand	Anodyne	CD38	55	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853984330	GF	On-Demand	Anodyne	CACNA1I	67	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@H](O)c3ccccc32)C1	ZINC000853984330	GF	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853984331	GF	On-Demand	Anodyne	CACNA1I	67	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853984331	GF	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853984332	GF	On-Demand	Anodyne	CACNA1I	67	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2C[C@@H](O)c3ccccc32)C1	ZINC000853984332	GF	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853984333	GF	On-Demand	Anodyne	CACNA1I	67	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2C[C@H](O)c3ccccc32)C1	ZINC000853984333	GF	On-Demand	Anodyne	GPR119	37	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@]2(C)CC2(C)C)C1	ZINC000853984357	EF	On-Demand	Anodyne	CACNA1I	55	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@]2(C)CC2(C)C)C1	ZINC000853984358	EF	On-Demand	Anodyne	CACNA1I	55	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@]2(C)CC2(C)C)C1	ZINC000853984359	EF	On-Demand	Anodyne	CACNA1I	55	37
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@]2(C)CC2(C)C)C1	ZINC000853984360	EF	On-Demand	Anodyne	CACNA1I	55	37
CC[C@@](C)(NC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)C1CC1	ZINC000853984362	EG	On-Demand	Anodyne	CACNA1I	43	34
CC[C@@](C)(NC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C1CC1	ZINC000853984363	EG	On-Demand	Anodyne	CACNA1I	43	34
CON(C)CCNC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853984367	ED	On-Demand	Anodyne	CACNA1I	47	35
CON(C)CCNC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853984368	ED	On-Demand	Anodyne	CACNA1I	47	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCC(CO)(CO)C2)C1	ZINC000853984372	FC	On-Demand	Anodyne	CACNA1I	40	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCC(CO)(CO)C2)C1	ZINC000853984373	FC	On-Demand	Anodyne	CACNA1I	40	31
C[C@@H](CCNC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853984381	ED	On-Demand	Anodyne	CACNA1I	43	34
C[C@@H](CCNC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853984381	ED	On-Demand	Anodyne	GPR119	25	41
C[C@@H](CCNC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853984383	ED	On-Demand	Anodyne	CACNA1I	43	34
C[C@@H](CCNC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1)N(C)C	ZINC000853984383	ED	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC2CC(CO)C2)C1	ZINC000853984386	ED	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC2CC(CO)C2)C1	ZINC000853984387	ED	On-Demand	Anodyne	CACNA1I	42	34
CN(C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](CO)Cc1ccccc1	ZINC000853984391	GE	On-Demand	Anodyne	CACNA1I	48	33
CN(C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@H](CO)Cc1ccccc1	ZINC000853984391	GE	On-Demand	Anodyne	GPR119	30	43
CN(C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](CO)Cc1ccccc1	ZINC000853984392	GE	On-Demand	Anodyne	CACNA1I	48	33
CN(C(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](CO)Cc1ccccc1	ZINC000853984392	GE	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)C1	ZINC000853984393	FD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)C1	ZINC000853984394	FD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC[C@]2(O)C[C@H]3C=C[C@H]2C3)C1	ZINC000853984395	FD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC[C@@]2(O)C[C@H]3C=C[C@H]2C3)C1	ZINC000853984396	FD	On-Demand	Anodyne	CACNA1I	42	34
O[C@H]1C[C@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853984399	BD	On-Demand	Anodyne	MAPK9	33	45
O[C@H]1C[C@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853984399	BD	On-Demand	Anodyne	SORD	68	39
O[C@H]1C[C@H](Nc2nccc(N3CCCC3)n2)C1	ZINC000853984399	BD	On-Demand	Anodyne	MAPK8	37	45
COc1ccc2c(NC3CC(CO)C3)ccnc2c1	ZINC000853984425	CE	On-Demand	Anodyne	HRP1_PLAFA	62	40
COc1ccc2c(NC3CC(CO)C3)ccnc2c1	ZINC000853984425	CE	On-Demand	Anodyne	KDR	29	40
COc1ccc2c(NC3CC(CO)C3)ccnc2c1	ZINC000853984425	CE	On-Demand	Anodyne	PDGFRA	45	38
O[C@H](CNc1ncnc2c1ncn2C1CC1)c1cc(F)c(F)c(F)c1	ZINC000853984458	EF	On-Demand	Anodyne	ADORA1	53	43
O[C@H](CNc1ncnc2c1ncn2C1CC1)c1cc(F)c(F)c(F)c1	ZINC000853984458	EF	On-Demand	Anodyne	ADORA3	58	42
O[C@@H](CNc1ncnc2c1ncn2C1CC1)c1cc(F)c(F)c(F)c1	ZINC000853984459	EF	On-Demand	Anodyne	ADORA1	53	43
O[C@@H](CNc1ncnc2c1ncn2C1CC1)c1cc(F)c(F)c(F)c1	ZINC000853984459	EF	On-Demand	Anodyne	ADORA3	58	42
COC(=O)c1cccc(NCC2CCN(CC3CC3)CC2)n1	ZINC000853984503	DE	On-Demand	Anodyne	HTR4	54	40
COC(=O)c1cccc(NCC2CCN(CC3CC3)CC2)n1	ZINC000853984503	DE	On-Demand	Anodyne	CACNA1I	53	35
COC(=O)c1cccc(NCC2CCN(CC3CC3)CC2)n1	ZINC000853984503	DE	On-Demand	Anodyne	VCP	43	36
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](O)C2)c2nonc12	ZINC000853984601	CD	On-Demand	Bother	GSTM2	124	44
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](O)C2)c2nonc12	ZINC000853984601	CD	On-Demand	Bother	GSTP1	76	44
O=[N+]([O-])c1ccc(N[C@H]2C[C@H](O)C2)c2nonc12	ZINC000853984601	CD	On-Demand	Bother	EPAS1	55	33
C#CCOCCNC(=O)NC1(c2cccc(OC)c2)CCC1	ZINC000853984661	DE	On-Demand	Mild	DRD4	40	31
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984665	GG	On-Demand	Anodyne	CHRM3	16	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984665	GG	On-Demand	Anodyne	EPHX2	30	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984665	GG	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984665	GG	On-Demand	Anodyne	CCR8	18	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984665	GG	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984665	GG	On-Demand	Anodyne	SFRP1	34	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984665	GG	On-Demand	Anodyne	WNT3	42	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984667	GG	On-Demand	Anodyne	CHRM3	16	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984667	GG	On-Demand	Anodyne	EPHX2	30	44
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984667	GG	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984667	GG	On-Demand	Anodyne	CCR8	18	40
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984667	GG	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984667	GG	On-Demand	Anodyne	SFRP1	34	41
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](Oc3ccccc3)C2)C1	ZINC000853984667	GG	On-Demand	Anodyne	WNT3	42	34
CN1C[C@@H](CNC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984683	FD	On-Demand	Anodyne	CACNA1I	58	39
CN1C[C@@H](CNC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984683	FD	On-Demand	Anodyne	GPR119	31	40
CN1C[C@H](CNC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984685	FD	On-Demand	Anodyne	CACNA1I	58	39
CN1C[C@H](CNC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984685	FD	On-Demand	Anodyne	GPR119	31	40
CN1C[C@@H](CNC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984687	FD	On-Demand	Anodyne	CACNA1I	58	39
CN1C[C@@H](CNC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984687	FD	On-Demand	Anodyne	GPR119	31	40
CN1C[C@H](CNC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984688	FD	On-Demand	Anodyne	CACNA1I	58	39
CN1C[C@H](CNC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CC1=O	ZINC000853984688	FD	On-Demand	Anodyne	GPR119	31	40
Cc1ccc(CC2CN(C(=O)NC[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984712	GG	On-Demand	Anodyne	GRIN2B	26	43
Cc1ccc(CC2CN(C(=O)NC[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984712	GG	On-Demand	Anodyne	CCR3	17	44
Cc1ccc(CC2CN(C(=O)NC[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984712	GG	On-Demand	Anodyne	CACNA1I	66	42
Cc1ccc(CC2CN(C(=O)NC[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984712	GG	On-Demand	Anodyne	GPR119	45	47
Cc1ccc(CC2CN(C(=O)NC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984715	GG	On-Demand	Anodyne	GRIN2B	26	43
Cc1ccc(CC2CN(C(=O)NC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984715	GG	On-Demand	Anodyne	CCR3	17	44
Cc1ccc(CC2CN(C(=O)NC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984715	GG	On-Demand	Anodyne	CACNA1I	66	42
Cc1ccc(CC2CN(C(=O)NC[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC000853984715	GG	On-Demand	Anodyne	GPR119	45	47
C#CCOCCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853984721	EC	On-Demand	Mild	HRH2	21	41
C#CCOCCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853984723	EC	On-Demand	Mild	HRH2	21	41
COCC1(NC(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCCC1	ZINC000853984782	FF	On-Demand	Anodyne	CACNA1I	42	37
COCC1(NC(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CCCC1	ZINC000853984783	FF	On-Demand	Anodyne	CACNA1I	42	37
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC2(O)CCC(F)(F)CC2)C1	ZINC000853984798	GE	On-Demand	Anodyne	CACNA1I	59	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NCC2(O)CCC(F)(F)CC2)C1	ZINC000853984798	GE	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC2(O)CCC(F)(F)CC2)C1	ZINC000853984799	GE	On-Demand	Anodyne	CACNA1I	59	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NCC2(O)CCC(F)(F)CC2)C1	ZINC000853984799	GE	On-Demand	Anodyne	GPR119	32	40
Cc1cc(N2CCc3c(cccc3C(N)=O)C2)nc(N)n1	ZINC000853984809	CD	On-Demand	Anodyne	HRH4	24	47
CC(=O)c1c(F)cccc1NCC1CCN(CC2CC2)CC1	ZINC000853984857	DH	On-Demand	Anodyne	HTR4	46	39
CC(=O)c1c(F)cccc1NCC1CCN(CC2CC2)CC1	ZINC000853984857	DH	On-Demand	Anodyne	SIGMAR1	17	45
CC(=O)c1c(F)cccc1NCC1CCN(CC2CC2)CC1	ZINC000853984857	DH	On-Demand	Anodyne	CCR3	46	37
CC(=O)c1c(F)cccc1NCC1CCN(CC2CC2)CC1	ZINC000853984857	DH	On-Demand	Anodyne	CACNA1I	54	35
Fc1cccc(NCC2CCN(CC3CC3)CC2)n1	ZINC000853984865	CF	On-Demand	Anodyne	SIGMAR1	15	44
COCCc1nsc(N2CCc3c(cccc3C(N)=O)C2)n1	ZINC000853984923	DD	On-Demand	Anodyne	BCL2L1	40	31
O=C(NCCSCc1ccnc(Cl)c1)NCC1CCN(CC2CC2)CC1	ZINC000853984964	GG	On-Demand	Anodyne	CACNA1I	61	36
CO[C@H]1Cc2ccc(NC(=O)C(=O)N[C@]3(c4ccccc4)CC3(C)C)cc2C1	ZINC000853984968	GG	On-Demand	Anodyne	FSHR	40	35
CO[C@H]1Cc2ccc(NC(=O)C(=O)N[C@@]3(c4ccccc4)CC3(C)C)cc2C1	ZINC000853984969	GG	On-Demand	Anodyne	FSHR	40	35
O=C(NCCSCc1ccnc(Cl)c1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853984995	GG	On-Demand	Anodyne	CPT1A	45	33
O=C(NCCSCc1ccnc(Cl)c1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853984996	GG	On-Demand	Anodyne	CPT1A	45	33
CN1CCN(C(=O)NC[C@H]2CCN(C(=O)OC(C)(C)C)C2)CCC1=O	ZINC000853985008	FD	On-Demand	Anodyne	CACNA1I	51	36
CN1CCN(C(=O)NC[C@@H]2CCN(C(=O)OC(C)(C)C)C2)CCC1=O	ZINC000853985009	FD	On-Demand	Anodyne	CACNA1I	51	36
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC/C=C/CO)C1	ZINC000853985017	DD	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC/C=C\CO)C1	ZINC000853985018	DD	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC/C=C\CO)C1	ZINC000853985019	DD	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC/C=C/CO)C1	ZINC000853985020	DD	On-Demand	Anodyne	CACNA1I	43	35
COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H](C)N3CCCCC3)C2)cc1	ZINC000853985023	FF	On-Demand	Clean	MTNR1A	21	44
COc1ccc(N2CC[C@H](NC(=O)NCC[C@@H](C)N3CCCCC3)C2)cc1	ZINC000853985023	FF	On-Demand	Clean	MTNR1B	18	44
COc1ccc(N2CC[C@H](NC(=O)NCC[C@H](C)N3CCCCC3)C2)cc1	ZINC000853985025	FF	On-Demand	Clean	MTNR1A	21	44
COc1ccc(N2CC[C@H](NC(=O)NCC[C@H](C)N3CCCCC3)C2)cc1	ZINC000853985025	FF	On-Demand	Clean	MTNR1B	18	44
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N(CCC2CC2)CC2CC2)C1	ZINC000853985040	FG	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N(CCC2CC2)CC2CC2)C1	ZINC000853985042	FG	On-Demand	Anodyne	CACNA1I	47	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)C1	ZINC000853985053	ED	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@]3(O)C[C@H]3C2)C1	ZINC000853985056	ED	On-Demand	Anodyne	CACNA1I	46	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2COc3cc(F)ccc3C2)C1	ZINC000853985065	GF	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@@H]2COc3cc(F)ccc3C2)C1	ZINC000853985065	GF	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2COc3cc(F)ccc3C2)C1	ZINC000853985068	GF	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2COc3cc(F)ccc3C2)C1	ZINC000853985068	GF	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2COc3cc(F)ccc3C2)C1	ZINC000853985070	GF	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2COc3cc(F)ccc3C2)C1	ZINC000853985070	GF	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2COc3cc(F)ccc3C2)C1	ZINC000853985072	GF	On-Demand	Anodyne	CACNA1I	43	35
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N[C@H]2COc3cc(F)ccc3C2)C1	ZINC000853985072	GF	On-Demand	Anodyne	GPR119	33	43
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853985114	GF	On-Demand	Reactive	CACNA1I	52	33
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853985114	GF	On-Demand	Reactive	GPR119	44	41
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853985116	GF	On-Demand	Reactive	CACNA1I	52	33
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)C1	ZINC000853985116	GF	On-Demand	Reactive	GPR119	44	41
C[C@@H](CCNC(=O)N1CC[C@H](N2CCOC2=O)C1)N1CCCCC1	ZINC000853985120	ED	On-Demand	Anodyne	CCR5	22	40
C[C@@H](CCNC(=O)N1CC[C@@H](N2CCOC2=O)C1)N1CCCCC1	ZINC000853985124	ED	On-Demand	Anodyne	CCR5	22	40
Cn1c(S)nnc1CCNC(=O)NC[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853985150	GD	On-Demand	Anodyne	CACNA1I	42	34
Cn1c(S)nnc1CCNC(=O)NC[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000853985152	GD	On-Demand	Anodyne	CACNA1I	42	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)NC(C)(C)c2cccc(C#N)c2)C1	ZINC000853985170	GG	On-Demand	Mild	CACNA1I	55	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)NC(C)(C)c2cccc(C#N)c2)C1	ZINC000853985172	GG	On-Demand	Mild	CACNA1I	55	36
COC(=O)c1ccc(C(F)(F)F)nc1NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853985244	GG	On-Demand	Anodyne	TRPV1	85	35
COC(=O)c1ccc(C(F)(F)F)nc1NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853985245	GG	On-Demand	Anodyne	TRPV1	85	35
O[C@H](CNc1nccc(N2CCOCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985252	FD	On-Demand	Anodyne	SORD	41	33
O[C@H](CNc1nccc(N2CCOCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985252	FD	On-Demand	Anodyne	EPHB4	66	34
O[C@H](CNc1nccc(N2CCOCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985252	FD	On-Demand	Anodyne	STAT6	44	34
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985253	FD	On-Demand	Anodyne	SORD	41	33
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985253	FD	On-Demand	Anodyne	EPHB4	66	34
O[C@@H](CNc1nccc(N2CCOCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985253	FD	On-Demand	Anodyne	STAT6	44	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CCC(O)(CO)CC2)C1	ZINC000853985262	FC	On-Demand	Anodyne	CACNA1I	41	32
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CCC(O)(CO)CC2)C1	ZINC000853985264	FC	On-Demand	Anodyne	CACNA1I	41	32
O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NCC1CCN(CC2CC2)CC1	ZINC000853985265	FG	On-Demand	Bother	HTR4	28	41
O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NCC1CCN(CC2CC2)CC1	ZINC000853985265	FG	On-Demand	Bother	CACNA1I	41	33
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CC(OC)C2)cc1	ZINC000853985267	FD	On-Demand	Anodyne	ADRB2	34	55
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CC(OC)C2)cc1	ZINC000853985267	FD	On-Demand	Anodyne	ADRB1	69	55
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2CC(OC)C2)cc1	ZINC000853985267	FD	On-Demand	Anodyne	ADRB3	43	42
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CC(OC)C2)cc1	ZINC000853985269	FD	On-Demand	Anodyne	ADRB2	34	55
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CC(OC)C2)cc1	ZINC000853985269	FD	On-Demand	Anodyne	ADRB1	69	55
COCCc1ccc(OC[C@H](O)CNC(=O)NC2CC(OC)C2)cc1	ZINC000853985269	FD	On-Demand	Anodyne	ADRB3	43	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2[C@@H]3c4ccc(F)cc4C[C@H]32)C1	ZINC000853985270	GG	On-Demand	Anodyne	CACNA1I	66	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@H]2[C@@H]3c4ccc(F)cc4C[C@H]32)C1	ZINC000853985270	GG	On-Demand	Anodyne	GPR119	31	44
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853985272	GG	On-Demand	Anodyne	CACNA1I	66	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853985272	GG	On-Demand	Anodyne	GPR119	31	44
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853985274	GG	On-Demand	Anodyne	CACNA1I	66	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]32)C1	ZINC000853985274	GG	On-Demand	Anodyne	GPR119	31	44
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@H]32)C1	ZINC000853985277	GG	On-Demand	Anodyne	CACNA1I	66	36
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N[C@@H]2[C@H]3Cc4cc(F)ccc4[C@H]32)C1	ZINC000853985277	GG	On-Demand	Anodyne	GPR119	31	44
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853985282	GD	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853985282	GD	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853985284	GD	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@@H](CN3CCCC3=O)C2)C1	ZINC000853985284	GD	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853985287	GD	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC[C@H](CNC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853985287	GD	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853985289	GD	On-Demand	Anodyne	CACNA1I	55	34
CC(C)(C)OC(=O)N1CC[C@@H](CNC(=O)N2CC[C@H](CN3CCCC3=O)C2)C1	ZINC000853985289	GD	On-Demand	Anodyne	GPR119	32	42
Cc1csc([C@H](C)CNC(=O)NNc2nc3ccc(Cl)cc3s2)n1	ZINC000853985318	GI	On-Demand	Reactive	CSNK1D	38	43
NC(=O)c1cc(Cl)nnc1NCC1CCN(CC2CC2)CC1	ZINC000853985327	DD	On-Demand	Anodyne	HTR4	43	42
NC(=O)c1cc(Cl)nnc1NCC1CCN(CC2CC2)CC1	ZINC000853985327	DD	On-Demand	Anodyne	CACNA1I	63	38
NC(=O)c1cc(Cl)nnc1NCC1CCN(CC2CC2)CC1	ZINC000853985327	DD	On-Demand	Anodyne	SIRT3	40	36
CC(=O)c1ccc(C(F)(F)F)nc1NC[C@@H](O)c1cc(F)c(F)c(F)c1	ZINC000853985406	GH	On-Demand	Anodyne	TRPV1	84	36
CC(=O)c1ccc(C(F)(F)F)nc1NC[C@H](O)c1cc(F)c(F)c(F)c1	ZINC000853985407	GH	On-Demand	Anodyne	TRPV1	84	36
COC(=O)NCc1ccc(NC(=O)C(=O)N[C@@]2(c3ccccc3)CC2(C)C)cc1	ZINC000853985408	GF	On-Demand	Anodyne	PDS	44	33
COC(=O)NCc1ccc(NC(=O)C(=O)N[C@]2(c3ccccc3)CC2(C)C)cc1	ZINC000853985409	GF	On-Demand	Anodyne	PDS	44	33
Cc1nc(N[C@@H](C)CN(C)C(=O)OC(C)(C)C)ccc1[N+](=O)[O-]	ZINC000853985446	DF	On-Demand	Bother	COLA	40	33
Cc1nc(N[C@H](C)CN(C)C(=O)OC(C)(C)C)ccc1[N+](=O)[O-]	ZINC000853985447	DF	On-Demand	Bother	COLA	40	33
C#CCNC(=O)c1ccc(NCC2CCN(CC3CC3)CC2)nc1	ZINC000853985488	ED	On-Demand	Mild	IKBKB	20	47
C#CCNC(=O)c1ccc(NCC2CCN(CC3CC3)CC2)nc1	ZINC000853985488	ED	On-Demand	Mild	CACNA1I	82	40
O=C(NC1CCCC1)c1ccc(NC[C@H](O)c2cc(F)c(F)c(F)c2)nn1	ZINC000853985509	GF	On-Demand	Anodyne	MAPK13	59	32
O=C(NC1CCCC1)c1ccc(NC[C@@H](O)c2cc(F)c(F)c(F)c2)nn1	ZINC000853985511	GF	On-Demand	Anodyne	MAPK13	59	32
CC(=O)c1cc(N[C@H](C)CN(C)C(=O)OC(C)(C)C)ccc1[N+](=O)[O-]	ZINC000853985532	FG	On-Demand	Bother	COLA	48	37
CC(=O)c1cc(N[C@@H](C)CN(C)C(=O)OC(C)(C)C)ccc1[N+](=O)[O-]	ZINC000853985535	FG	On-Demand	Bother	COLA	48	37
COC[C@@H](NC(=O)NC1CC(OC)C1)c1cccc(OC)c1	ZINC000853985582	DD	On-Demand	Anodyne	MTNR1A	34	41
COC[C@@H](NC(=O)NC1CC(OC)C1)c1cccc(OC)c1	ZINC000853985582	DD	On-Demand	Anodyne	MTNR1B	37	41
COC[C@H](NC(=O)NC1CC(OC)C1)c1cccc(OC)c1	ZINC000853985584	DD	On-Demand	Anodyne	MTNR1A	34	41
COC[C@H](NC(=O)NC1CC(OC)C1)c1cccc(OC)c1	ZINC000853985584	DD	On-Demand	Anodyne	MTNR1B	37	41
COC(=O)c1cnc(NCC2CCN(CC3CC3)CC2)cc1C(F)(F)F	ZINC000853985627	FG	On-Demand	Anodyne	CACNA1I	51	37
COC(=O)c1sc(NCC2CCN(CC3CC3)CC2)nc1Cl	ZINC000853985652	EG	On-Demand	Anodyne	CACNA1I	43	34
O=C(NC1CC1)c1ccc(NC[C@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985664	FF	On-Demand	Anodyne	MAPK11	21	46
O=C(NC1CC1)c1ccc(NC[C@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985664	FF	On-Demand	Anodyne	MAPK14	40	46
O=C(NC1CC1)c1ccc(NC[C@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985664	FF	On-Demand	Anodyne	SSTR5	29	46
O=C(NC1CC1)c1ccc(NC[C@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985664	FF	On-Demand	Anodyne	MAPK13	78	39
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985665	FF	On-Demand	Anodyne	MAPK11	21	46
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985665	FF	On-Demand	Anodyne	MAPK14	40	46
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985665	FF	On-Demand	Anodyne	SSTR5	29	46
O=C(NC1CC1)c1ccc(NC[C@@H](O)c2cc(F)c(F)c(F)c2)nc1	ZINC000853985665	FF	On-Demand	Anodyne	MAPK13	78	39
O[C@H](CNc1nccc(N2CCCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985681	EF	On-Demand	Anodyne	SORD	67	35
O[C@@H](CNc1nccc(N2CCCC2)n1)c1cc(F)c(F)c(F)c1	ZINC000853985683	EF	On-Demand	Anodyne	SORD	67	35
c1cc(N2CCCC2)nc(NCC2CCN(CC3CC3)CC2)n1	ZINC000853985685	DF	On-Demand	Anodyne	GRIN2B	17	45
COCc1cc([N+](=O)[O-])ccc1N1CCc2c(cccc2C(N)=O)C1	ZINC000853985864	EE	On-Demand	Bother	CACNA1C	48	35
COCc1cc([N+](=O)[O-])ccc1N1CCc2c(cccc2C(N)=O)C1	ZINC000853985864	EE	On-Demand	Bother	CACNA1D	76	35
O=[N+]([O-])c1ccc(NCC2CCN(CC3CC3)CC2)c2nonc12	ZINC000853986029	EF	On-Demand	Bother	GSTM2	115	47
O=[N+]([O-])c1ccc(NCC2CCN(CC3CC3)CC2)c2nonc12	ZINC000853986029	EF	On-Demand	Bother	GSTP1	71	47
O=[N+]([O-])c1ccc(NCC2CCN(CC3CC3)CC2)c2nonc12	ZINC000853986029	EF	On-Demand	Bother	EPAS1	61	34
CC(=O)c1ccc(C#N)cc1NCC1CCN(CC2CC2)CC1	ZINC000853986047	DG	On-Demand	Mild	CACNA1I	46	33
O=C(NCCSCc1ccnc(Cl)c1)N[C@H]1CCN(C2CCCCC2)C1	ZINC000853986122	GH	On-Demand	Anodyne	SLC6A5	17	41
O=C(NCCSCc1ccnc(Cl)c1)N[C@@H]1CCN(C2CCCCC2)C1	ZINC000853986123	GH	On-Demand	Anodyne	SLC6A5	17	41
COC(=O)Nc1cc(NC(=O)C(=O)N[C@]2(c3ccccc3)CC2(C)C)ccc1F	ZINC000853986155	GG	On-Demand	Anodyne	ENV	40	36
COC(=O)Nc1cc(NC(=O)C(=O)N[C@@]2(c3ccccc3)CC2(C)C)ccc1F	ZINC000853986156	GG	On-Demand	Anodyne	ENV	40	36
COC(=O)c1cc(NC(=O)C(=O)N[C@]2(c3ccccc3)CC2(C)C)ccc1F	ZINC000853986169	GF	On-Demand	Anodyne	ENV	43	39
COC(=O)c1cc(NC(=O)C(=O)N[C@@]2(c3ccccc3)CC2(C)C)ccc1F	ZINC000853986170	GF	On-Demand	Anodyne	ENV	43	39
C[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986254	FF	On-Demand	Anodyne	SIRT3	50	32
C[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986254	FF	On-Demand	Anodyne	SIRT2	50	32
C[C@@H]1CCN(c2ncnc3c(F)cccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986254	FF	On-Demand	Anodyne	SIRT1	50	32
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986270	EC	On-Demand	Anodyne	SIRT3	50	34
C[C@@H]1CCN(c2ncnc3c2nnn3C)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986270	EC	On-Demand	Anodyne	SIRT2	43	33
C[C@@H]1CCN(c2cc(C(F)(F)F)ccn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986295	FF	On-Demand	Anodyne	CCR2	24	41
C[C@@H]1CCN(c2cc(C(F)(F)F)ccn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986295	FF	On-Demand	Anodyne	LIPG	49	35
C#Cc1cccnc1N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853986296	DD	On-Demand	Mild	TRPV1	15	40
COc1c(C)ncnc1N1CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C1	ZINC000853986298	ED	On-Demand	Anodyne	PDE3B	42	33
C[C@@H]1CCN(c2nc(C#N)c(Cl)s2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986300	FF	On-Demand	Mild	PARE	81	34
C[C@@H]1CCN(c2ccc(C(=O)N(C)C)nn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986313	FD	On-Demand	Anodyne	SCD1	42	38
C[C@@H]1CCN(c2ncnc3[nH]c4ccccc4c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986325	GG	On-Demand	Anodyne	LIMK2	40	38
C[C@@H]1CCN(c2cncc(Br)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986326	FF	On-Demand	Anodyne	CHRNA3	17	45
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(Oc2cccnc2)cc1	ZINC000853986330	FG	On-Demand	Anodyne	NPY5R	20	40
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(Oc2cccnc2)cc1	ZINC000853986330	FG	On-Demand	Anodyne	NAMPT	35	45
C[C@@H]1CCN(c2nc(N)c3ccccc3n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986334	FE	On-Demand	Anodyne	HTR3A	15	47
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1cccnc1F	ZINC000853986362	CD	On-Demand	Anodyne	G2YM83_BOTF4	66	37
C[C@@H]1CCN(c2ncnc3[nH]c4cc(F)ccc4c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986387	GG	On-Demand	Anodyne	SIRT3	52	32
C[C@@H]1CCN(c2ncnc3[nH]c4cc(F)ccc4c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986387	GG	On-Demand	Anodyne	SIRT2	50	32
C[C@@H]1CCN(c2ncnc3[nH]c4cc(F)ccc4c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986387	GG	On-Demand	Anodyne	SIRT1	49	30
C[C@@H]1CCN(c2ncnc3[nH]c4cc(F)ccc4c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986387	GG	On-Demand	Anodyne	LIMK2	45	35
C[C@@H]1CCN(c2cc(C(F)(F)F)cnc2C#N)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986393	GF	On-Demand	Mild	LIPG	40	37
CC(=O)c1ccc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)nc1	ZINC000853986401	EE	On-Demand	Anodyne	HPGDS	30	40
C[C@@H]1CCN(c2ccnc(Cc3ccccc3)n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986417	GF	On-Demand	Anodyne	SORD	47	35
C[C@@H]1CCN(c2ncccc2C(F)(F)F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986432	FF	On-Demand	Anodyne	TRPV1	44	52
C[C@@H]1CCN(c2ncccc2C(F)(F)F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986432	FF	On-Demand	Anodyne	RBP4	45	45
Cc1nc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)sc1-c1ccccc1	ZINC000853986441	FH	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)sc1-c1ccccc1	ZINC000853986441	FH	On-Demand	Anodyne	PI4KB	40	38
Cc1nc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)sc1-c1ccccc1	ZINC000853986442	FH	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)sc1-c1ccccc1	ZINC000853986442	FH	On-Demand	Anodyne	PI4KB	40	38
C[C@@H]1CCN(c2ccncc2C(N)=O)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986461	ED	On-Demand	Anodyne	LIPG	42	32
C[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986495	EF	On-Demand	Anodyne	SIRT3	95	40
C[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986495	EF	On-Demand	Anodyne	SIRT2	81	40
C[C@@H]1CCN(c2ncnc3ccsc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986495	EF	On-Demand	Anodyne	SIRT1	73	40
O=C(NNc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000853986511	GG	On-Demand	Reactive	SLC27A4	44	35
O=C(NNc1ccc([N+](=O)[O-])cc1F)N[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000853986512	GG	On-Demand	Reactive	SLC27A4	44	35
O=C(NNc1ccc([N+](=O)[O-])cc1F)N[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000853986513	GG	On-Demand	Reactive	SLC27A4	44	35
O=C(NNc1ccc([N+](=O)[O-])cc1F)N[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000853986514	GG	On-Demand	Reactive	SLC27A4	44	35
C[C@@H]1CCN(c2ncc(Cl)s2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986544	EF	On-Demand	Anodyne	PARE	76	40
COC(=O)c1nc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)sc1C	ZINC000853986589	FE	On-Demand	Anodyne	PARE	93	42
C[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986603	GE	On-Demand	Bother	SIRT3	61	33
C[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986603	GE	On-Demand	Bother	SIRT2	51	33
C[C@@H]1CCN(c2ncnc3sc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986603	GE	On-Demand	Bother	SIRT1	49	31
C[C@@H]1CCN(c2ncc(C(F)(F)F)s2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986604	FG	On-Demand	Anodyne	MLYCD	65	41
C[C@@H]1CCN(c2ncc(C(F)(F)F)s2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986604	FG	On-Demand	Anodyne	PARE	55	39
C[C@@H]1CCN(c2nc(Cl)c(C#N)s2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986628	FF	On-Demand	Mild	PARE	49	33
CCn1c(=O)c(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)nc2ccccc21	ZINC000853986630	GE	On-Demand	Anodyne	PDE6D	61	35
COc1cccc(C2(NC(=O)NC3CC(OC)C3)CCC2)c1	ZINC000853986637	DF	On-Demand	Anodyne	EPHX2	17	40
C[C@@H]1CCN(c2ncnc3sccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986646	EF	On-Demand	Anodyne	SIRT3	53	33
C[C@@H]1CCN(c2ncnc3sccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986646	EF	On-Demand	Anodyne	SIRT2	52	32
C[C@@H]1CCN(c2ncnc3sccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986646	EF	On-Demand	Anodyne	SIRT1	51	32
COC(=O)c1cc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)ccc1F	ZINC000853986710	EE	On-Demand	Anodyne	ENV	43	38
COC(=O)c1cc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)ccc1F	ZINC000853986711	EE	On-Demand	Anodyne	ENV	43	38
C[C@@H]1CCN(c2noc(-c3ccccc3)n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986756	FF	On-Demand	Anodyne	DGAT1	16	45
C[C@@H]1CCN(c2nc(O)c3ccccc3n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986772	FE	On-Demand	Anodyne	TNKS	45	32
COc1ccc(-c2noc(N3CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C3)n2)cc1	ZINC000853986797	GF	On-Demand	Anodyne	PDK1	40	33
C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986800	GE	On-Demand	Anodyne	SLC6A9	33	44
C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986800	GE	On-Demand	Anodyne	GPR119	48	40
C[C@@H]1CCN(c2ncccc2Br)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986832	FF	On-Demand	Anodyne	TRPV1	17	41
C[C@@H]1CCN(c2ncccc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853986843	DF	On-Demand	Anodyne	TRPV1	24	49
C#Cc1cccnc1NCC1CCN(CC2CC2)CC1	ZINC000853986846	CF	On-Demand	Mild	GRIN2B	16	40
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1cccc(OCCS(C)(=O)=O)c1	ZINC000853986865	GD	On-Demand	Anodyne	EPHX2	20	41
CC(=O)c1ccc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000853986964	FF	On-Demand	Bother	TAAR1	16	44
Cc1csc2c(N3CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C3)ncnc12	ZINC000853986994	FF	On-Demand	Anodyne	SIRT3	66	41
Cc1csc2c(N3CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C3)ncnc12	ZINC000853986994	FF	On-Demand	Anodyne	SIRT2	53	35
Cc1csc2c(N3CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C3)ncnc12	ZINC000853986994	FF	On-Demand	Anodyne	SIRT1	51	32
C[C@@H]1CCN(c2nc(N(C)C)c3ccccc3n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853987001	GF	On-Demand	Anodyne	ADRA2A	15	41
CC(=O)c1nc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)sc1C	ZINC000853987016	EF	On-Demand	Anodyne	PARE	55	40
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1CCN(CC2CC2)CC1	ZINC000853987048	EG	On-Demand	Bother	CACNA1I	46	33
CC(=O)c1ccc([N+](=O)[O-])cc1NCC1CCN(CC2CC2)CC1	ZINC000853987048	EG	On-Demand	Bother	VCP	21	40
C[C@@H]1CCN(c2ccc(C(F)(F)F)cn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853987053	FF	On-Demand	Anodyne	TRPV1	16	51
C[C@@H]1CCN(c2ccc(C(F)(F)F)cn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853987053	FF	On-Demand	Anodyne	LIPG	43	38
COc1ccc(N2CC[C@H](NC(=O)NC3COC(C)(C)OC3)C2)cc1	ZINC000853987139	ED	On-Demand	Clean	MTNR1A	16	48
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)cc1	ZINC000853987167	GD	On-Demand	Anodyne	MTOR	49	40
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)cc1	ZINC000853987170	GD	On-Demand	Anodyne	MTOR	49	40
COC(=O)c1sc2c(c1Br)CN(c1ccc([N+](=O)[O-])cc1C)C2	ZINC000853987204	GI	On-Demand	Bother	CACNA1C	44	36
COC(=O)c1sc2c(c1Br)CN(c1ccc([N+](=O)[O-])cc1C)C2	ZINC000853987204	GI	On-Demand	Bother	CACNA1D	66	36
O=C(Nc1ccc(N2CCCC2)c(F)c1)C(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853987294	GD	On-Demand	Anodyne	NPY2R	76	38
O=C(Nc1ccc(N2CCCC2)c(F)c1)C(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853987296	GD	On-Demand	Anodyne	NPY2R	76	38
Cn1cc(CCNC(=O)NC2COC(C)(C)OC2)c2ccccc21	ZINC000853987329	EE	On-Demand	Anodyne	MTNR1A	18	42
COC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)c1	ZINC000853987361	EE	On-Demand	Anodyne	KCNK3	51	33
COC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)c1	ZINC000853987361	EE	On-Demand	Anodyne	KCNK9	51	33
COC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)c1	ZINC000853987362	EE	On-Demand	Anodyne	KCNK3	51	33
COC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)c1	ZINC000853987362	EE	On-Demand	Anodyne	KCNK9	51	33
O=C(Nc1ccc(N2CCOCC2)c(F)c1)C(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853987427	GD	On-Demand	Anodyne	NPY2R	63	39
O=C(Nc1ccc(N2CCOCC2)c(F)c1)C(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853987428	GD	On-Demand	Anodyne	NPY2R	63	39
COc1cccc(C2(NC(=O)NCCC3(C)OCCO3)CCC2)c1	ZINC000853987632	EF	On-Demand	Anodyne	DRD4	41	32
COc1cccc(C2(NC(=O)NCCC3(C)OCCO3)CCC2)c1	ZINC000853987632	EF	On-Demand	Anodyne	MTNR1A	43	38
COc1cccc(C2(NC(=O)NCCC3(C)OCCO3)CCC2)c1	ZINC000853987632	EF	On-Demand	Anodyne	ICMT	45	39
O=C(Nc1ccc(N2CCCC2)c(Cl)c1)C(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853987656	GE	On-Demand	Anodyne	NPY2R	52	41
O=C(Nc1ccc(N2CCCC2)c(Cl)c1)C(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853987658	GE	On-Demand	Anodyne	NPY2R	52	41
COCCOC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)c1	ZINC000853987663	GE	On-Demand	Anodyne	KCNK3	48	33
COCCOC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)c1	ZINC000853987663	GE	On-Demand	Anodyne	KCNK9	47	33
COCCOC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)c1	ZINC000853987664	GE	On-Demand	Anodyne	KCNK3	48	33
COCCOC(=O)Nc1cccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)c1	ZINC000853987664	GE	On-Demand	Anodyne	KCNK9	47	33
COC(=O)c1ccc(CNC(=O)NC2COC(C)(C)OC2)c(F)c1	ZINC000853987715	ED	On-Demand	Anodyne	BDKRB1	27	40
COC(=O)Nc1cc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)ccc1F	ZINC000853987743	FE	On-Demand	Anodyne	ENV	40	35
COC(=O)Nc1cc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)ccc1F	ZINC000853987744	FE	On-Demand	Anodyne	ENV	40	35
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000853987746	FG	On-Demand	Anodyne	CHRNA7	26	41
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000853987746	FG	On-Demand	Anodyne	ADAM17	15	40
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000853987746	FG	On-Demand	Anodyne	NAMPT	41	42
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000853987754	EF	On-Demand	Anodyne	NPY2R	100	42
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000853987754	EF	On-Demand	Anodyne	ENV	43	38
CN1CCCN(c2ccc(NC(=O)C(=O)N(C)C[C@@H]3CC3(C)C)cc2)CC1	ZINC000853987760	FE	On-Demand	Anodyne	PRNP	37	42
CN1CCCN(c2ccc(NC(=O)C(=O)N(C)C[C@H]3CC3(C)C)cc2)CC1	ZINC000853987761	FE	On-Demand	Anodyne	PRNP	37	42
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853987985	FD	On-Demand	Anodyne	MTOR	56	35
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853987985	FD	On-Demand	Anodyne	STAT6	51	32
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853987986	FD	On-Demand	Anodyne	MTOR	56	35
O=C(Nc1ccc(N2CCOCC2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853987986	FD	On-Demand	Anodyne	STAT6	51	32
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000853988094	FE	On-Demand	Anodyne	NPY2R	81	41
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000853988094	FE	On-Demand	Anodyne	ENV	41	37
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc1	ZINC000853988108	FE	On-Demand	Anodyne	MTOR	50	44
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc1	ZINC000853988110	FE	On-Demand	Anodyne	MTOR	50	44
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000853988149	GG	On-Demand	Anodyne	NPY2R	88	39
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000853988149	GG	On-Demand	Anodyne	ENV	40	37
N#C[C@@H]1CCCC[C@H]1NC(=O)NOCc1ccc(F)cc1	ZINC000853988250	CF	On-Demand	Mild	SSTR3	19	41
N#C[C@@H]1CCCC[C@@H]1NC(=O)NOCc1ccc(F)cc1	ZINC000853988251	CF	On-Demand	Mild	SSTR3	19	41
N#C[C@H]1CCCC[C@@H]1NC(=O)NOCc1ccc(F)cc1	ZINC000853988252	CF	On-Demand	Mild	SSTR3	19	41
N#C[C@H]1CCCC[C@H]1NC(=O)NOCc1ccc(F)cc1	ZINC000853988253	CF	On-Demand	Mild	SSTR3	19	41
C[C@H]1CN(c2ccc(NC(=O)C(=O)N(C)C[C@H]3CC3(C)C)cc2F)C[C@@H](C)O1	ZINC000853988276	GF	On-Demand	Anodyne	NPY2R	64	36
C[C@H]1CN(c2ccc(NC(=O)C(=O)N(C)C[C@H]3CC3(C)C)cc2F)C[C@@H](C)O1	ZINC000853988276	GF	On-Demand	Anodyne	ENV	40	37
C[C@H]1CN(c2ccc(NC(=O)C(=O)N(C)C[C@@H]3CC3(C)C)cc2F)C[C@@H](C)O1	ZINC000853988278	GF	On-Demand	Anodyne	NPY2R	64	36
C[C@H]1CN(c2ccc(NC(=O)C(=O)N(C)C[C@@H]3CC3(C)C)cc2F)C[C@@H](C)O1	ZINC000853988278	GF	On-Demand	Anodyne	ENV	40	37
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000853988355	FG	On-Demand	Anodyne	KCNQ2	61	34
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000853988355	FG	On-Demand	Anodyne	NPY2R	102	41
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000853988355	FG	On-Demand	Anodyne	ENV	43	38
COC(=O)c1sc2c(c1Br)CN(c1ccnc(C(C)C)n1)C2	ZINC000853988372	GH	On-Demand	Anodyne	SORD	73	36
COC[C@H](NC(=O)NCCC1(C)OCCO1)c1cccc(OC)c1	ZINC000853988443	ED	On-Demand	Anodyne	DRD4	41	32
COC[C@H](NC(=O)NCCC1(C)OCCO1)c1cccc(OC)c1	ZINC000853988443	ED	On-Demand	Anodyne	MTNR1A	35	40
COC[C@H](NC(=O)NCCC1(C)OCCO1)c1cccc(OC)c1	ZINC000853988443	ED	On-Demand	Anodyne	MTNR1B	32	40
COC[C@@H](NC(=O)NCCC1(C)OCCO1)c1cccc(OC)c1	ZINC000853988445	ED	On-Demand	Anodyne	DRD4	41	32
COC[C@@H](NC(=O)NCCC1(C)OCCO1)c1cccc(OC)c1	ZINC000853988445	ED	On-Demand	Anodyne	MTNR1A	35	40
COC[C@@H](NC(=O)NCCC1(C)OCCO1)c1cccc(OC)c1	ZINC000853988445	ED	On-Demand	Anodyne	MTNR1B	32	40
C[C@@H]1CCN(c2ccc(C(=O)NCCO)nn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988451	GC	On-Demand	Anodyne	SCD1	60	48
C[C@@H]1CCN(c2ccc(C(=O)NCCO)nn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988451	GC	On-Demand	Anodyne	SCD	48	48
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	PDE3A	41	37
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	AKT2	47	37
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	AKT3	57	35
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	PDE3B	45	37
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	AKT1	33	40
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	SIRT3	65	35
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	SIRT2	55	35
C[C@@H]1CCN(c2ncnc3cc(Cl)ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988480	FG	On-Demand	Anodyne	SIRT1	54	33
COCc1cc([N+](=O)[O-])ccc1N1C[C@]23CCCC[C@]2(COC3)C1	ZINC000853988500	EG	On-Demand	Bother	CACNA1D	42	33
COCc1cc([N+](=O)[O-])ccc1N1C[C@@]23CCCC[C@]2(COC3)C1	ZINC000853988502	EG	On-Demand	Bother	CACNA1D	42	33
COCc1cc([N+](=O)[O-])ccc1N1C[C@]23CCCC[C@@]2(COC3)C1	ZINC000853988503	EG	On-Demand	Bother	CACNA1D	42	33
COc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988554	FG	On-Demand	Anodyne	PDE4A	45	45
COc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988554	FG	On-Demand	Anodyne	PDE4B	22	44
COc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988554	FG	On-Demand	Anodyne	PDE4D	24	45
COc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988554	FG	On-Demand	Anodyne	PDE4C	18	44
COc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988554	FG	On-Demand	Anodyne	QRFPR	40	32
COc1ccc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988554	FG	On-Demand	Anodyne	ENPP1	54	32
COc1ccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988556	FG	On-Demand	Anodyne	PDE4A	45	45
COc1ccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988556	FG	On-Demand	Anodyne	PDE4B	22	44
COc1ccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988556	FG	On-Demand	Anodyne	PDE4D	24	45
COc1ccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988556	FG	On-Demand	Anodyne	PDE4C	18	44
COc1ccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988556	FG	On-Demand	Anodyne	QRFPR	40	32
COc1ccc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)cc1OC1CCCC1	ZINC000853988556	FG	On-Demand	Anodyne	ENPP1	54	32
C[C@@H]1CCN(c2ncc(C#N)cc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988559	EE	On-Demand	Mild	CXCR3	24	41
CN(C(=O)NC1COC(C)(C)OC1)[C@H](CO)Cc1ccccc1	ZINC000853988570	DD	On-Demand	Anodyne	NPY5R	15	40
CN(C(=O)NC1COC(C)(C)OC1)[C@@H](CO)Cc1ccccc1	ZINC000853988572	DD	On-Demand	Anodyne	NPY5R	15	40
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2COC(C)(C)OC2)cc1	ZINC000853988630	GD	On-Demand	Anodyne	ADRB2	28	52
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2COC(C)(C)OC2)cc1	ZINC000853988630	GD	On-Demand	Anodyne	ADRB1	63	52
COCCc1ccc(OC[C@@H](O)CNC(=O)NC2COC(C)(C)OC2)cc1	ZINC000853988630	GD	On-Demand	Anodyne	ADRB3	38	40
COCCc1ccc(OC[C@H](O)CNC(=O)NC2COC(C)(C)OC2)cc1	ZINC000853988632	GD	On-Demand	Anodyne	ADRB2	28	52
COCCc1ccc(OC[C@H](O)CNC(=O)NC2COC(C)(C)OC2)cc1	ZINC000853988632	GD	On-Demand	Anodyne	ADRB1	63	52
COCCc1ccc(OC[C@H](O)CNC(=O)NC2COC(C)(C)OC2)cc1	ZINC000853988632	GD	On-Demand	Anodyne	ADRB3	38	40
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000853988718	EF	On-Demand	Bother	ENV	45	41
COC(=O)/C=C\c1ccc(N2CCO[C@H](CCCN(C)C)C2)c([N+](=O)[O-])c1	ZINC000853988720	GE	On-Demand	Clean	BCL2L1	51	32
COC(=O)/C=C\c1ccc(N2CCO[C@@H](CCCN(C)C)C2)c([N+](=O)[O-])c1	ZINC000853988721	GE	On-Demand	Clean	BCL2L1	51	32
O=C(Nc1ccc(OCc2cccnc2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853988754	GE	On-Demand	Anodyne	CHRNA7	36	40
O=C(Nc1ccc(OCc2cccnc2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853988755	GE	On-Demand	Anodyne	CHRNA7	36	40
CN1CCN(c2ccccc2NC(=O)C(=O)N2C[C@H]3CC[C@H]2[C@H](CO)C3)CC1	ZINC000853988769	GC	On-Demand	Anodyne	KCNQ2	68	36
CN1CCN(c2ccccc2NC(=O)C(=O)N2C[C@H]3CC[C@H]2[C@@H](CO)C3)CC1	ZINC000853988770	GC	On-Demand	Anodyne	KCNQ2	68	36
C[C@@H]1CCN(c2ccc3ccccc3n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988857	EG	On-Demand	Anodyne	HTR3A	19	42
Cc1nnc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)s1	ZINC000853988891	DD	On-Demand	Anodyne	PARE	76	34
Cc1cc(NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)ccc1N1CCOCC1	ZINC000853988942	FE	On-Demand	Anodyne	NPY2R	41	35
Cc1cc(NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)ccc1N1CCOCC1	ZINC000853988943	FE	On-Demand	Anodyne	NPY2R	41	35
C[C@@H]1CCN(c2ccc(S(N)(=O)=O)cc2C#N)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988946	GD	On-Demand	Mild	CA7	20	41
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	AKT2	57	55
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	AKT3	38	44
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	JAK3	28	49
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	JAK1	41	40
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	ROCK2	15	44
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	AKT1	25	44
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	TYK2	15	40
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	SIRT3	53	33
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	SIRT2	52	33
C[C@@H]1CCN(c2ncnc3[nH]ccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988947	ED	On-Demand	Anodyne	SIRT1	50	31
C[C@@H]1CCN(c2ncc(C(N)=O)cc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988969	FD	On-Demand	Anodyne	CXCR3	28	47
C[C@@H]1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988978	GE	On-Demand	Bother	PDGFRB	20	43
C[C@@H]1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988978	GE	On-Demand	Bother	PDE3B	43	34
C[C@@H]1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988978	GE	On-Demand	Bother	SIRT3	62	33
C[C@@H]1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988978	GE	On-Demand	Bother	SIRT2	53	33
C[C@@H]1CCN(c2ncnc3ccc([N+](=O)[O-])cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853988978	GE	On-Demand	Bother	SIRT1	52	31
C[C@@H]1CCN(c2ncnc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989086	EF	On-Demand	Anodyne	PDE3A	41	38
C[C@@H]1CCN(c2ncnc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989086	EF	On-Demand	Anodyne	PDGFRB	26	41
C[C@@H]1CCN(c2ncnc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989086	EF	On-Demand	Anodyne	PDE3B	44	37
C[C@@H]1CCN(c2ncnc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989086	EF	On-Demand	Anodyne	SIRT3	65	35
C[C@@H]1CCN(c2ncnc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989086	EF	On-Demand	Anodyne	SIRT2	56	35
C[C@@H]1CCN(c2ncnc3ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989086	EF	On-Demand	Anodyne	SIRT1	55	33
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCC1(C)OCCO1	ZINC000853989123	GH	On-Demand	Anodyne	MME	59	38
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCC1(C)OCCO1	ZINC000853989123	GH	On-Demand	Anodyne	ACE2	48	33
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCC1(C)OCCO1	ZINC000853989123	GH	On-Demand	Anodyne	PSMB8	53	33
C[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989144	FD	On-Demand	Anodyne	MAPK13	43	32
C[C@@H]1CCN(c2ccc(C(=O)NC3CC3)cn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989144	FD	On-Demand	Anodyne	HPGDS	39	52
C#CCNC(=O)c1ccc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)nc1	ZINC000853989145	FD	On-Demand	Mild	HPGDS	32	44
C[C@@H]1CCN(c2ncc(Cl)cc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989147	FG	On-Demand	Anodyne	CXCR3	27	42
C[C@@H]1CCN(c2nc(-c3ccccc3)no2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989149	FF	On-Demand	Anodyne	ETHR	22	40
C[C@@H]1CCN(c2ncnc3c2oc2ccccc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989170	GG	On-Demand	Anodyne	HRH4	19	52
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1cccnc1Br	ZINC000853989174	EE	On-Demand	Anodyne	G2YM83_BOTF4	45	34
C[C@@H]1CCN(c2nc3ccccc3n2C)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989180	EE	On-Demand	Anodyne	PDE6D	60	35
COc1ccc2c(N3CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C3)ccnc2c1	ZINC000853989183	FG	On-Demand	Anodyne	KDR	31	42
COC(=O)c1sc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)nc1Cl	ZINC000853989256	GE	On-Demand	Anodyne	PARE	107	38
Cc1sc2ncnc(N3CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C3)c2c1C	ZINC000853989341	FG	On-Demand	Anodyne	SIRT3	42	36
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1cnn(C(F)F)c1	ZINC000853989361	DD	On-Demand	Anodyne	ITK	45	35
C[C@@H]1CCN(c2ccnc(C(N)=O)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989362	ED	On-Demand	Anodyne	SIRT3	44	33
C[C@@H]1CCN(c2ccc(C(=O)NC3CCCC3)nn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989506	GE	On-Demand	Anodyne	SCD1	45	43
C[C@@H]1CCN(c2ccc(C(=O)NC3CCCC3)nn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989506	GE	On-Demand	Anodyne	SCD	31	40
C[C@@H]1CCN(c2ccc(C#N)c(Cl)c2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989525	EG	On-Demand	Mild	AR	35	58
O=[N+]([O-])c1ccc(N2C[C@]34CCCC[C@@]3(COC4)C2)c2nonc12	ZINC000853989535	EF	On-Demand	Bother	GSTM2	106	40
O=[N+]([O-])c1ccc(N2C[C@]34CCCC[C@@]3(COC4)C2)c2nonc12	ZINC000853989535	EF	On-Demand	Bother	GSTP1	64	40
O=[N+]([O-])c1ccc(N2C[C@@]34CCCC[C@]3(COC4)C2)c2nonc12	ZINC000853989537	EF	On-Demand	Bother	GSTM2	106	40
O=[N+]([O-])c1ccc(N2C[C@@]34CCCC[C@]3(COC4)C2)c2nonc12	ZINC000853989537	EF	On-Demand	Bother	GSTP1	64	40
O=[N+]([O-])c1ccc(N2C[C@]34CCCC[C@]3(COC4)C2)c2nonc12	ZINC000853989538	EF	On-Demand	Bother	GSTM2	106	40
O=[N+]([O-])c1ccc(N2C[C@]34CCCC[C@]3(COC4)C2)c2nonc12	ZINC000853989538	EF	On-Demand	Bother	GSTP1	64	40
COc1ccc2c(N3CCO[C@@H](CCCN(C)C)C3)ccnc2c1	ZINC000853989592	EF	On-Demand	Anodyne	GSG2	32	41
COc1ccc2c(N3CCO[C@H](CCCN(C)C)C3)ccnc2c1	ZINC000853989595	EF	On-Demand	Anodyne	GSG2	32	41
CN(C)CCC[C@@H]1CN(c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000853989680	CE	On-Demand	Bother	SSTR1	33	41
C[C@@H]1CCN(c2ncnc3n[nH]cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989698	ED	On-Demand	Anodyne	SIRT3	50	35
C[C@@H]1CCN(c2ncnc3n[nH]cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989698	ED	On-Demand	Anodyne	SIRT2	46	33
C[C@@H]1CCN(c2ncnc3n[nH]cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989698	ED	On-Demand	Anodyne	SIRT1	41	33
CCCNC(=O)c1ccc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)nc1	ZINC000853989704	FE	On-Demand	Anodyne	HPGDS	35	45
C[C@@H]1CCN(c2ncc(C(=O)N(C)C)cc2Cl)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989705	GE	On-Demand	Anodyne	CXCR3	27	45
C[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989710	FF	On-Demand	Anodyne	SIRT3	53	33
C[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989710	FF	On-Demand	Anodyne	SIRT2	53	33
C[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989710	FF	On-Demand	Anodyne	SIRT1	53	33
C[C@@H]1CCN(c2ncnc3cccc(F)c23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989710	FF	On-Demand	Anodyne	LIMK2	45	35
C[C@@H]1CCN(c2ccccc2S(C)(=O)=O)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989719	FD	On-Demand	Anodyne	SFRP1	47	33
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000853989750	GH	On-Demand	Anodyne	ENV	40	35
C[C@@H]1CCN(c2ccc(S(C)(=O)=O)cc2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853989792	FD	On-Demand	Anodyne	GPR119	36	47
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCNC(=O)C2)c(Cl)c1	ZINC000853989956	GD	On-Demand	Anodyne	NPY2R	49	36
CN1CCN(c2ccccc2NC(=O)C(=O)N(C)C[C@@H]2CC2(C)C)CC1	ZINC000853990003	FD	On-Demand	Anodyne	KCNQ2	75	39
CN1CCN(c2ccccc2NC(=O)C(=O)N(C)C[C@H]2CC2(C)C)CC1	ZINC000853990006	FD	On-Demand	Anodyne	KCNQ2	75	39
C[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990057	FE	On-Demand	Bother	GSTM2	103	38
C[C@@H]1CCN(c2ccc([N+](=O)[O-])c3nonc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990057	FE	On-Demand	Bother	GSTP1	61	37
C=CCNC(=O)c1ccc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)nc1	ZINC000853990063	FD	On-Demand	Mild	HPGDS	31	41
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1cccnc1Cl	ZINC000853990066	CE	On-Demand	Anodyne	G2YM83_BOTF4	79	42
Cc1nc(N2CC[C@@H](C)[C@@H](NC(=O)C(F)(F)F)C2)sc1C	ZINC000853990068	DF	On-Demand	Anodyne	PARE	57	37
C[C@@H]1CCN(c2ncnc3ccc(F)cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990085	FF	On-Demand	Anodyne	PDE3A	42	39
C[C@@H]1CCN(c2ncnc3ccc(F)cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990085	FF	On-Demand	Anodyne	PDGFRB	35	45
C[C@@H]1CCN(c2ncnc3ccc(F)cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990085	FF	On-Demand	Anodyne	PDE3B	45	36
C[C@@H]1CCN(c2ncnc3ccc(F)cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990085	FF	On-Demand	Anodyne	SIRT3	68	36
C[C@@H]1CCN(c2ncnc3ccc(F)cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990085	FF	On-Demand	Anodyne	SIRT2	59	36
C[C@@H]1CCN(c2ncnc3ccc(F)cc23)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990085	FF	On-Demand	Anodyne	SIRT1	55	33
C[C@@H]1CCN(c2cc(Cl)nc(N)n2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990196	ED	On-Demand	Anodyne	HRH4	49	37
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N(C)C)c(Cl)c1	ZINC000853990239	EF	On-Demand	Anodyne	ENV	44	39
C[C@@H]1CCN(c2ccc(C(N)=O)nn2)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990240	EC	On-Demand	Anodyne	SCD1	44	46
C[C@@H]1CCN(c2ncccc2F)C[C@@H]1NC(=O)C(F)(F)F	ZINC000853990250	DE	On-Demand	Anodyne	TRPV1	20	40
CN(C)CCC[C@@H]1CN(c2ccc([N+](=O)[O-])c3nonc23)CCO1	ZINC000853990443	ED	On-Demand	Bother	GSTM2	92	37
CN(C)CCC[C@@H]1CN(c2ccc([N+](=O)[O-])c3nonc23)CCO1	ZINC000853990443	ED	On-Demand	Bother	GSTP1	52	37
CN(C)CCC[C@@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1	ZINC000853990610	GG	On-Demand	Anodyne	PIK3CA	17	41
CN(C)CCC[C@@H]1CN(c2nc(-c3cccnc3)nc3ccccc23)CCO1	ZINC000853990610	GG	On-Demand	Anodyne	MTOR	19	41
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853990686	ED	On-Demand	Anodyne	MTOR	65	38
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853990686	ED	On-Demand	Anodyne	EPHX2	17	48
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853990686	ED	On-Demand	Anodyne	STAT6	56	33
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000853990957	GF	On-Demand	Anodyne	NPY2R	46	36
CN(C[C@@H]1CC1(C)C)C(=O)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000853990957	GF	On-Demand	Anodyne	ENV	40	35
C#C[C@@H](NC(=O)NCC1(c2ccccc2OC)CCC1)C1CCOCC1	ZINC000853991035	FF	On-Demand	Mild	KCNA3	43	38
C#C[C@H](NC(=O)NCC1(c2ccccc2OC)CCC1)C1CCOCC1	ZINC000853991036	FF	On-Demand	Mild	KCNA3	43	38
O=C(NCc1nc2ccccc2n1C1CC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853991042	FE	On-Demand	Anodyne	FPR2	23	41
O=C(NCc1nc2ccccc2n1C1CC1)N1CC[C@H](N2CCOC2=O)C1	ZINC000853991042	FE	On-Demand	Anodyne	SMO	40	38
O=C(NCc1nc2ccccc2n1C1CC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853991043	FE	On-Demand	Anodyne	FPR2	23	41
O=C(NCc1nc2ccccc2n1C1CC1)N1CC[C@@H](N2CCOC2=O)C1	ZINC000853991043	FE	On-Demand	Anodyne	SMO	40	38
O=C(NCc1nc2ccccc2n1C1CC1)N1CCC(N2CCOC2=O)CC1	ZINC000853991051	GE	On-Demand	Anodyne	CALCRL	48	34
O=C(NCc1nc2ccccc2n1C1CC1)N1CCC(N2CCOC2=O)CC1	ZINC000853991051	GE	On-Demand	Anodyne	FPR2	22	40
O=C(NCc1nc2ccccc2n1C1CC1)N1CCC(N2CCOC2=O)CC1	ZINC000853991051	GE	On-Demand	Anodyne	SMO	44	40
Cc1nc(NC(=O)C(=O)NCCOCCF)sc1-c1ccccc1	ZINC000853991057	FE	On-Demand	Anodyne	PIK3CG	18	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccc(F)c1	ZINC000853991101	GE	On-Demand	Anodyne	GPR119	27	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccc(C#N)n1	ZINC000853991138	GD	On-Demand	Mild	GPR119	18	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(Cl)nc1	ZINC000853991149	GE	On-Demand	Anodyne	GPR119	35	40
COc1ncccc1NC(=O)C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853991174	GD	On-Demand	Anodyne	GPR119	37	40
CN(C)CC1(CNC(=O)NNc2ccc([N+](=O)[O-])cc2F)CCCC1	ZINC000853991190	FE	On-Demand	Reactive	NMBR	41	30
O=C(NC/C=C\CO)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991194	DD	On-Demand	Anodyne	KCNA3	19	44
O=C(NC/C=C/CO)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991195	DD	On-Demand	Anodyne	KCNA3	19	44
COCCN(CCF)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000853991203	EF	On-Demand	Anodyne	KCNA3	47	38
COc1ccc(NC(=O)C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1	ZINC000853991206	GE	On-Demand	Anodyne	HDAC8	17	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccnc1Cl	ZINC000853991233	GE	On-Demand	Anodyne	GPR119	32	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccnc1Cl	ZINC000853991233	GE	On-Demand	Anodyne	G2YM83_BOTF4	54	36
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853991277	FI	On-Demand	Anodyne	OPRL1	15	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H]1c1ccc(F)cc1	ZINC000853991277	FI	On-Demand	Anodyne	SIGMAR1	16	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853991278	FI	On-Demand	Anodyne	OPRL1	15	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H]1c1ccc(F)cc1	ZINC000853991278	FI	On-Demand	Anodyne	SIGMAR1	16	41
CON(C)CCNC(=O)NC(c1ccccc1C)c1ccccc1C	ZINC000853991283	EG	On-Demand	Anodyne	CTSA	43	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccc(F)c1F	ZINC000853991285	GF	On-Demand	Anodyne	GPR119	29	43
C#CCCN(CCOC)C(=O)NCC1(c2ccccc2OC)CCC1	ZINC000853991294	EF	On-Demand	Mild	KCNA3	44	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1c(F)cccc1F	ZINC000853991306	GF	On-Demand	Anodyne	GPR119	33	42
CCCn1cc(NC(=O)C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cn1	ZINC000853991308	GD	On-Demand	Anodyne	PANC	52	35
COCC1(NC(=O)NC2CCC(O)(c3ccccc3)CC2)CCCC1	ZINC000853991310	EG	On-Demand	Anodyne	EPHX2	30	41
C[C@@H](CCNC(=O)NC1CCC(O)(c2ccccc2)CC1)N(C)C	ZINC000853991315	EE	On-Demand	Anodyne	OPRL1	15	54
C[C@@H](CCNC(=O)NC1CCC(O)(c2ccccc2)CC1)N(C)C	ZINC000853991315	EE	On-Demand	Anodyne	KCNA3	38	41
C[C@@H](CCNC(=O)NC1CCC(O)(c2ccccc2)CC1)N(C)C	ZINC000853991315	EE	On-Demand	Anodyne	EPHX2	15	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccccc1F	ZINC000853991322	GE	On-Demand	Anodyne	GPR119	33	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(F)cn1	ZINC000853991325	GD	On-Demand	Anodyne	GPR119	40	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(Cl)cn1	ZINC000853991347	GE	On-Demand	Anodyne	F10	27	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(Cl)cn1	ZINC000853991347	GE	On-Demand	Anodyne	GPR119	29	40
CC[C@H](C)N(CC)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991374	DH	On-Demand	Anodyne	OPRL1	18	48
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853991380	FF	On-Demand	Anodyne	CPT1A	108	39
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853991381	FF	On-Demand	Anodyne	CPT1A	108	39
COc1ccc2cc(NC(=O)C(=O)NCCOCCF)ccc2c1	ZINC000853991413	ED	On-Demand	Anodyne	MTNR1A	64	37
COc1ccc2cc(NC(=O)C(=O)NCCOCCF)ccc2c1	ZINC000853991413	ED	On-Demand	Anodyne	MTNR1B	54	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(F)c(F)c1	ZINC000853991447	GF	On-Demand	Anodyne	F13A1	16	43
COCCN(CCF)C(=O)NC(c1ccccc1C)c1ccccc1C	ZINC000853991472	FI	On-Demand	Anodyne	CTSA	40	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(F)nc1	ZINC000853991485	GD	On-Demand	Anodyne	GPR119	41	40
CN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853991488	GG	On-Demand	Anodyne	OPRL1	17	52
CN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853991488	GG	On-Demand	Anodyne	TIMP3	48	35
CN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@H](CO)Cc1ccccc1	ZINC000853991488	GG	On-Demand	Anodyne	NPY5R	15	40
CN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853991489	GG	On-Demand	Anodyne	OPRL1	17	52
CN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853991489	GG	On-Demand	Anodyne	TIMP3	48	35
CN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@@H](CO)Cc1ccccc1	ZINC000853991489	GG	On-Demand	Anodyne	NPY5R	15	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccnc1	ZINC000853991490	FD	On-Demand	Anodyne	GPR119	31	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccnc1	ZINC000853991490	FD	On-Demand	Anodyne	NAMPT	15	45
O=C(Nc1ccc(Oc2cccnc2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@H](CO)C2	ZINC000853991495	GE	On-Demand	Anodyne	CHRNA7	24	41
O=C(Nc1ccc(Oc2cccnc2)cc1)C(=O)N1C[C@H]2CC[C@H]1[C@@H](CO)C2	ZINC000853991496	GE	On-Demand	Anodyne	CHRNA7	24	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(c2ccco2)CC1	ZINC000853991503	FH	On-Demand	Anodyne	SMO	20	42
CCn1cc(NC(=O)C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cn1	ZINC000853991513	GD	On-Demand	Anodyne	PANC	53	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cnn(CC#N)c1	ZINC000853991517	GC	On-Demand	Mild	PANC	50	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccccc1	ZINC000853991520	FE	On-Demand	Anodyne	GPR119	27	41
COC[C@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)c1cccc(OC)c1	ZINC000853991530	GH	On-Demand	Anodyne	OPRL1	18	46
COC[C@@H](NC(=O)NC1CCC(O)(c2ccccc2)CC1)c1cccc(OC)c1	ZINC000853991531	GH	On-Demand	Anodyne	OPRL1	18	46
COc1cc(NC(=O)C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccn1	ZINC000853991537	GD	On-Demand	Anodyne	GPR119	27	43
O=C(NCCOCCF)C(=O)Nc1ccc(OCc2cccnc2)cc1	ZINC000853991556	FD	On-Demand	Anodyne	NAMPT	36	44
COCCN(CCF)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991563	EE	On-Demand	Anodyne	KCNA3	40	39
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853991571	GE	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853991572	GE	On-Demand	Anodyne	L3MBTL3	41	34
O=C(NC1CCC(O)(c2ccccc2)CC1)NC1CC(CO)C1	ZINC000853991574	DD	On-Demand	Anodyne	EPHX2	17	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853991581	DD	On-Demand	Anodyne	OPRL1	16	44
O=C(NC1CCC(O)(c2ccccc2)CC1)N[C@H]1C[C@H](O)C1	ZINC000853991581	DD	On-Demand	Anodyne	EPHX2	26	41
Cc1c(F)cccc1NC(=O)C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853991591	GF	On-Demand	Anodyne	GPR119	36	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccnc1F	ZINC000853991614	GD	On-Demand	Anodyne	GPR119	41	40
C=CCC1(NC(=O)NC2CCC(O)(c3ccccc3)CC2)CCCC1	ZINC000853991619	EI	On-Demand	Mild	KCNA3	20	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(C#N)cc1	ZINC000853991656	GE	On-Demand	Mild	DHODH	18	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(C#N)cc1	ZINC000853991656	GE	On-Demand	Mild	CTRB_BOVIN	44	31
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1ccc(C#N)cc1	ZINC000853991656	GE	On-Demand	Mild	GPR119	23	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccc(C#N)c1	ZINC000853991682	GE	On-Demand	Mild	GPR119	23	43
CN(C[C@@H]1CC1(C)C)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991690	EH	On-Demand	Anodyne	KCNA3	16	41
O=[N+]([O-])c1ccc(N2CC3CC2(c2ccccc2)C3)c2nonc12	ZINC000853991708	DG	On-Demand	Bother	GSTM2	100	44
O=[N+]([O-])c1ccc(N2CC3CC2(c2ccccc2)C3)c2nonc12	ZINC000853991708	DG	On-Demand	Bother	GSTP1	60	44
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCOCC2)c(F)c1	ZINC000853991723	FC	On-Demand	Anodyne	NPY2R	70	37
C=CCN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@H](C)COC	ZINC000853991729	EG	On-Demand	Mild	KCNA3	30	46
C=CCN(C(=O)NC1CCC(O)(c2ccccc2)CC1)[C@@H](C)COC	ZINC000853991730	EG	On-Demand	Mild	KCNA3	30	46
COc1cncnc1NC(=O)C(=O)N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853991738	GD	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cc(F)ccc1F	ZINC000853991739	GF	On-Demand	Anodyne	GPR119	31	43
CON(C)CCNC(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991780	DD	On-Demand	Anodyne	KCNA3	45	44
CON(C)CCNC(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991780	DD	On-Demand	Anodyne	EPHX2	15	45
COC(=O)N(C)CCNC(=O)NCC1(c2ccccc2OC)CCC1	ZINC000853991786	EE	On-Demand	Anodyne	KCNA3	46	38
Cc1ncc(NC(=O)C(=O)N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cn1	ZINC000853991810	GD	On-Demand	Anodyne	GPR119	34	40
CC(C)(C)N1C[C@@H](CNC(=O)NC2CCC(O)(c3ccccc3)CC2)CC1=O	ZINC000853991820	GF	On-Demand	Anodyne	CCR1	15	41
CC(C)(C)N1C[C@H](CNC(=O)NC2CCC(O)(c3ccccc3)CC2)CC1=O	ZINC000853991821	GF	On-Demand	Anodyne	CCR1	15	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(c2ccon2)CC1	ZINC000853991845	FG	On-Demand	Anodyne	EPHX2	24	43
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(c2ccon2)CC1	ZINC000853991845	FG	On-Demand	Anodyne	SMO	40	49
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000853991871	ED	On-Demand	Anodyne	EPHX2	19	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1C[C@H]2CC[C@@H](C2)C1	ZINC000853991879	EG	On-Demand	Anodyne	OPRL1	16	40
O=C(NCCOCCF)C(=O)Nc1cccnc1Cl	ZINC000853991883	CC	On-Demand	Anodyne	G2YM83_BOTF4	65	34
CN(c1ccccc1)[C@@H]1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853991887	GH	On-Demand	Anodyne	OPRL1	20	44
CN(c1ccccc1)[C@H]1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853991888	GH	On-Demand	Anodyne	OPRL1	20	44
C=CCCC(C)(C)NC(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991923	EH	On-Demand	Mild	KCNA3	23	41
CN(CC(=O)N1CCCC1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991955	FE	On-Demand	Anodyne	OPRL1	21	47
CN(CC(=O)N1CCCC1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991955	FE	On-Demand	Anodyne	SIGMAR1	17	42
CN(CC(=O)N1CCCC1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991955	FE	On-Demand	Anodyne	PREP	44	39
CN(CC(=O)N1CCCC1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991955	FE	On-Demand	Anodyne	EPHX2	30	40
CN(CC(=O)N1CCCC1)C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853991955	FE	On-Demand	Anodyne	SLC12A5	45	33
O=C(NCCC[C@H]1CCCCO1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853991975	EF	On-Demand	Reactive	TBXA2R	15	41
O=C(NCCC[C@@H]1CCCCO1)NNc1ccc([N+](=O)[O-])cc1F	ZINC000853991977	EF	On-Demand	Reactive	TBXA2R	15	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC2(COC2)C1	ZINC000853991980	EE	On-Demand	Anodyne	EPHX2	29	41
CCN1CC[C@@H](N(CC)C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853991982	FF	On-Demand	Anodyne	OPRL1	19	43
CCN1CC[C@@H](N(CC)C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853991982	FF	On-Demand	Anodyne	CCR5	40	45
CCN1CC[C@H](N(CC)C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853991984	FF	On-Demand	Anodyne	OPRL1	19	43
CCN1CC[C@H](N(CC)C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853991984	FF	On-Demand	Anodyne	CCR5	40	45
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCSCC2)c(Cl)c1	ZINC000853991990	GD	On-Demand	Anodyne	NPY2R	55	38
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000853992021	ED	On-Demand	Anodyne	NPY2R	78	37
CCOc1nc(N2CCC(NC(=O)OC)CC2)ncc1Cl	ZINC000853992028	DD	On-Demand	Anodyne	SSTR5	42	37
CCOc1cncc(N2CCC(NC(=O)OC)CC2)n1	ZINC000853992061	CD	On-Demand	Anodyne	SSTR5	49	42
CCOc1cc(N2CCC(NC(=O)OC)CC2)nc(C)n1	ZINC000853992077	CD	On-Demand	Anodyne	SSTR5	52	37
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000853992085	FD	On-Demand	Anodyne	KCNQ2	55	35
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000853992085	FD	On-Demand	Anodyne	NPY2R	70	40
CCOC(=O)N1CCN(C(=O)[C@H](C)Sc2nnc(CN3CCCC3)n2Cc2ccccc2)CC1	ZINC000853992089	JF	On-Demand	Anodyne	P2RY12	94	41
CCOC(=O)N1CCN(C(=O)[C@@H](C)Sc2nnc(CN3CCCC3)n2Cc2ccccc2)CC1	ZINC000853992091	JF	On-Demand	Anodyne	P2RY12	94	41
CCn1c(=O)c(N2CCC(NC(=O)OC)CC2)nc2ccccc21	ZINC000853992134	ED	On-Demand	Anodyne	HRH1	34	41
CCn1c(=O)c(N2CCC(NC(=O)OC)CC2)nc2ccccc21	ZINC000853992134	ED	On-Demand	Anodyne	PDE6D	76	39
O=C(NCCC[C@H]1CCCCO1)NNc1nc2ccc(Cl)cc2s1	ZINC000853992164	FH	On-Demand	Reactive	LCK	21	40
O=C(NCCC[C@@H]1CCCCO1)NNc1nc2ccc(Cl)cc2s1	ZINC000853992166	FH	On-Demand	Reactive	LCK	21	40
O=C(NCC1CCC(O)CC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992178	EF	On-Demand	Anodyne	GRIN2B	25	47
O=C(NCC1CCC(O)CC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992178	EF	On-Demand	Anodyne	KCNA3	39	42
O=C(NCC1CCC(O)CC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992178	EF	On-Demand	Anodyne	EPHX2	16	42
C[C@@H]1COCCN1c1ccc(NC(=O)C(=O)NCCOCCF)cc1	ZINC000853992181	FC	On-Demand	Anodyne	MTOR	58	43
C[C@H](Sc1nnc(CN2CCCC2)n1Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853992211	JJ	On-Demand	Anodyne	AGTR1	17	43
C[C@H](Sc1nnc(CN2CCCC2)n1Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853992211	JJ	On-Demand	Anodyne	KCNQ2	22	46
C[C@@H](Sc1nnc(CN2CCCC2)n1Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853992215	JJ	On-Demand	Anodyne	AGTR1	17	43
C[C@@H](Sc1nnc(CN2CCCC2)n1Cc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853992215	JJ	On-Demand	Anodyne	KCNQ2	22	46
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(N2CCOC2=O)CC1	ZINC000853992224	GE	On-Demand	Anodyne	EPHX2	18	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853992238	EH	On-Demand	Anodyne	OPRL1	16	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853992240	EH	On-Demand	Anodyne	OPRL1	16	42
CN1CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)CCC1=O	ZINC000853992249	ED	On-Demand	Anodyne	EPHX2	23	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CO)(CO)C1	ZINC000853992251	ED	On-Demand	Anodyne	OPRL1	17	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(CO)(CO)C1	ZINC000853992251	ED	On-Demand	Anodyne	EPHX2	28	40
COC(=O)Cc1ccnc(N2CCC(NC(=O)OC)CC2)c1	ZINC000853992254	DD	On-Demand	Anodyne	SSTR5	42	34
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853992255	GH	On-Demand	Anodyne	SMO	23	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC([C@H]2CCCCO2)CC1	ZINC000853992257	GH	On-Demand	Anodyne	SMO	23	41
CC[C@@](C)(NC(=O)NC1CCC(O)(c2ccccc2)CC1)C1CC1	ZINC000853992268	EH	On-Demand	Anodyne	CCR1	21	40
CC1C[C@@H]2CC[C@H](C1)N2C(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992304	EH	On-Demand	Anodyne	OPRL1	21	41
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	HTR1A	23	42
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	HTR1D	50	42
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	HTR1B	45	42
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	METAP1	37	40
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	MTNR1A	15	41
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	MTNR1B	15	41
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	MCHR1	20	43
CCCc1cc(N2CCC(NC(=O)OC)CC2)c2ccccc2n1	ZINC000853992317	EH	On-Demand	Anodyne	TNKS	45	30
CNS(=O)(=O)c1ccc(N2CCC(NC(=O)OC)CC2)c(F)c1	ZINC000853992346	ED	On-Demand	Anodyne	SLC6A9	25	46
CN1CCCN(c2ccc(NC(=O)C(=O)NCCOCCF)cc2)CC1	ZINC000853992413	FC	On-Demand	Anodyne	PRNP	37	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992441	GG	On-Demand	Anodyne	CCR1	24	42
O=C(NCC(O)(C1CC1)C1CC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992457	FF	On-Demand	Anodyne	CCR1	20	47
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCc2nccnc2C1	ZINC000853992458	FE	On-Demand	Anodyne	EPHX2	16	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC[C@](O)(C2CC2)C1	ZINC000853992459	FF	On-Demand	Anodyne	EPHX2	22	45
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC[C@@](O)(C2CC2)C1	ZINC000853992460	FF	On-Demand	Anodyne	EPHX2	22	45
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000853992482	FE	On-Demand	Anodyne	KCNQ2	49	34
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000853992482	FE	On-Demand	Anodyne	NPY2R	62	41
O=C(NCCOCCF)C(=O)Nc1ccccc1N1CCOC1=O	ZINC000853992483	EC	On-Demand	Anodyne	KCNQ2	50	33
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853992493	DF	On-Demand	Anodyne	RBP4	45	32
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H]2C[C@H]2C1	ZINC000853992494	DF	On-Demand	Anodyne	RBP4	45	32
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853992495	DF	On-Demand	Anodyne	RBP4	45	32
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853992496	DF	On-Demand	Anodyne	RBP4	45	32
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853992512	GH	On-Demand	Anodyne	EPHX2	50	46
CNc1nc(N2CCC(NC(=O)OC)CC2)nc2ccccc12	ZINC000853992539	DD	On-Demand	Anodyne	HTR3A	23	59
CNc1nc(N2CCC(NC(=O)OC)CC2)nc2ccccc12	ZINC000853992539	DD	On-Demand	Anodyne	HRH4	17	41
CNc1nc(N2CCC(NC(=O)OC)CC2)nc2ccccc12	ZINC000853992539	DD	On-Demand	Anodyne	TNKS	50	31
CNc1nc(N2CCC(NC(=O)OC)CC2)nc2ccccc12	ZINC000853992539	DD	On-Demand	Anodyne	EHMT2	46	38
O=C(NCCOCCF)C(=O)Nc1cccc(COc2ccccc2)c1	ZINC000853992551	FE	On-Demand	Anodyne	FFAR1	30	40
O=C(NCCOCCF)C(=O)Nc1cccc(COc2ccccc2)c1	ZINC000853992551	FE	On-Demand	Anodyne	PDS	44	33
COCc1cc(N2CCC(NC(=O)OC)CC2)c2cc(F)ccc2n1	ZINC000853992588	EF	On-Demand	Anodyne	DHODH	48	37
COCc1cc(N2CCC(NC(=O)OC)CC2)c2cc(F)ccc2n1	ZINC000853992588	EF	On-Demand	Anodyne	MCHR1	18	41
COC(=O)c1cc(NC(=O)C(=O)NCCOCCF)ccc1F	ZINC000853992629	EC	On-Demand	Anodyne	DHODH	16	40
CC[C@@H](O)CNC(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992640	DD	On-Demand	Anodyne	OPRL1	20	47
CC[C@@H](O)CNC(=O)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992640	DD	On-Demand	Anodyne	EPHX2	20	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(O)(CO)CC1	ZINC000853992645	ED	On-Demand	Anodyne	OPRL1	20	42
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(O)(CO)CC1	ZINC000853992645	ED	On-Demand	Anodyne	SIGMAR1	17	40
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CCC(O)(CO)CC1	ZINC000853992645	ED	On-Demand	Anodyne	EPHX2	33	45
c1ccc(C23CC(CN2c2nccc(N4CCCC4)n2)C3)cc1	ZINC000853992646	DG	On-Demand	Anodyne	SORD	60	36
COC(=O)c1cnc(N2CC3CC2(c2ccccc2)C3)cc1C(F)(F)F	ZINC000853992658	FI	On-Demand	Anodyne	RBP4	52	36
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCCCCCC2)c(F)c1	ZINC000853992674	GF	On-Demand	Anodyne	NPY2R	81	37
C[C@@]1(C#N)CCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853992678	EF	On-Demand	Mild	EPHX2	22	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H]2COC[C@H]2C1	ZINC000853992706	EE	On-Demand	Anodyne	EPHX2	31	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853992707	EE	On-Demand	Anodyne	EPHX2	31	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853992708	EE	On-Demand	Anodyne	EPHX2	31	41
O=C(NC1CCC(O)(c2ccccc2)CC1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853992709	EE	On-Demand	Anodyne	EPHX2	31	41
O=C(NCC1(O)CCC(F)(F)CC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992712	GG	On-Demand	Anodyne	KCNA3	39	42
O=C(NCC1(O)CCC(F)(F)CC1)NC1CCC(O)(c2ccccc2)CC1	ZINC000853992712	GG	On-Demand	Anodyne	EPHX2	15	42
Cc1ccc(CC2CN(C(=O)NC3CCC(O)(c4ccccc4)CC3)C2)cc1	ZINC000853992721	GI	On-Demand	Anodyne	GRIN2B	37	45
Cc1ccc(CC2CN(C(=O)NC3CCC(O)(c4ccccc4)CC3)C2)cc1	ZINC000853992721	GI	On-Demand	Anodyne	SIGMAR1	18	41
CCc1ncnc(N2CCC(NC(=O)OC)CC2)c1F	ZINC000853992733	CD	On-Demand	Anodyne	SIRT3	62	37
CCc1ncnc(N2CCC(NC(=O)OC)CC2)c1F	ZINC000853992733	CD	On-Demand	Anodyne	SIRT2	54	37
CCc1ncnc(N2CCC(NC(=O)OC)CC2)c1F	ZINC000853992733	CD	On-Demand	Anodyne	SIRT1	51	32
CCOC(=O)c1nccc(N2CCC(NC(=O)OC)CC2)n1	ZINC000853992738	DC	On-Demand	Anodyne	SSTR5	42	34
CCOC(=O)c1nccc(N2CCC(NC(=O)OC)CC2)n1	ZINC000853992738	DC	On-Demand	Anodyne	SORD	58	42
CCOc1cc(N2CCC(NC(=O)OC)CC2)c(F)cn1	ZINC000853992770	CD	On-Demand	Anodyne	SSTR5	47	41
CCOc1cc(N2CCC(NC(=O)OC)CC2)ncn1	ZINC000853992778	CD	On-Demand	Anodyne	SSTR5	48	36
CCOC(=O)c1cc(N2CCC(NC(=O)OC)CC2)ncc1Cl	ZINC000853992782	EE	On-Demand	Anodyne	HTR4	50	39
CCOC(=O)c1cc(N2CCC(NC(=O)OC)CC2)ncc1Cl	ZINC000853992782	EE	On-Demand	Anodyne	P2RY12	23	40
CCOC(=O)c1cc(N2CCC(NC(=O)OC)CC2)ncc1Cl	ZINC000853992782	EE	On-Demand	Anodyne	SSTR5	43	37
CCc1nc2ccccc2c(N2CCC(NC(=O)OC)CC2)c1C	ZINC000853992805	EG	On-Demand	Anodyne	TNKS	50	31
NS(=O)(=O)c1cc(CNc2ncc3c(n2)CCCC3)ccc1F	ZINC000853992911	ED	On-Demand	Anodyne	MAPK1	31	40
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853992929	EE	On-Demand	Anodyne	OPRL1	18	44
COC(=O)[C@@H]1C[C@@H](NC(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853992929	EE	On-Demand	Anodyne	KCNA3	39	42
NS(=O)(=O)c1cc(CNc2nccc(N3CCCC3)n2)ccc1F	ZINC000853992974	FD	On-Demand	Anodyne	MRGPRX1	46	44
NS(=O)(=O)c1cc(CNc2nccc(N3CCCC3)n2)ccc1F	ZINC000853992974	FD	On-Demand	Anodyne	SMG1	42	43
CO[C@]1(CO)CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853993015	FD	On-Demand	Anodyne	SIGMAR1	18	41
CO[C@]1(CO)CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853993015	FD	On-Demand	Anodyne	EPHX2	26	44
CO[C@]1(CO)CCCN(C(=O)NC2CCC(O)(c3ccccc3)CC2)C1	ZINC000853993015	FD	On-Demand	Anodyne	SLC12A5	48	35
Cc1nnc(CN(C)C(=O)NC2CCC(O)(c3ccccc3)CC2)s1	ZINC000853993018	FF	On-Demand	Anodyne	KCNA3	15	41
Cn1nccc1CCNC(=O)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853993048	DD	On-Demand	Anodyne	CPT1A	82	37
Cn1nccc1CCNC(=O)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853993049	DD	On-Demand	Anodyne	CPT1A	82	37
COC(=O)Nc1cccc(NC(=O)C(=O)NCCOCCF)c1	ZINC000853993067	EC	On-Demand	Anodyne	NQO2	22	40
COC(=O)Nc1cccc(NC(=O)C(=O)NCCOCCF)c1	ZINC000853993067	EC	On-Demand	Anodyne	KCNK3	64	35
COC(=O)Nc1cccc(NC(=O)C(=O)NCCOCCF)c1	ZINC000853993067	EC	On-Demand	Anodyne	KCNK9	65	35
Cn1nccc1CCNC(=O)N1CCn2c(O)nnc2C1	ZINC000853993070	CB	On-Demand	Anodyne	P2RX7	15	41
N#CCOc1cccc(NC(=O)C(=O)NCCOCCF)c1	ZINC000853993099	DC	On-Demand	Mild	ADRB1	23	42
COc1ccc(NC(=O)C(=O)NCCOCCF)cc1OC1CCCC1	ZINC000853993104	FE	On-Demand	Anodyne	PDE4A	44	48
COc1ccc(NC(=O)C(=O)NCCOCCF)cc1OC1CCCC1	ZINC000853993104	FE	On-Demand	Anodyne	PDE4B	20	48
COc1ccc(NC(=O)C(=O)NCCOCCF)cc1OC1CCCC1	ZINC000853993104	FE	On-Demand	Anodyne	PDE4D	23	48
COc1ccc(NC(=O)C(=O)NCCOCCF)cc1OC1CCCC1	ZINC000853993104	FE	On-Demand	Anodyne	PDE4C	17	48
COc1ccc(NC(=O)C(=O)NCCOCCF)cc1OC1CCCC1	ZINC000853993104	FE	On-Demand	Anodyne	QRFPR	40	32
COc1ccc(NC(=O)C(=O)NCCOCCF)cc1OC1CCCC1	ZINC000853993104	FE	On-Demand	Anodyne	ENPP1	49	30
CCOc1cc2nccc(N3CCC(NC(=O)OC)CC3)c2cc1OCC	ZINC000853993107	FG	On-Demand	Anodyne	PDE3A	40	39
CCOc1cc2nccc(N3CCC(NC(=O)OC)CC3)c2cc1OCC	ZINC000853993107	FG	On-Demand	Anodyne	PDGFRB	49	44
CCOc1cc2nccc(N3CCC(NC(=O)OC)CC3)c2cc1OCC	ZINC000853993107	FG	On-Demand	Anodyne	SSTR5	84	44
CCOc1cc2nccc(N3CCC(NC(=O)OC)CC3)c2cc1OCC	ZINC000853993107	FG	On-Demand	Anodyne	KDR	44	38
CCOc1cc2nccc(N3CCC(NC(=O)OC)CC3)c2cc1OCC	ZINC000853993107	FG	On-Demand	Anodyne	PDE3B	44	39
CCOc1cc2nccc(N3CCC(NC(=O)OC)CC3)c2cc1OCC	ZINC000853993107	FG	On-Demand	Anodyne	PDGFRA	46	41
CCOc1cc2nccc(N3CCC(NC(=O)OC)CC3)c2cc1OCC	ZINC000853993107	FG	On-Demand	Anodyne	EHMT2	62	34
COC[C@H](NC(=O)NCCc1ccnn1C)c1cccc(OC)c1	ZINC000853993126	ED	On-Demand	Anodyne	DRD4	40	31
COC[C@H](NC(=O)NCCc1ccnn1C)c1cccc(OC)c1	ZINC000853993126	ED	On-Demand	Anodyne	MTNR1A	54	39
COC[C@H](NC(=O)NCCc1ccnn1C)c1cccc(OC)c1	ZINC000853993126	ED	On-Demand	Anodyne	MTNR1B	50	39
COC[C@@H](NC(=O)NCCc1ccnn1C)c1cccc(OC)c1	ZINC000853993127	ED	On-Demand	Anodyne	DRD4	40	31
COC[C@@H](NC(=O)NCCc1ccnn1C)c1cccc(OC)c1	ZINC000853993127	ED	On-Demand	Anodyne	MTNR1A	54	39
COC[C@@H](NC(=O)NCCc1ccnn1C)c1cccc(OC)c1	ZINC000853993127	ED	On-Demand	Anodyne	MTNR1B	50	39
CCCNC(=O)c1ccc(N2CCC(NC(=O)OC)CC2)nc1	ZINC000853993142	DD	On-Demand	Anodyne	SSTR5	46	41
CCCNC(=O)c1ccc(N2CCC(NC(=O)OC)CC2)nc1	ZINC000853993142	DD	On-Demand	Anodyne	SCD1	19	41
CCCNC(=O)c1ccc(N2CCC(NC(=O)OC)CC2)nc1	ZINC000853993142	DD	On-Demand	Anodyne	HPGDS	40	52
COCc1cc([N+](=O)[O-])ccc1N1CCC(NC(=O)OC)CC1	ZINC000853993147	DE	On-Demand	Bother	CACNA1C	51	37
COCc1cc([N+](=O)[O-])ccc1N1CCC(NC(=O)OC)CC1	ZINC000853993147	DE	On-Demand	Bother	CACNA1D	78	37
Cn1nccc1CCNC(=O)N1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000853993157	ED	On-Demand	Anodyne	SLC6A3	15	42
C[C@H]1CN(c2ccc(NC(=O)C(=O)NCCOCCF)cc2F)C[C@@H](C)O1	ZINC000853993164	GD	On-Demand	Anodyne	NPY2R	62	33
C[C@H]1CN(c2ccc(NC(=O)C(=O)NCCOCCF)cc2F)C[C@H](C)O1	ZINC000853993166	GD	On-Demand	Anodyne	NPY2R	62	33
CCOC(=O)c1c(N2CCC(NC(=O)OC)CC2)nc2ccccc2c1C	ZINC000853993205	FG	On-Demand	Anodyne	HTR3A	17	42
CCOC(=O)c1c(N2CCC(NC(=O)OC)CC2)nc2ccccc2c1C	ZINC000853993205	FG	On-Demand	Anodyne	P2RY12	34	41
CCOC(=O)c1c(N2CCC(NC(=O)OC)CC2)nc2ccccc2c1C	ZINC000853993205	FG	On-Demand	Anodyne	SSTR5	19	41
CCOC(=O)c1c(N2CCC(NC(=O)OC)CC2)nc2ccccc2c1C	ZINC000853993205	FG	On-Demand	Anodyne	TNKS	41	33
CCn1cnc2c(N3CCC(NC(=O)OC)CC3)ncnc21	ZINC000853993245	DD	On-Demand	Anodyne	ADORA1	15	48
CCn1cnc2c(N3CCC(NC(=O)OC)CC3)ncnc21	ZINC000853993245	DD	On-Demand	Anodyne	OXGR1	43	34
CCn1cnc2c(N3CCC(NC(=O)OC)CC3)ncnc21	ZINC000853993245	DD	On-Demand	Anodyne	SIRT3	73	38
CCn1cnc2c(N3CCC(NC(=O)OC)CC3)ncnc21	ZINC000853993245	DD	On-Demand	Anodyne	SIRT2	60	38
CCn1cnc2c(N3CCC(NC(=O)OC)CC3)ncnc21	ZINC000853993245	DD	On-Demand	Anodyne	SIRT1	52	33
Cn1nccc1CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853993261	GD	On-Demand	Anodyne	HTR1A	27	43
Cn1nccc1CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853993261	GD	On-Demand	Anodyne	DRD2	16	42
Cn1nccc1CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853993261	GD	On-Demand	Anodyne	HTR2A	18	40
Cn1nccc1CCNC(=O)NC1(CN2CCN(c3ccccc3)CC2)CC1	ZINC000853993261	GD	On-Demand	Anodyne	DRD3	23	40
Cn1nccc1CCNC(=O)N1CCC[C@@H]1c1nccc(C(F)(F)F)n1	ZINC000853993262	FE	On-Demand	Anodyne	GPBAR1	17	43
Cn1nccc1CCNC(=O)N1CCC[C@H]1c1nccc(C(F)(F)F)n1	ZINC000853993263	FE	On-Demand	Anodyne	GPBAR1	17	43
CCOc1cc(N2CCC(NC(=O)OC)CC2)ccc1[N+](=O)[O-]	ZINC000853993278	DE	On-Demand	Bother	SSTR5	50	35
Cn1nccc1CCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853993395	FD	On-Demand	Anodyne	CCR3	22	41
Cn1nccc1CCNC(=O)NCc1ccc(CN2CC[C@@H](O)C2)cc1	ZINC000853993395	FD	On-Demand	Anodyne	MCHR1	18	40
Cn1nccc1CCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853993396	FD	On-Demand	Anodyne	CCR3	22	41
Cn1nccc1CCNC(=O)NCc1ccc(CN2CC[C@H](O)C2)cc1	ZINC000853993396	FD	On-Demand	Anodyne	MCHR1	18	40
CCN1CC[C@H](N(CC)C(=O)NCCc2ccnn2C)C1	ZINC000853993416	CD	On-Demand	Anodyne	CCR5	19	43
CCN1CC[C@@H](N(CC)C(=O)NCCc2ccnn2C)C1	ZINC000853993417	CD	On-Demand	Anodyne	CCR5	19	43
C#CCNC(=O)c1ccc(N2CCC(NC(=O)OC)CC2)nc1	ZINC000853993422	DC	On-Demand	Mild	HPGDS	36	51
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853993454	EC	On-Demand	Anodyne	MTOR	52	37
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853993454	EC	On-Demand	Anodyne	EPHX2	20	42
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853993454	EC	On-Demand	Anodyne	STAT6	54	32
C=CCNC(=O)c1ccc(N2CCC(NC(=O)OC)CC2)nc1	ZINC000853993467	DD	On-Demand	Mild	HPGDS	35	48
CCOC(=O)c1nnc2ccccc2c1N1CCC(NC(=O)OC)CC1	ZINC000853993474	FE	On-Demand	Anodyne	SSTR5	42	38
CCn1c(-c2ccccc2)nnc1N1CCC(NC(=O)OC)CC1	ZINC000853993503	EE	On-Demand	Anodyne	PDE6D	49	37
Cc1cc(NC(=O)C(=O)NCC2(O)CCC(C)CC2)ccc1N1CCOCC1	ZINC000853993518	GD	On-Demand	Anodyne	MTOR	42	34
O=C(NCCOCCF)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000853993551	FD	On-Demand	Anodyne	NPY2R	45	37
CCOC(=O)N1CCN(C(=O)[C@@H](C)Sc2nnc(CN3CCCC3)n2-c2ccccc2)CC1	ZINC000853993581	JF	On-Demand	Anodyne	P2RY12	149	38
CCOC(=O)N1CCN(C(=O)[C@H](C)Sc2nnc(CN3CCCC3)n2-c2ccccc2)CC1	ZINC000853993582	JF	On-Demand	Anodyne	P2RY12	149	38
C[C@@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)NCCc1ccnn1C	ZINC000853993633	GH	On-Demand	Anodyne	MME	66	34
Cn1nccc1CCNC(=O)N(CCN1CCOCC1)CC1CC1	ZINC000853993635	EC	On-Demand	Anodyne	CASR	52	39
COc1cccc(C2(NC(=O)NCCc3ccnn3C)CCC2)c1	ZINC000853993667	EE	On-Demand	Anodyne	DRD4	42	32
COc1cccc(C2(NC(=O)NCCc3ccnn3C)CCC2)c1	ZINC000853993667	EE	On-Demand	Anodyne	MTNR1A	49	37
COc1cccc(C2(NC(=O)NCCc3ccnn3C)CCC2)c1	ZINC000853993667	EE	On-Demand	Anodyne	MTNR1B	41	35
Cn1nccc1CCNC(=O)N1CCC2(COC2)C1	ZINC000853993757	CC	On-Demand	Anodyne	EPHX2	15	40
COC(=O)c1cc(NC(=O)C(=O)NCC2(O)CCC(C)CC2)ccc1F	ZINC000853993766	FD	On-Demand	Anodyne	ENV	40	34
Cn1nccc1CCNC(=O)N1CCC[C@H](N2CCOCC2)CC1	ZINC000853993944	EC	On-Demand	Anodyne	L3MBTL3	87	39
Cn1nccc1CCNC(=O)N1CCC[C@@H](N2CCOCC2)CC1	ZINC000853993945	EC	On-Demand	Anodyne	L3MBTL3	87	39
C[C@H](Sc1nnc(CN2CCCC2)n1-c1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853994037	JJ	On-Demand	Anodyne	KCNQ2	20	48
C[C@@H](Sc1nnc(CN2CCCC2)n1-c1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853994038	JJ	On-Demand	Anodyne	KCNQ2	20	48
CN1CCN(c2ccccc2NC(=O)C(=O)NCCOCCF)CC1	ZINC000853994055	FC	On-Demand	Anodyne	DRD2	33	43
CN1CCN(c2ccccc2NC(=O)C(=O)NCCOCCF)CC1	ZINC000853994055	FC	On-Demand	Anodyne	DRD4	21	41
CN1CCN(c2ccccc2NC(=O)C(=O)NCCOCCF)CC1	ZINC000853994055	FC	On-Demand	Anodyne	DRD3	52	43
CN1CCN(c2ccccc2NC(=O)C(=O)NCCOCCF)CC1	ZINC000853994055	FC	On-Demand	Anodyne	KCNQ2	76	39
COC(=O)c1cnc([C@@H]2CCCN(c3ncnc4sc(C)cc34)C2)s1	ZINC000853994121	FH	On-Demand	Anodyne	SIRT3	55	32
COC(=O)c1cnc([C@@H]2CCCN(c3ncnc4sc(C)cc34)C2)s1	ZINC000853994121	FH	On-Demand	Anodyne	SIRT2	45	31
COC(=O)c1cnc([C@H]2CCCN(c3ncnc4sc(C)cc34)C2)s1	ZINC000853994122	FH	On-Demand	Anodyne	SIRT3	55	32
COC(=O)c1cnc([C@H]2CCCN(c3ncnc4sc(C)cc34)C2)s1	ZINC000853994122	FH	On-Demand	Anodyne	SIRT2	45	31
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCC1SCCS1	ZINC000853994144	FD	On-Demand	Anodyne	STAT6	44	33
COC(=O)c1cnc([C@@H]2CCCN(c3ccnc(C(C)C)n3)C2)s1	ZINC000853994174	EG	On-Demand	Anodyne	SORD	103	38
COC(=O)c1cnc([C@H]2CCCN(c3ccnc(C(C)C)n3)C2)s1	ZINC000853994175	EG	On-Demand	Anodyne	SORD	103	38
O=C(NCCC1SCCS1)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000853994176	GE	On-Demand	Anodyne	STAT6	44	32
COC(=O)c1cnc([C@@H]2CCCN(c3nnc(Cl)cc3C(N)=O)C2)s1	ZINC000853994182	GD	On-Demand	Anodyne	SIRT3	44	32
COC(=O)c1cnc([C@H]2CCCN(c3nnc(Cl)cc3C(N)=O)C2)s1	ZINC000853994183	GD	On-Demand	Anodyne	SIRT3	44	32
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NNc1cc(F)cc(Cl)c1	ZINC000853994196	GF	On-Demand	Reactive	STAT6	55	36
Cc1nc(NC(=O)C(=O)NCC2(O)CCC(C)CC2)sc1-c1ccccc1	ZINC000853994211	GG	On-Demand	Anodyne	PIK3CG	19	40
CN(C[C@H]1CC1(C)C)c1nccc(N2CCCC2)n1	ZINC000853994232	CF	On-Demand	Anodyne	SORD	72	37
CN(C[C@@H]1CC1(C)C)c1nccc(N2CCCC2)n1	ZINC000853994233	CF	On-Demand	Anodyne	SORD	72	37
Cn1nccc1CCNC(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853994264	DD	On-Demand	Anodyne	EPHX2	24	44
COc1ccc2cc(NC(=O)C(=O)NCC3(O)CCC(C)CC3)ccc2c1	ZINC000853994273	FF	On-Demand	Anodyne	MTNR1A	44	36
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1ncccn1	ZINC000853994311	EC	On-Demand	Anodyne	SCN10A	18	41
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NCc1ncccn1	ZINC000853994311	EC	On-Demand	Anodyne	STAT6	57	35
COC(=O)N(C)CCNC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000853994351	FC	On-Demand	Anodyne	STAT6	43	31
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853994368	GE	On-Demand	Anodyne	STAT6	56	35
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853994370	GE	On-Demand	Anodyne	STAT6	56	35
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853994372	GE	On-Demand	Anodyne	STAT6	56	35
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853994374	GE	On-Demand	Anodyne	STAT6	56	35
O=C(NCc1cnc(N2CCOCC2)c(F)c1)NNC(=O)c1cccc(F)n1	ZINC000853994385	GC	On-Demand	Reactive	STAT6	56	36
CON(C)CCNC(=O)NCc1ccc(N2CCCS2(=O)=O)cc1	ZINC000853994421	FC	On-Demand	Anodyne	CDK1	16	40
CON(C)CCNC(=O)NCc1cccc(N2CCCS2(=O)=O)c1	ZINC000853994443	FC	On-Demand	Anodyne	CDK1	16	40
COC(=O)c1cnc([C@@H]2CCCN(c3nc(Cl)c(C#N)s3)C2)s1	ZINC000853994448	FG	On-Demand	Mild	PARE	47	33
COC(=O)c1cnc([C@H]2CCCN(c3nc(Cl)c(C#N)s3)C2)s1	ZINC000853994449	FG	On-Demand	Mild	PARE	47	33
CCCc1ccc(NC(=O)C(=O)NCC2(O)CCC(C)CC2)cc1	ZINC000853994450	EF	On-Demand	Anodyne	TIMP3	40	32
CON(C)CCNC(=O)N[C@@H]1c2ccccc2CCC[C@@H]1C	ZINC000853994451	DE	On-Demand	Anodyne	BIRC2	47	33
CON(C)CCNC(=O)N[C@@H]1c2ccccc2CCC[C@H]1C	ZINC000853994452	DE	On-Demand	Anodyne	BIRC2	47	33
CON(C)CCNC(=O)N[C@H]1c2ccccc2CCC[C@H]1C	ZINC000853994453	DE	On-Demand	Anodyne	BIRC2	47	33
CON(C)CCNC(=O)N[C@H]1c2ccccc2CCC[C@@H]1C	ZINC000853994454	DE	On-Demand	Anodyne	BIRC2	47	33
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@@H](c2ncc(C(=O)OC)s2)C1	ZINC000853994468	GG	On-Demand	Bother	CACNA1C	44	37
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@@H](c2ncc(C(=O)OC)s2)C1	ZINC000853994468	GG	On-Demand	Bother	CACNA1D	67	35
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H](c2ncc(C(=O)OC)s2)C1	ZINC000853994469	GG	On-Demand	Bother	CACNA1C	44	37
COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H](c2ncc(C(=O)OC)s2)C1	ZINC000853994469	GG	On-Demand	Bother	CACNA1D	67	35
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@@H]1C=CCC1	ZINC000853994478	DD	On-Demand	Anodyne	STAT6	43	32
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@H]1C=CCC1	ZINC000853994479	DD	On-Demand	Anodyne	STAT6	43	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cncc(C(N)=O)n1	ZINC000853994499	ED	On-Demand	Anodyne	GPR119	17	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C#N)nn1	ZINC000853994504	DD	On-Demand	Mild	GPR119	28	45
Cc1nnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)s1	ZINC000853994511	DE	On-Demand	Anodyne	GPR119	21	42
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccc1[N+](=O)[O-]	ZINC000853994514	EF	On-Demand	Bother	GPR119	25	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(Cl)nc(C2CC2)n1	ZINC000853994515	FH	On-Demand	Anodyne	GPR119	19	40
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc(C)n1	ZINC000853994518	DF	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(C#N)ncn1	ZINC000853994522	DD	On-Demand	Mild	GPR119	42	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnn(C(C)(C)C)c(=O)c1Cl	ZINC000853994524	GG	On-Demand	Anodyne	GPR119	18	41
CC(=O)c1ccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc1	ZINC000853994529	EF	On-Demand	Anodyne	GPR119	44	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(C(C)(C)C)n1	ZINC000853994531	EG	On-Demand	Anodyne	GPR119	53	53
COc1nc(C)cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853994541	EE	On-Demand	Anodyne	GPR119	20	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccccc2o1	ZINC000853994551	EG	On-Demand	Anodyne	GPR119	29	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2cc(C#N)ccc2n1	ZINC000853994555	FH	On-Demand	Mild	GPR119	21	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(C(N)=O)c1	ZINC000853994557	ED	On-Demand	Anodyne	GPR119	54	45
CC(C)n1cc2cc(NC(=O)C(=O)NC[C@@H]3CCCN(CC4CC4)C3)ccc2n1	ZINC000853994569	GF	On-Demand	Anodyne	CCR3	56	35
CC(C)n1cc2cc(NC(=O)C(=O)NC[C@H]3CCCN(CC4CC4)C3)ccc2n1	ZINC000853994571	GF	On-Demand	Anodyne	CCR3	56	35
Cc1cc(C)c([N+](=O)[O-])c(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853994573	FG	On-Demand	Bother	GPR119	25	42
CCCNC(=O)c1ccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc1	ZINC000853994577	FF	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncncc1Br	ZINC000853994589	FF	On-Demand	Anodyne	GPR119	39	45
CCOC(=O)c1coc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853994591	FE	On-Demand	Anodyne	GPR119	19	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(C#N)c2ccccc2n1	ZINC000853994593	FH	On-Demand	Mild	ADAM17	15	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(C#N)c2ccccc2n1	ZINC000853994593	FH	On-Demand	Mild	GPR119	21	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2ccsc12	ZINC000853994598	EG	On-Demand	Anodyne	SIRT3	53	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2ccsc12	ZINC000853994598	EG	On-Demand	Anodyne	SIRT2	54	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2ccsc12	ZINC000853994598	EG	On-Demand	Anodyne	SIRT1	53	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2ccsc12	ZINC000853994598	EG	On-Demand	Anodyne	GPR119	43	43
COC(=O)c1cnc([C@@H]2CCCN(c3ccc([N+](=O)[O-])c4nonc34)C2)s1	ZINC000853994616	GF	On-Demand	Bother	GSTM2	89	38
COC(=O)c1cnc([C@@H]2CCCN(c3ccc([N+](=O)[O-])c4nonc34)C2)s1	ZINC000853994616	GF	On-Demand	Bother	GSTP1	49	34
COC(=O)c1cnc([C@H]2CCCN(c3ccc([N+](=O)[O-])c4nonc34)C2)s1	ZINC000853994618	GF	On-Demand	Bother	GSTM2	89	38
COC(=O)c1cnc([C@H]2CCCN(c3ccc([N+](=O)[O-])c4nonc34)C2)s1	ZINC000853994618	GF	On-Demand	Bother	GSTP1	49	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c(N)c1F	ZINC000853994622	FF	On-Demand	Bother	GPR119	22	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2c(F)cccc2o1	ZINC000853994624	EH	On-Demand	Anodyne	GPR119	28	40
Cn1ncnc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853994629	CD	On-Demand	Anodyne	GPR119	40	45
CON(C)CCNC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000853994631	EC	On-Demand	Anodyne	STAT6	48	32
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(Cl)nc(N)n1	ZINC000853994639	EE	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(C(F)(F)F)s1	ZINC000853994642	FH	On-Demand	Anodyne	MLYCD	41	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(C(F)(F)F)s1	ZINC000853994642	FH	On-Demand	Anodyne	GPR119	37	45
C=CCNC(=O)c1ccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc1	ZINC000853994646	FF	On-Demand	Mild	GPR119	29	43
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(Br)nc1	ZINC000853994656	GE	On-Demand	Anodyne	CCR3	65	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc2occc12	ZINC000853994662	EG	On-Demand	Anodyne	GPR119	42	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(F)cn1	ZINC000853994665	DE	On-Demand	Anodyne	GPR119	54	59
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccncc1Cl	ZINC000853994668	DG	On-Demand	Anodyne	GPR119	39	45
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc(C(F)(F)F)n1	ZINC000853994671	FG	On-Demand	Anodyne	GPR119	38	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncncc1C#N	ZINC000853994674	DD	On-Demand	Mild	GPR119	41	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1c([N+](=O)[O-])cccc1[N+](=O)[O-]	ZINC000853994675	GG	On-Demand	Bother	GPR119	35	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(N2CCCCC2)n1	ZINC000853994678	FG	On-Demand	Anodyne	SORD	48	36
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(N2CCCCC2)n1	ZINC000853994678	FG	On-Demand	Anodyne	GPR119	41	49
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(Cl)n1	ZINC000853994682	DG	On-Demand	Anodyne	GPR119	39	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(C#N)n1	ZINC000853994695	DF	On-Demand	Mild	GPR119	29	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccncc1Br	ZINC000853994698	FG	On-Demand	Anodyne	GPR119	41	45
C#CCNC(=O)c1ccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc1	ZINC000853994701	FE	On-Demand	Mild	GPR119	37	44
COCc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ncn1	ZINC000853994704	EE	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(S(N)(=O)=O)s1	ZINC000853994706	FD	On-Demand	Anodyne	GPR119	43	48
COC(=O)c1cnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c([N+](=O)[O-])c1	ZINC000853994712	GE	On-Demand	Bother	GPR119	26	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncncc1Cl	ZINC000853994714	DF	On-Demand	Anodyne	GPR119	40	45
COC(=O)Cc1ccnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853994716	FE	On-Demand	Anodyne	GPR119	42	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(C(F)(F)F)c1	ZINC000853994732	FH	On-Demand	Anodyne	GPR119	56	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc(N)c2ccccc2n1	ZINC000853994734	FF	On-Demand	Anodyne	GPR119	28	45
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c2cnn(C)c2n1	ZINC000853994738	FE	On-Demand	Anodyne	GPR119	25	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(Cl)cn1	ZINC000853994740	DF	On-Demand	Anodyne	GPR119	43	59
C[C@@H]1C[C@H]1c1nnc2ccc(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)nn12	ZINC000853994744	GF	On-Demand	Anodyne	GPR119	18	42
C[C@H]1C[C@H]1c1nnc2ccc(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)nn12	ZINC000853994749	GF	On-Demand	Anodyne	GPR119	18	42
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(C#N)cn1	ZINC000853994779	EF	On-Demand	Mild	GPR119	37	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ncc(C(F)(F)F)s1	ZINC000853994789	GE	On-Demand	Anodyne	CCR3	52	35
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(C2OCCO2)c1	ZINC000853994792	GD	On-Demand	Anodyne	CCR3	44	39
OC[C@@H]1C[C@H]2CC[C@H]1N(c1nccc(N3CCCC3)n1)C2	ZINC000853994814	CD	On-Demand	Anodyne	SORD	54	37
OC[C@H]1C[C@H]2CC[C@H]1N(c1nccc(N3CCCC3)n1)C2	ZINC000853994815	CD	On-Demand	Anodyne	SORD	54	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnccn1	ZINC000853994842	CE	On-Demand	Anodyne	GPR119	42	62
COC(=O)c1cnc([C@@H]2CCCN(c3ccc([N+](=O)[O-])cc3C)C2)s1	ZINC000853994864	FH	On-Demand	Bother	CACNA1D	48	33
COC(=O)c1cnc([C@H]2CCCN(c3ccc([N+](=O)[O-])cc3C)C2)s1	ZINC000853994866	FH	On-Demand	Bother	CACNA1D	48	33
CCOC(=O)Nc1ccc(NC(=O)C(=O)NCC2(O)CCC(C)CC2)cc1	ZINC000853994871	GE	On-Demand	Anodyne	TIMP3	46	31
CC(C)(C)OC(=O)c1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccn1	ZINC000853994895	GH	On-Demand	Anodyne	GPR119	51	45
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@@H]1COC2(CCC2)C1	ZINC000853994925	FD	On-Demand	Anodyne	STAT6	44	32
O=C(NCc1cnc(N2CCOCC2)c(F)c1)N[C@H]1COC2(CCC2)C1	ZINC000853994926	FD	On-Demand	Anodyne	STAT6	44	32
COCCn1cc(NC(=O)C(=O)NC[C@@H](O)c2ccccc2OC)cn1	ZINC000853994936	FC	On-Demand	Anodyne	PANC	45	33
COC(=O)c1cnc([C@@H]2CCCN(c3nc(C)ccc3Cl)C2)s1	ZINC000853994941	FH	On-Demand	Anodyne	PARE	45	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(C(C)(C)C)n1	ZINC000853994942	EG	On-Demand	Anodyne	GPR119	41	48
COC(=O)c1cnc([C@H]2CCCN(c3nc(C)ccc3Cl)C2)s1	ZINC000853994943	FH	On-Demand	Anodyne	PARE	45	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccncc1C(N)=O	ZINC000853994944	ED	On-Demand	Anodyne	GPR119	35	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc(C(F)F)nc2ccccc12	ZINC000853994946	GI	On-Demand	Anodyne	GPR119	33	41
Cn1c(S)nnc1CCNC(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000853994952	GC	On-Demand	Anodyne	STAT6	49	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c1NC(=O)CS2	ZINC000853994953	GE	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1F	ZINC000853994954	DF	On-Demand	Anodyne	GPR119	61	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(C#N)cc1F	ZINC000853994960	EF	On-Demand	Mild	GPR119	50	49
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2ccc(F)cc12	ZINC000853994962	FG	On-Demand	Anodyne	GPR119	54	42
COCCN(CCF)C(=O)NCc1cnc(N2CCOCC2)c(F)c1	ZINC000853994973	FD	On-Demand	Anodyne	STAT6	43	31
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000853994974	FG	On-Demand	Bother	GPR119	20	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccc([N+](=O)[O-])cc2[nH]1	ZINC000853994974	FG	On-Demand	Bother	TXN	17	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(N2CCOCC2)n1	ZINC000853994978	GD	On-Demand	Anodyne	MTOR	28	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(N2CCOCC2)n1	ZINC000853994978	GD	On-Demand	Anodyne	GPR119	39	49
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C#N)c([N+](=O)[O-])c1	ZINC000853994981	FG	On-Demand	Mild	GPR119	30	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N2CCCC2)ncn1	ZINC000853994984	FF	On-Demand	Anodyne	GPR119	52	53
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)sc1C	ZINC000853994990	DG	On-Demand	Anodyne	GPR119	18	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2cccc([N+](=O)[O-])c12	ZINC000853994996	GG	On-Demand	Bother	GPR119	36	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2nnnn2n1	ZINC000853995003	ED	On-Demand	Anodyne	GPR119	25	43
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(N2CCCCC2)c1	ZINC000853995007	GF	On-Demand	Anodyne	CCR3	66	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1c(F)c(F)nc(F)c1F	ZINC000853995028	FG	On-Demand	Anodyne	GPR119	28	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c(F)cccc12	ZINC000853995038	FG	On-Demand	Anodyne	GPR119	48	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(Br)cc1C#N	ZINC000853995040	GG	On-Demand	Mild	GPR119	29	42
CCOC(=O)c1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ncc1Cl	ZINC000853995042	GG	On-Demand	Anodyne	GPR119	24	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(F)(F)F)nn1	ZINC000853995044	FG	On-Demand	Anodyne	GPR119	48	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc2cc(F)cnc12	ZINC000853995051	FG	On-Demand	Anodyne	GPR119	42	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(F)cn1	ZINC000853995053	DF	On-Demand	Anodyne	GPR119	57	48
CCCc1ccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nn1	ZINC000853995055	EG	On-Demand	Anodyne	GPR119	35	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cncc(Br)c1	ZINC000853995068	FG	On-Demand	Anodyne	GPR119	32	44
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(Cl)cc1C#N	ZINC000853995072	FH	On-Demand	Mild	GPR119	22	41
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc(-c2ccccn2)n1	ZINC000853995073	GG	On-Demand	Anodyne	GPR119	30	46
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc(-c2cccnc2)n1	ZINC000853995082	GG	On-Demand	Anodyne	GPR119	20	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N)ccc1[N+](=O)[O-]	ZINC000853995086	EF	On-Demand	Bother	GPR119	26	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2c(n1)CCC2=O	ZINC000853995088	EF	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnc(F)cn1	ZINC000853995091	DE	On-Demand	Anodyne	GPR119	50	47
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccnn1CC1CC1	ZINC000853995095	FD	On-Demand	Anodyne	CCR3	48	34
CCc1nnc2ccc(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)nn12	ZINC000853995096	FE	On-Demand	Anodyne	GPR119	34	45
Cc1nnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c(C#N)c1C	ZINC000853995106	EF	On-Demand	Mild	GPR119	20	40
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccn1	ZINC000853995108	DF	On-Demand	Anodyne	GPR119	55	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2C(=O)NCc1ccc(C(F)F)cc1	ZINC000853995112	GH	On-Demand	Anodyne	GPR119	29	40
CN(C)c1ccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1Cl	ZINC000853995113	GF	On-Demand	Anodyne	CCR3	48	38
CN(C)c1ccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1Cl	ZINC000853995115	GF	On-Demand	Anodyne	CCR3	48	38
CCCn1cc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)cn1	ZINC000853995119	ED	On-Demand	Anodyne	CCR3	46	36
CCCn1cc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)cn1	ZINC000853995121	ED	On-Demand	Anodyne	CCR3	46	36
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@@H]1CCc3ccccc31)CCC2	ZINC000853995128	EH	On-Demand	Anodyne	XIAP	23	44
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@@H]1CCc3ccccc31)CCC2	ZINC000853995128	EH	On-Demand	Anodyne	BIRC3	32	41
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@@H]1CCc3ccccc31)CCC2	ZINC000853995128	EH	On-Demand	Anodyne	BIRC2	44	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(C2CC2)n1	ZINC000853995131	EF	On-Demand	Anodyne	GPR119	39	45
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc(C#N)n1	ZINC000853995137	EF	On-Demand	Mild	GPR119	30	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C#N)cc1F	ZINC000853995152	EG	On-Demand	Mild	GPR119	42	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccnn1	ZINC000853995157	CE	On-Demand	Anodyne	GPR119	43	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(Br)ccn1	ZINC000853995159	FG	On-Demand	Anodyne	GPR119	49	45
C#CCOc1ccc(F)cc1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995160	GE	On-Demand	Mild	CCR3	73	38
C#CCOc1ccc(F)cc1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995161	GE	On-Demand	Mild	CCR3	73	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])s1	ZINC000853995164	EG	On-Demand	Bother	GPR119	31	45
C#Cc1cccnc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853995172	DF	On-Demand	Mild	GPR119	42	43
COC(=O)c1nccnc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853995173	ED	On-Demand	Anodyne	GPR119	42	45
COc1ccc2cc(NC(=O)C(=O)NC[C@@H]3CCCN(CC4CC4)C3)ccc2c1	ZINC000853995180	GG	On-Demand	Anodyne	DRD4	40	30
COc1ccc2cc(NC(=O)C(=O)NC[C@@H]3CCCN(CC4CC4)C3)ccc2c1	ZINC000853995180	GG	On-Demand	Anodyne	CCR3	72	44
COc1ccc2cc(NC(=O)C(=O)NC[C@H]3CCCN(CC4CC4)C3)ccc2c1	ZINC000853995181	GG	On-Demand	Anodyne	DRD4	40	30
COc1ccc2cc(NC(=O)C(=O)NC[C@H]3CCCN(CC4CC4)C3)ccc2c1	ZINC000853995181	GG	On-Demand	Anodyne	CCR3	72	44
CCn1c(=O)c(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc2ccccc21	ZINC000853995186	GG	On-Demand	Anodyne	GPR119	26	43
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@H]2[C@@H](CO)C3)c2nonc12	ZINC000853995222	DD	On-Demand	Bother	GSTM2	110	41
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@H]2[C@@H](CO)C3)c2nonc12	ZINC000853995222	DD	On-Demand	Bother	GSTP1	67	40
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@H]2[C@H](CO)C3)c2nonc12	ZINC000853995223	DD	On-Demand	Bother	GSTM2	110	41
O=[N+]([O-])c1ccc(N2C[C@H]3CC[C@H]2[C@H](CO)C3)c2nonc12	ZINC000853995223	DD	On-Demand	Bother	GSTP1	67	40
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccnc1F	ZINC000853995228	ED	On-Demand	Anodyne	CHRM4	15	44
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccnc1F	ZINC000853995228	ED	On-Demand	Anodyne	CCR3	78	38
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc(C#N)c1[N+](=O)[O-]	ZINC000853995240	FG	On-Demand	Mild	GPR119	19	41
Nc1c(Cl)cc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1Cl	ZINC000853995241	GF	On-Demand	Anodyne	HTR4	28	41
Nc1c(Cl)cc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1Cl	ZINC000853995241	GF	On-Demand	Anodyne	CCR3	40	38
Nc1c(Cl)cc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1Cl	ZINC000853995242	GF	On-Demand	Anodyne	HTR4	28	41
Nc1c(Cl)cc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1Cl	ZINC000853995242	GF	On-Demand	Anodyne	CCR3	40	38
COC(=O)c1cnc([C@H]2CCCN(c3cc(C)nc(N)n3)C2)s1	ZINC000853995243	ED	On-Demand	Anodyne	HRH4	43	38
COC(=O)c1cnc([C@@H]2CCCN(c3cc(C)nc(N)n3)C2)s1	ZINC000853995244	ED	On-Demand	Anodyne	HRH4	43	38
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccnc1Cl	ZINC000853995267	FD	On-Demand	Anodyne	CCR3	39	41
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccnc1Cl	ZINC000853995267	FD	On-Demand	Anodyne	G2YM83_BOTF4	45	32
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853995270	GF	On-Demand	Anodyne	NPY1R	28	42
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853995270	GF	On-Demand	Anodyne	PYGL	31	43
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853995270	GF	On-Demand	Anodyne	PYGM	27	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cncc(-n2cccn2)n1	ZINC000853995273	FE	On-Demand	Anodyne	GPR119	18	42
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853995274	GF	On-Demand	Anodyne	NPY1R	28	42
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853995274	GF	On-Demand	Anodyne	PYGL	31	43
CC(C)n1cc2c(n1)[C@H](NC(=O)N[C@H]1Cc3ccccc3N(C)C1=O)CCC2	ZINC000853995274	GF	On-Demand	Anodyne	PYGM	27	43
CCc1ncnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1F	ZINC000853995276	EF	On-Demand	Anodyne	GPR119	49	44
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc2nncn12	ZINC000853995280	EE	On-Demand	Anodyne	GPR119	23	43
N#CCOc1cc(F)ccc1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995286	GD	On-Demand	Mild	CCR3	69	37
N#CCOc1cc(F)ccc1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995287	GD	On-Demand	Mild	CCR3	69	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc(N)c1Cl	ZINC000853995288	EE	On-Demand	Anodyne	GPR119	37	43
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c2cc[nH]c2n1	ZINC000853995291	EF	On-Demand	Anodyne	JAK1	43	41
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c2cc[nH]c2n1	ZINC000853995291	EF	On-Demand	Anodyne	GPR119	30	40
CC(=O)c1ccc(C(F)(F)F)nc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853995293	GH	On-Demand	Anodyne	GPR119	42	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(F)(F)F)cn1	ZINC000853995294	FH	On-Demand	Anodyne	LIPE	15	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(F)(F)F)cn1	ZINC000853995294	FH	On-Demand	Anodyne	GPR119	50	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc([N+](=O)[O-])cc1Cl	ZINC000853995301	FG	On-Demand	Bother	GPR119	33	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(N[C@H]2CCCOC2)n1	ZINC000853995303	GF	On-Demand	Anodyne	GPR119	19	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(N[C@@H]2CCCOC2)n1	ZINC000853995304	GF	On-Demand	Anodyne	GPR119	19	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1S(C)(=O)=O	ZINC000853995306	FE	On-Demand	Anodyne	GPR119	71	53
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc2c(n1)CCCC2	ZINC000853995311	EF	On-Demand	Anodyne	GPR119	31	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c1CCCC2	ZINC000853995320	EF	On-Demand	Anodyne	GPR119	39	44
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccc1C#N	ZINC000853995322	EF	On-Demand	Mild	GPR119	31	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(C(F)(F)F)n1	ZINC000853995333	FH	On-Demand	Anodyne	GPR119	47	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(C(F)(F)F)n1	ZINC000853995333	FH	On-Demand	Anodyne	SFRP1	43	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1[N+](=O)[O-]	ZINC000853995334	EF	On-Demand	Bother	GPR119	49	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1S(N)(=O)=O	ZINC000853995336	FD	On-Demand	Anodyne	GPR119	59	48
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cnn(C(F)F)c1	ZINC000853995340	FD	On-Demand	Anodyne	CCR3	44	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N2CCSCC2)ncn1	ZINC000853995350	GF	On-Demand	Anodyne	GPR119	43	50
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(-n2cccc2)c1	ZINC000853995353	GF	On-Demand	Anodyne	CCR3	52	43
CC(=O)c1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccc1[N+](=O)[O-]	ZINC000853995357	GG	On-Demand	Bother	GPR119	24	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N2CCCCC2)ncn1	ZINC000853995360	FG	On-Demand	Anodyne	GPR119	50	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2ccccc12	ZINC000853995365	EG	On-Demand	Anodyne	GPR119	51	47
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1c(F)cccc1-n1cccn1	ZINC000853995372	GE	On-Demand	Anodyne	CCR3	87	40
COC(=O)c1cccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995378	EE	On-Demand	Anodyne	GPR119	30	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(F)n1	ZINC000853995389	DF	On-Demand	Anodyne	GPR119	46	44
COC(=O)c1nccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995392	ED	On-Demand	Anodyne	GPR119	44	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc([N+](=O)[O-])cc1F	ZINC000853995405	FF	On-Demand	Bother	GPR119	42	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccccc1S(C)(=O)=O	ZINC000853995407	FF	On-Demand	Anodyne	GPR119	55	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccn2nnnc12	ZINC000853995415	ED	On-Demand	Anodyne	GPR119	26	41
COc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995417	FE	On-Demand	Anodyne	DRD2	36	42
COc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995417	FE	On-Demand	Anodyne	DRD4	21	44
COc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995417	FE	On-Demand	Anodyne	SLC6A1	47	39
COc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995417	FE	On-Demand	Anodyne	CCR3	80	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnc(N2CCCC2=O)cn1	ZINC000853995418	FE	On-Demand	Anodyne	GPR119	38	43
COc1cccc(C)c1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995420	FE	On-Demand	Anodyne	DRD2	36	42
COc1cccc(C)c1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995420	FE	On-Demand	Anodyne	DRD4	21	44
COc1cccc(C)c1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995420	FE	On-Demand	Anodyne	SLC6A1	47	39
COc1cccc(C)c1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995420	FE	On-Demand	Anodyne	CCR3	80	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc([N+](=O)[O-])c(N)n1	ZINC000853995433	FD	On-Demand	Bother	GPR119	26	50
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc(NCCO)c2ccccc2n1	ZINC000853995438	GF	On-Demand	Anodyne	GPR119	25	45
CC(=O)c1ccnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1	ZINC000853995440	EF	On-Demand	Anodyne	GPR119	48	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(C(C)(C)C)ncn1	ZINC000853995442	EG	On-Demand	Anodyne	GPR119	49	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ncccc2cc1C#N	ZINC000853995446	FG	On-Demand	Mild	GPR119	27	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccccn2c1C#N	ZINC000853995448	FF	On-Demand	Mild	GPR119	21	41
Cn1ncc2c(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)nc(N)nc21	ZINC000853995473	FD	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(C#N)c1[N+](=O)[O-]	ZINC000853995497	FG	On-Demand	Mild	GPR119	23	40
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(Cl)n1	ZINC000853995509	FD	On-Demand	Anodyne	CCR3	51	37
CCOC(=O)c1csc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995512	FF	On-Demand	Anodyne	GPR119	20	40
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000853995520	EF	On-Demand	Mild	NQO2	17	40
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000853995520	EF	On-Demand	Mild	MTNR1A	16	42
C#CCCN(CCOC)C(=O)NC[C@@H]1CCCc2cc(OC)ccc21	ZINC000853995520	EF	On-Demand	Mild	EBP	15	43
C#CCCN(CCOC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000853995522	EF	On-Demand	Mild	NQO2	17	40
C#CCCN(CCOC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000853995522	EF	On-Demand	Mild	MTNR1A	16	42
C#CCCN(CCOC)C(=O)NC[C@H]1CCCc2cc(OC)ccc21	ZINC000853995522	EF	On-Demand	Mild	EBP	15	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cncc(C#N)n1	ZINC000853995538	DD	On-Demand	Mild	GPR119	20	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc(F)c1Br	ZINC000853995539	GF	On-Demand	Anodyne	GPR119	48	43
C#CCCN(CCOC)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000853995552	EE	On-Demand	Mild	DRD4	17	49
C#CCCN(CCOC)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000853995553	EE	On-Demand	Mild	DRD4	17	49
C#CCCN(CCOC)C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000853995554	EE	On-Demand	Mild	DRD4	17	49
C#CCCN(CCOC)C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000853995555	EE	On-Demand	Mild	DRD4	17	49
CON(C)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000853995563	DD	On-Demand	Anodyne	DRD4	23	52
CON(C)CCNC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000853995564	DD	On-Demand	Anodyne	DRD4	23	52
CON(C)CCNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000853995565	DD	On-Demand	Anodyne	DRD4	23	52
CON(C)CCNC(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000853995566	DD	On-Demand	Anodyne	DRD4	23	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c(C(N)=O)c1	ZINC000853995593	GE	On-Demand	Bother	GPR119	21	44
CC(C)c1ncsc1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995605	FE	On-Demand	Anodyne	CCR3	42	34
CC(C)c1ncsc1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995606	FE	On-Demand	Anodyne	CCR3	42	34
C#CCOc1cc(F)ccc1NC(=O)C(=O)NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853995613	GE	On-Demand	Mild	CCR3	70	37
C#CCOc1cc(F)ccc1NC(=O)C(=O)NC[C@H]1CCCN(CC2CC2)C1	ZINC000853995615	GE	On-Demand	Mild	CCR3	70	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C#N)nc1	ZINC000853995618	DF	On-Demand	Mild	GPR119	51	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc(O)c2ccccc2n1	ZINC000853995624	FF	On-Demand	Anodyne	GPR119	24	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc(O)c2ccccc2n1	ZINC000853995624	FF	On-Demand	Anodyne	TNKS	59	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(=O)NCCO)nn1	ZINC000853995626	GC	On-Demand	Anodyne	SCD1	49	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(=O)NCCO)nn1	ZINC000853995626	GC	On-Demand	Anodyne	GPR119	27	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(=O)NCCO)nn1	ZINC000853995626	GC	On-Demand	Anodyne	SCD	40	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccnc1C#N	ZINC000853995628	DD	On-Demand	Mild	GPR119	33	43
COC(=O)c1cnc([C@@H]2CCCN(c3cc(Cl)nc(N)n3)C2)s1	ZINC000853995631	FE	On-Demand	Anodyne	HRH4	43	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nnc(Cl)cc1C(N)=O	ZINC000853995632	FD	On-Demand	Anodyne	GPR119	27	41
COC(=O)c1cnc([C@H]2CCCN(c3cc(Cl)nc(N)n3)C2)s1	ZINC000853995633	FE	On-Demand	Anodyne	HRH4	43	37
Cc1cc(C#N)cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995634	EF	On-Demand	Mild	GPR119	23	52
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853995643	FD	On-Demand	Anodyne	DRD4	17	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853995645	FD	On-Demand	Anodyne	DRD4	17	45
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853995647	FD	On-Demand	Anodyne	DRD4	17	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnc(C#N)cn1	ZINC000853995648	DD	On-Demand	Mild	GPR119	30	48
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCCc1nnc(S)n1C	ZINC000853995649	FD	On-Demand	Anodyne	DRD4	17	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N2CCC[C@@H]2CO)ncn1	ZINC000853995659	GE	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1c(C(N)=O)cccc1[N+](=O)[O-]	ZINC000853995661	GE	On-Demand	Bother	GPR119	17	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N2CCC[C@H]2CO)ncn1	ZINC000853995662	GE	On-Demand	Anodyne	GPR119	47	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2ncc([N+](=O)[O-])n2n1	ZINC000853995664	FE	On-Demand	Bother	GPR119	28	44
CCNc1nccnc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853995666	EE	On-Demand	Anodyne	GPR119	39	45
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853995667	FF	On-Demand	Anodyne	DRD4	25	51
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853995667	FF	On-Demand	Anodyne	SIGMAR1	32	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(C(N)=O)cc1Cl	ZINC000853995668	FE	On-Demand	Anodyne	CXCR3	25	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(C(N)=O)cc1Cl	ZINC000853995668	FE	On-Demand	Anodyne	GPR119	33	43
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853995669	FF	On-Demand	Anodyne	DRD4	25	51
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853995669	FF	On-Demand	Anodyne	SIGMAR1	32	40
CCOc1cncc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995670	EE	On-Demand	Anodyne	GPR119	32	46
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853995671	FF	On-Demand	Anodyne	DRD4	25	51
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853995671	FF	On-Demand	Anodyne	SIGMAR1	32	40
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(SC(F)F)nc1	ZINC000853995672	GF	On-Demand	Anodyne	CCR3	62	33
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853995673	FF	On-Demand	Anodyne	DRD4	25	51
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853995673	FF	On-Demand	Anodyne	SIGMAR1	32	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccn2cnnc12	ZINC000853995680	ED	On-Demand	Anodyne	GPR119	24	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccc(N)cc2s1	ZINC000853995682	FG	On-Demand	Anodyne	GPR119	22	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(F)ncn1	ZINC000853995683	DE	On-Demand	Anodyne	GPR119	50	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc(C(F)(F)F)ccc1C#N	ZINC000853995690	GH	On-Demand	Mild	GPR119	44	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C#N)c(N)n1	ZINC000853995693	EE	On-Demand	Mild	GPR119	23	42
COc1cc(C)nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995696	EE	On-Demand	Anodyne	GPR119	23	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(C(F)(F)F)n1	ZINC000853995698	FG	On-Demand	Anodyne	GPR119	53	51
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(NC2CC2)ncn1	ZINC000853995718	EF	On-Demand	Anodyne	GPR119	49	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc2c1C(=O)OC2(C)C	ZINC000853995720	FG	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(Cl)cc1F	ZINC000853995725	EG	On-Demand	Anodyne	GPR119	49	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccccc2cc1C#N	ZINC000853995728	FH	On-Demand	Mild	GPR119	30	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(Cl)c(C#N)n1	ZINC000853995730	EG	On-Demand	Mild	GPR119	19	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccncc1[N+](=O)[O-]	ZINC000853995734	EF	On-Demand	Bother	GPR119	40	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccccc2cc1CO	ZINC000853995738	FG	On-Demand	Anodyne	GPR119	36	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-n2nccn2)cc1	ZINC000853995745	GD	On-Demand	Anodyne	CCR3	42	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc2ccncc12	ZINC000853995752	EG	On-Demand	Anodyne	GPR119	35	45
Cc1cc(C#N)nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995756	EE	On-Demand	Mild	GPR119	27	50
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc2ccc([N+](=O)[O-])cc12	ZINC000853995760	GH	On-Demand	Bother	GPR119	42	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(CO)n1	ZINC000853995784	DD	On-Demand	Anodyne	GPR119	46	51
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N)c([N+](=O)[O-])c(CO)c1	ZINC000853995796	GE	On-Demand	Bother	GPR119	24	41
Cc1cc(C(F)(F)F)c(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nn1	ZINC000853995797	FG	On-Demand	Anodyne	GPR119	32	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(C(F)F)cn1	ZINC000853995798	EG	On-Demand	Anodyne	GPR119	44	56
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(N)c([N+](=O)[O-])n1	ZINC000853995799	EE	On-Demand	Bother	GPR119	21	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2[nH]cnc12	ZINC000853995804	ED	On-Demand	Anodyne	GPR119	33	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2nnc(C(F)(F)F)n2n1	ZINC000853995811	GF	On-Demand	Anodyne	GPR119	23	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccn1	ZINC000853995817	CE	On-Demand	Anodyne	GPR119	54	59
COc1c(C)ncnc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853995852	EE	On-Demand	Anodyne	GPR119	42	50
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cncc(OCCO)n1	ZINC000853995854	FD	On-Demand	Anodyne	GPR119	24	44
Cc1nc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)sc1C	ZINC000853995862	FD	On-Demand	Anodyne	CCR3	63	43
Cc1nc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)sc1C	ZINC000853995863	FD	On-Demand	Anodyne	CCR3	63	43
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(Br)n1	ZINC000853995876	GE	On-Demand	Anodyne	CCR3	52	36
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(F)n1	ZINC000853995883	ED	On-Demand	Anodyne	CCR3	89	39
C#Cc1cccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c1	ZINC000853995884	ED	On-Demand	Mild	CCR3	57	44
C#Cc1cccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)c1	ZINC000853995886	ED	On-Demand	Mild	CCR3	57	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(C(F)(F)F)ccn1	ZINC000853995906	FH	On-Demand	Anodyne	GPR119	48	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cncc(Cl)n1	ZINC000853995907	DF	On-Demand	Anodyne	GPR119	28	47
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(F)nc1	ZINC000853995908	ED	On-Demand	Anodyne	CHRM4	16	41
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(F)nc1	ZINC000853995908	ED	On-Demand	Anodyne	CCR3	97	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(C#N)cnn1	ZINC000853995911	DD	On-Demand	Mild	GPR119	26	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cncc(-n2cncn2)n1	ZINC000853995912	FD	On-Demand	Anodyne	GPR119	20	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(C#N)c1[N+](=O)[O-]	ZINC000853995913	FE	On-Demand	Mild	GPR119	38	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(CO)c(F)cn1	ZINC000853995914	EE	On-Demand	Anodyne	GPR119	47	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(C#N)n1	ZINC000853995915	DD	On-Demand	Mild	GPR119	35	66
Cc1nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)sc1S(N)(=O)=O	ZINC000853995918	GD	On-Demand	Anodyne	GPR119	30	44
Cn1ncc(C#N)c1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853995919	DD	On-Demand	Mild	GPR119	26	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccccc2[nH]1	ZINC000853995925	EG	On-Demand	Anodyne	GPR119	30	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(N2CCOCC2)n1	ZINC000853995926	GD	On-Demand	Anodyne	PIK3CA	15	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(N2CCOCC2)n1	ZINC000853995926	GD	On-Demand	Anodyne	MTOR	27	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(N2CCOCC2)n1	ZINC000853995926	GD	On-Demand	Anodyne	SORD	40	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(N2CCOCC2)n1	ZINC000853995926	GD	On-Demand	Anodyne	GPR119	39	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1c(C#N)cnc2ccccc12	ZINC000853995929	FH	On-Demand	Mild	GPR119	31	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(S(C)(=O)=O)cc1F	ZINC000853995930	GF	On-Demand	Anodyne	SLC6A9	31	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(S(C)(=O)=O)cc1F	ZINC000853995930	GF	On-Demand	Anodyne	GPR119	90	57
C#CCOc1cccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c1	ZINC000853995932	FD	On-Demand	Mild	CCR3	54	41
C#CCOc1cccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c1	ZINC000853995932	FD	On-Demand	Mild	EPHX2	16	40
C#CCOc1cccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)c1	ZINC000853995933	FD	On-Demand	Mild	CCR3	54	41
C#CCOc1cccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)c1	ZINC000853995933	FD	On-Demand	Mild	EPHX2	16	40
Cc1cc(CO)cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995935	EE	On-Demand	Anodyne	GPR119	35	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1sccc1[N+](=O)[O-]	ZINC000853995936	EG	On-Demand	Bother	GPR119	29	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c1CCC2	ZINC000853995943	EF	On-Demand	Anodyne	GPR119	39	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2nnc(C(F)F)n2n1	ZINC000853995950	GF	On-Demand	Anodyne	GPR119	21	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccncc1C#N	ZINC000853995951	DF	On-Demand	Mild	GPR119	41	51
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccn(C(F)F)c1=O	ZINC000853995952	FE	On-Demand	Anodyne	GPR119	25	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000853995953	GD	On-Demand	Bother	GPR119	29	43
Cn1ncc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c1C1CC1	ZINC000853995957	FD	On-Demand	Anodyne	CCR3	55	35
Cn1ncc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)c1C1CC1	ZINC000853995958	FD	On-Demand	Anodyne	CCR3	55	35
COCc1cc([N+](=O)[O-])ccc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853995959	GG	On-Demand	Bother	GPR119	37	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(OC(F)F)cn1	ZINC000853995960	FG	On-Demand	Anodyne	GPR119	44	49
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccnc1C#N	ZINC000853995961	DF	On-Demand	Mild	GPR119	40	43
Cn1ncc2c(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)ncnc21	ZINC000853995962	ED	On-Demand	Anodyne	GPR119	40	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(F)c1[N+](=O)[O-]	ZINC000853995963	FG	On-Demand	Bother	GPR119	38	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc2c(N)cccc12	ZINC000853995964	FG	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(NCC2CC2)ncn1	ZINC000853995967	FF	On-Demand	Anodyne	GPR119	48	43
COC(=O)c1ccc([N+](=O)[O-])c(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995968	GE	On-Demand	Bother	GPR119	23	41
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc(-c2ccncc2)n1	ZINC000853995973	GG	On-Demand	Anodyne	GPR119	27	42
COC(=O)c1cc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)ccc1F	ZINC000853995974	GD	On-Demand	Anodyne	CCR3	76	46
COC(=O)c1cc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)ccc1F	ZINC000853995975	GD	On-Demand	Anodyne	CCR3	76	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1C#N	ZINC000853995976	DF	On-Demand	Mild	GPR119	50	43
Cc1nnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc1C	ZINC000853995978	DE	On-Demand	Anodyne	GPR119	22	47
COc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ncn1	ZINC000853995981	DE	On-Demand	Anodyne	GPR119	47	45
CC(C)c1nnc2c(N3[C@H]4CC[C@H]3CN(C(=O)OC(C)(C)C)C4)nccn12	ZINC000853995986	FF	On-Demand	Anodyne	GPR119	24	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c1ncn2C1CC1	ZINC000853995989	FF	On-Demand	Anodyne	ADCY5	25	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c1ncn2C1CC1	ZINC000853995989	FF	On-Demand	Anodyne	OXGR1	54	34
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c1ncn2C1CC1	ZINC000853995989	FF	On-Demand	Anodyne	GPR119	33	41
CCOC(=O)c1nccc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853995990	FE	On-Demand	Anodyne	GPR119	48	44
C#Cc1cc(F)c(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c(F)c1	ZINC000853995995	GE	On-Demand	Mild	CCR3	56	35
C#Cc1cc(F)c(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)c(F)c1	ZINC000853995996	GE	On-Demand	Mild	CCR3	56	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(Cl)cn1	ZINC000853995997	DG	On-Demand	Anodyne	GPR119	52	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(Br)cn1	ZINC000853995998	FG	On-Demand	Anodyne	GPR119	47	48
C#Cc1cnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc1	ZINC000853995999	DE	On-Demand	Mild	GPR119	41	56
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(=O)NC2CC2)cn1	ZINC000853996000	FF	On-Demand	Anodyne	MAPK13	54	33
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(=O)NC2CC2)cn1	ZINC000853996000	FF	On-Demand	Anodyne	GPR119	42	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(=O)NC2CC2)cn1	ZINC000853996000	FF	On-Demand	Anodyne	HPGDS	35	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2nnc(C3CC3)n2n1	ZINC000853996003	FF	On-Demand	Anodyne	GPR119	18	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccsc1[N+](=O)[O-]	ZINC000853996006	EG	On-Demand	Bother	GPR119	19	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(-c2cnco2)c1	ZINC000853996035	GF	On-Demand	Anodyne	CCR3	59	57
Cn1cc(-c2cc3c(nn2)CCN(C(=O)NCc2ccc(C(F)F)cc2)C3)cn1	ZINC000853996053	GG	On-Demand	Anodyne	MAPK1	45	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853996057	GH	On-Demand	Anodyne	SLC6A1	70	38
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853996057	GH	On-Demand	Anodyne	CCR3	52	41
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853996057	GH	On-Demand	Anodyne	CHRNA7	19	44
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-c2ccccc2)cc1	ZINC000853996057	GH	On-Demand	Anodyne	PRNP	39	40
CCCc1ccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853996075	FF	On-Demand	Anodyne	CCR3	95	43
CCCc1ccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853996076	FF	On-Demand	Anodyne	CCR3	95	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccccc1[N+](=O)[O-]	ZINC000853996095	EG	On-Demand	Bother	GPR119	38	45
Cc1cc(C(F)(F)F)nc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853996107	FG	On-Demand	Anodyne	GPR119	35	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1C(F)(F)F	ZINC000853996108	FH	On-Demand	Anodyne	TRPV1	26	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1C(F)(F)F	ZINC000853996108	FH	On-Demand	Anodyne	GPR119	50	44
COC(=O)c1cnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc1	ZINC000853996109	ED	On-Demand	Anodyne	GPR119	42	56
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N2CCOCC2)ncn1	ZINC000853996111	GD	On-Demand	Anodyne	MTOR	20	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(N2CCOCC2)ncn1	ZINC000853996111	GD	On-Demand	Anodyne	GPR119	44	50
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(Br)cnc1C#N	ZINC000853996113	GG	On-Demand	Mild	GPR119	36	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc([N+](=O)[O-])s1	ZINC000853996114	EF	On-Demand	Bother	GPR119	39	48
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC000853996116	GE	On-Demand	Anodyne	CCR3	75	36
Cn1ccnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)c1=O	ZINC000853996119	DD	On-Demand	Anodyne	GPR119	32	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc(C(F)(F)F)cs1	ZINC000853996120	FH	On-Demand	Anodyne	GPR119	35	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(C#N)c1	ZINC000853996122	DF	On-Demand	Mild	GPR119	48	48
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnc2ccccc2n1	ZINC000853996124	EG	On-Demand	Anodyne	GPR119	42	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc(Cl)c1	ZINC000853996125	DG	On-Demand	Anodyne	GPR119	53	46
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ncn1	ZINC000853996126	DE	On-Demand	Anodyne	GPR119	50	45
Cc1nsc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853996127	DE	On-Demand	Anodyne	GPR119	18	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccnc1[N+](=O)[O-]	ZINC000853996128	EF	On-Demand	Bother	GPR119	43	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncccc1Br	ZINC000853996131	FG	On-Demand	Anodyne	GPR119	56	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(N2CCCC2)n1	ZINC000853996132	FF	On-Demand	Anodyne	GPR119	45	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cc(C#N)ccn1	ZINC000853996133	DF	On-Demand	Mild	GPR119	46	48
COc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccc1[N+](=O)[O-]	ZINC000853996134	FG	On-Demand	Bother	GPR119	29	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(OCC(F)(F)F)nn1	ZINC000853996136	GG	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])c(C#N)c1	ZINC000853996137	FG	On-Demand	Mild	GPR119	29	40
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2cccc(F)c12	ZINC000853996144	FG	On-Demand	Anodyne	GPR119	50	42
Cc1cncc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853996147	DE	On-Demand	Anodyne	GPR119	32	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnccc1C#N	ZINC000853996148	DF	On-Demand	Mild	GPR119	48	50
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc(C2CC2)n1	ZINC000853996149	EG	On-Demand	Anodyne	GPR119	20	45
COC(=O)c1cncc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853996150	ED	On-Demand	Anodyne	GPR119	24	44
CN(C)C(=O)c1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ccn1	ZINC000853996151	FE	On-Demand	Anodyne	GPR119	46	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccnc2cccnc12	ZINC000853996152	EG	On-Demand	Anodyne	GPR119	33	43
CCOc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)ncn1	ZINC000853996156	EE	On-Demand	Anodyne	GPR119	50	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nnc(-c2ccccn2)s1	ZINC000853996157	FG	On-Demand	Anodyne	GPR119	24	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2[nH]ccc12	ZINC000853996158	EF	On-Demand	Anodyne	AKT2	47	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2[nH]ccc12	ZINC000853996158	EF	On-Demand	Anodyne	JAK3	28	52
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2[nH]ccc12	ZINC000853996158	EF	On-Demand	Anodyne	JAK1	64	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2[nH]ccc12	ZINC000853996158	EF	On-Demand	Anodyne	JAK2	19	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2[nH]ccc12	ZINC000853996158	EF	On-Demand	Anodyne	GPR119	43	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1c(Cl)cncc1[N+](=O)[O-]	ZINC000853996159	FG	On-Demand	Bother	GPR119	20	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(S(N)(=O)=O)cc1C#N	ZINC000853996160	GD	On-Demand	Mild	GPR119	41	35
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cnn(Cc2ccccc2)c(=O)c1	ZINC000853996164	GF	On-Demand	Anodyne	GPR119	41	44
COC(=O)c1cncnc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853996168	ED	On-Demand	Anodyne	GPR119	40	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(Cl)s1	ZINC000853996170	EG	On-Demand	Anodyne	GPR119	34	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccnc1OC(F)F	ZINC000853996171	FF	On-Demand	Anodyne	GPR119	34	43
Cn1cnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)cc1=O	ZINC000853996172	DD	On-Demand	Anodyne	GPR119	29	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nc2ccccn2c1[N+](=O)[O-]	ZINC000853996175	FF	On-Demand	Bother	GPR119	19	42
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(C#N)cc1Cl	ZINC000853996176	EG	On-Demand	Mild	GPR119	39	43
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(Cl)nc1	ZINC000853996177	FD	On-Demand	Anodyne	CCR3	64	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000853996184	GD	On-Demand	Bother	GPR119	30	42
CN(C)S(=O)(=O)c1ccccc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853996185	GF	On-Demand	Anodyne	GPR119	43	45
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2sccc12	ZINC000853996187	EG	On-Demand	Anodyne	GPR119	44	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc(Br)cn1	ZINC000853996189	FF	On-Demand	Anodyne	GPR119	43	59
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncnc2c1cnn2C(C)(C)C	ZINC000853996190	GG	On-Demand	Anodyne	GPR119	40	37
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C(N)=O)nn1	ZINC000853996193	ED	On-Demand	Anodyne	GPR119	33	44
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2nnc(C(C)(C)C)n2n1	ZINC000853996195	GG	On-Demand	Anodyne	GPR119	20	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc2ccccc2c1	ZINC000853996212	FG	On-Demand	Anodyne	CCR3	57	46
Cn1cnc([N+](=O)[O-])c1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853996245	ED	On-Demand	Bother	GPR119	26	43
CN(C)c1ccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)cc1	ZINC000853996252	FD	On-Demand	Anodyne	CCR3	51	38
CN(C)c1ccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)cc1	ZINC000853996253	FD	On-Demand	Anodyne	CCR3	51	38
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1nnnn1-c1ccccc1	ZINC000853996277	FE	On-Demand	Anodyne	GPR119	24	41
COc1ccnc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)n1	ZINC000853996284	DE	On-Demand	Anodyne	GPR119	48	50
O=C(NC1CC(OCc2ccccc2)C1)N[C@@H]1C[C@H](O)c2ccccc21	ZINC000853996318	FG	On-Demand	Anodyne	NAAA	40	37
O=C(NC1CC(OCc2ccccc2)C1)N[C@H]1C[C@H](O)c2ccccc21	ZINC000853996319	FG	On-Demand	Anodyne	NAAA	40	37
O=C(NC1CC(OCc2ccccc2)C1)N[C@@H]1C[C@@H](O)c2ccccc21	ZINC000853996320	FG	On-Demand	Anodyne	NAAA	40	37
O=C(NC1CC(OCc2ccccc2)C1)N[C@H]1C[C@@H](O)c2ccccc21	ZINC000853996321	FG	On-Demand	Anodyne	NAAA	40	37
C[C@H](Sc1nnc(CN2CCCCC2)n1-c1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853996336	JJ	On-Demand	Anodyne	KCNQ2	17	47
C[C@@H](Sc1nnc(CN2CCCCC2)n1-c1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1	ZINC000853996337	JJ	On-Demand	Anodyne	KCNQ2	17	47
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1cccc(F)c1C#N	ZINC000853996368	EG	On-Demand	Mild	GPR119	36	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1cccc(SC(F)F)c1	ZINC000853996415	GG	On-Demand	Anodyne	CCR3	57	40
COc1ccc2c(NCCOCCF)ccnc2c1	ZINC000853996420	CF	On-Demand	Anodyne	HRP1_PLAFA	119	45
COc1ccc2c(NCCOCCF)ccnc2c1	ZINC000853996420	CF	On-Demand	Anodyne	HNMT	65	38
COc1ccc2c(NCCOCCF)ccnc2c1	ZINC000853996420	CF	On-Demand	Anodyne	BOTA	19	44
N#CCOc1cccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c1	ZINC000853996442	FD	On-Demand	Mild	CCR3	60	41
N#CCOc1cccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)c1	ZINC000853996443	FD	On-Demand	Mild	CCR3	60	41
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccccc1SC(F)F	ZINC000853996450	GG	On-Demand	Anodyne	CCR3	52	39
CC(=O)c1c(F)cccc1N1[C@H]2CC[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000853996455	EH	On-Demand	Anodyne	GPR119	34	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ncc([N+](=O)[O-])cc1C#N	ZINC000853996462	FE	On-Demand	Mild	GPR119	29	42
Cc1cc(N2[C@H]3CC[C@H]2CN(C(=O)OC(C)(C)C)C3)nc(N)n1	ZINC000853996464	DD	On-Demand	Anodyne	GPR119	26	46
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc([N+](=O)[O-])cc1	ZINC000853996467	EG	On-Demand	Bother	GPR119	43	47
COC(=O)Nc1cccc(NC(=O)C(=O)NC[C@@H]2CCCN(CC3CC3)C2)c1	ZINC000853996473	GE	On-Demand	Anodyne	CCR3	71	43
COC(=O)Nc1cccc(NC(=O)C(=O)NC[C@H]2CCCN(CC3CC3)C2)c1	ZINC000853996474	GE	On-Demand	Anodyne	CCR3	71	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccccn1	ZINC000853996476	CF	On-Demand	Anodyne	GPR119	54	62
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(C#N)cc1	ZINC000853996483	DG	On-Demand	Mild	GPR119	41	47
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(N2CCCCC2)cc1	ZINC000853996488	GF	On-Demand	Anodyne	CCR3	60	41
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc2nncn2n1	ZINC000853996506	ED	On-Demand	Anodyne	GPR119	23	43
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](C1)N2c1ccc(S(C)(=O)=O)cc1	ZINC000853996519	FF	On-Demand	Anodyne	GPR119	81	66
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-n2nccn2)nc1	ZINC000853996540	GC	On-Demand	Anodyne	CCR3	44	35
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000853996584	GG	On-Demand	Anodyne	CCR3	43	38
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-n2ccnc2)nc1	ZINC000853996590	GD	On-Demand	Anodyne	CCR3	38	42
O=C(NC[C@H]1CCCN(CC2CC2)C1)C(=O)Nc1ccc(-n2ccnc2)nc1	ZINC000853996590	GD	On-Demand	Anodyne	NOS2	45	33
O=C1C[C@@H]2CC[C@H](C1)N2C(=O)NCCCCCCOc1ccc(Cl)cc1	ZINC000853996623	GI	On-Demand	Anodyne	ASAH1	50	32
COC[C@H](NC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853996686	GF	On-Demand	Anodyne	MTNR1A	27	41
COC[C@H](NC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853996686	GF	On-Demand	Anodyne	MTNR1B	28	41
COC[C@@H](NC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853996687	GF	On-Demand	Anodyne	MTNR1A	27	41
COC[C@@H](NC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)c1cccc(OC)c1	ZINC000853996687	GF	On-Demand	Anodyne	MTNR1B	28	41
CON(C)CCNC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000853996736	DE	On-Demand	Anodyne	CYP11B1	17	42
CON(C)CCNC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000853996736	DE	On-Demand	Anodyne	PTAFR	15	42
CON(C)CCNC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000853996736	DE	On-Demand	Anodyne	CYP11B2	35	42
CON(C)CCNC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000853996736	DE	On-Demand	Anodyne	ROCK1	28	40
CON(C)CCNC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000853996736	DE	On-Demand	Anodyne	ROCK2	40	44
CON(C)CCNC(=O)NCc1cccc(-c2cccnc2)c1	ZINC000853996736	DE	On-Demand	Anodyne	NAMPT	50	40
COC(=O)c1cccc(NC[C@@H]2CCCN(CC3CC3)C2)n1	ZINC000853996749	DE	On-Demand	Anodyne	CCR3	50	34
COC(=O)c1cccc(NC[C@H]2CCCN(CC3CC3)C2)n1	ZINC000853996750	DE	On-Demand	Anodyne	CCR3	50	34
COC(=O)c1nc2nc(C)cc(NC[C@@H](O)c3ccccc3OC)n2n1	ZINC000853996757	FD	On-Demand	Anodyne	ALS	40	32
C#CCCN(CCOC)C(=O)NCc1cccc(-c2cccnc2)c1	ZINC000853996768	EF	On-Demand	Mild	ROCK2	41	35
CCCc1ccc(NC(=O)C(=O)N[C@H]2CCc3ccccc3-n3ccnc32)cc1	ZINC000853996891	GH	On-Demand	Anodyne	CFTR	45	36
CCCc1ccc(NC(=O)C(=O)N[C@@H]2CCc3ccccc3-n3ccnc32)cc1	ZINC000853996892	GH	On-Demand	Anodyne	CFTR	45	36
O=C(NCCCCCCOc1ccc(Cl)cc1)N1CCC(O)(CO)CC1	ZINC000853996937	GF	On-Demand	Anodyne	PLA2G4B	53	32
O=C(NCCCCCCOc1ccc(Cl)cc1)N1CCC(O)(CO)CC1	ZINC000853996937	GF	On-Demand	Anodyne	EPHX2	18	42
COC1(c2noc(CC3CCN(c4ccnc(C(C)C)n4)CC3)n2)CCCC1	ZINC000853997030	GH	On-Demand	Anodyne	SORD	69	35
FC(F)(F)c1ccncc1CNc1ncc2c(n1)CCCC2	ZINC000853997228	DG	On-Demand	Anodyne	PTK2	49	31
Cc1cc(C(F)(F)F)c(NCc2cnccc2C(F)(F)F)nn1	ZINC000853997264	EH	On-Demand	Anodyne	PTK2	40	32
C[C@H]1c2ccccc2OCCN1C(=O)C(=O)Nc1cnn(CC#N)c1	ZINC000853997275	ED	On-Demand	Mild	PANC	45	33
O=C(NCCCCCCOc1ccc(Cl)cc1)N1CC[C@H](O)C(F)(F)C1	ZINC000853997404	GH	On-Demand	Anodyne	EPHX2	22	41
O=C(NCCCCCCOc1ccc(Cl)cc1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853997405	GH	On-Demand	Anodyne	EPHX2	22	41
CS(=O)(=O)C1CN(C(=O)NCCCCCCOc2ccc(Cl)cc2)C1	ZINC000853997418	GF	On-Demand	Anodyne	HRH2	18	40
CS(=O)(=O)C1CN(C(=O)NCCCCCCOc2ccc(Cl)cc2)C1	ZINC000853997418	GF	On-Demand	Anodyne	MMP13	22	41
CS(=O)(=O)C1CN(C(=O)NCCCCCCOc2ccc(Cl)cc2)C1	ZINC000853997418	GF	On-Demand	Anodyne	PLA2G4B	46	31
CS(=O)(=O)C1CN(C(=O)NCCCCCCOc2ccc(Cl)cc2)C1	ZINC000853997418	GF	On-Demand	Anodyne	MMP7	15	41
CS(=O)(=O)C1CN(C(=O)NCCCCCCOc2ccc(Cl)cc2)C1	ZINC000853997418	GF	On-Demand	Anodyne	ASAH1	49	31
Cc1nc(NC(=O)C(=O)N2CCOc3ccccc3[C@H]2C)sc1C	ZINC000853997468	EF	On-Demand	Anodyne	TRPC6	25	40
Cc1nc(NC(=O)C(=O)N2CCOc3ccccc3[C@H]2C)sc1C	ZINC000853997468	EF	On-Demand	Anodyne	TRPC3	17	40
Cc1nc(NC(=O)C(=O)N2CCOc3ccccc3[C@@H]2C)sc1C	ZINC000853997469	EF	On-Demand	Anodyne	TRPC6	25	40
Cc1nc(NC(=O)C(=O)N2CCOc3ccccc3[C@@H]2C)sc1C	ZINC000853997469	EF	On-Demand	Anodyne	TRPC3	17	40
CC[C@@H](O)CNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C	ZINC000853997547	CC	On-Demand	Anodyne	CTSK	15	42
CC[C@H](C)N(CC)C(=O)N[C@H](C)CNC(=O)OC(C)(C)C	ZINC000853997585	DF	On-Demand	Anodyne	CTSK	15	41
C[C@H]1c2ccccc2OCCN1C(=O)C(=O)Nc1cnn(C(F)F)c1	ZINC000853997653	FE	On-Demand	Anodyne	ITK	50	33
CN(C)[C@@H](CNC(=O)NCc1ncccn1)c1cccc(C(F)(F)F)c1	ZINC000853997792	FF	On-Demand	Anodyne	PDS	40	35
C[C@@H](CCNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)N(C)C	ZINC000853997828	DD	On-Demand	Anodyne	CTSK	16	40
C[C@@H](CCNC(=O)N[C@H](C)CNC(=O)OC(C)(C)C)N(C)C	ZINC000853997828	DD	On-Demand	Anodyne	CHRNA4	17	42
CN(C)[C@@H](CNC(=O)N[C@@H]1C=CCC1)c1cccc(C(F)(F)F)c1	ZINC000853997864	EG	On-Demand	Anodyne	CCR2	44	39
CN(C)[C@@H](CNC(=O)N[C@H]1C=CCC1)c1cccc(C(F)(F)F)c1	ZINC000853997865	EG	On-Demand	Anodyne	CCR2	44	39
C[C@H]1c2ccccc2OCCN1C(=O)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853997991	GE	On-Demand	Anodyne	MTOR	54	37
C[C@H]1c2ccccc2OCCN1C(=O)C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000853997991	GE	On-Demand	Anodyne	STAT6	52	33
CN1CCN(C(=O)NCCCCCCOc2ccc(Cl)cc2)CCC1=O	ZINC000853998008	GG	On-Demand	Anodyne	HRH3	20	40
CN1CCN(C(=O)NCCCCCCOc2ccc(Cl)cc2)CCC1=O	ZINC000853998008	GG	On-Demand	Anodyne	ASAH1	53	32
CN(C)[C@@H](CNC(=O)N[C@H]1COC2(CCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000853998012	GG	On-Demand	Anodyne	CCR2	45	36
CN(C)[C@@H](CNC(=O)N[C@@H]1COC2(CCC2)C1)c1cccc(C(F)(F)F)c1	ZINC000853998014	GG	On-Demand	Anodyne	CCR2	45	36
O=C(NCCCCCCOc1ccc(Cl)cc1)N1CCC(CO)(CO)C1	ZINC000853998021	GF	On-Demand	Anodyne	EPHX2	21	42
C[C@@H](Nc1nccc(N2CCCC2)n1)c1ccc2c(c1)CCCO2	ZINC000853998075	DH	On-Demand	Anodyne	SORD	55	33
C[C@H]1c2ccccc2OCCN1C(=O)C(=O)Nc1ccc(N2CCCC2)c(F)c1	ZINC000853998179	GG	On-Demand	Anodyne	NPY2R	104	42
O=C(NCCCCCCOc1ccc(Cl)cc1)NC1CC(CO)C1	ZINC000853998246	FG	On-Demand	Anodyne	EPHX2	24	44
CO[C@]1(CO)CCCN(C(=O)NCCCCCCOc2ccc(Cl)cc2)C1	ZINC000853998288	GG	On-Demand	Anodyne	EPHX2	20	47
O=C(NCCCCCCOc1ccc(Cl)cc1)N1CCC2(COC2)C1	ZINC000853998337	FH	On-Demand	Anodyne	EPHX2	32	41
CCCn1cc(NC(=O)C(=O)N2CCOc3ccccc3[C@H]2C)cn1	ZINC000853998583	EE	On-Demand	Anodyne	PANC	50	33
CCCn1cc(NC(=O)C(=O)N2CCOc3ccccc3[C@@H]2C)cn1	ZINC000853998584	EE	On-Demand	Anodyne	PANC	50	33
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCCC2(CCCC2)CC1	ZINC000853998738	FH	On-Demand	Anodyne	EPHX2	15	41
CC(=O)c1c(F)cccc1NC[C@@H]1CCCN(CC2CC2)C1	ZINC000853998807	DH	On-Demand	Anodyne	CCR3	82	41
CC(=O)c1c(F)cccc1NC[C@H]1CCCN(CC2CC2)C1	ZINC000853998808	DH	On-Demand	Anodyne	CCR3	82	41
CON(C)CCNC(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000853998856	FF	On-Demand	Anodyne	GYS1	65	34
CCN1CC[C@H](N(CC)C(=O)NC2CCC(O)(c3cccnc3)CC2)C1	ZINC000853998917	FE	On-Demand	Anodyne	CCR2	17	42
CCN1CC[C@@H](N(CC)C(=O)NC2CCC(O)(c3cccnc3)CC2)C1	ZINC000853998918	FE	On-Demand	Anodyne	CCR2	17	42
COC(=O)c1sc(NC[C@H]2CCCN(CC3CC3)C2)nc1Cl	ZINC000853998938	EG	On-Demand	Anodyne	CCR3	46	38
COC(=O)c1sc(NC[C@@H]2CCCN(CC3CC3)C2)nc1Cl	ZINC000853998940	EG	On-Demand	Anodyne	CCR3	46	38
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853999013	GD	On-Demand	Anodyne	CHRNA7	42	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(N2CC[C@H](O)C2)CC1	ZINC000853999013	GD	On-Demand	Anodyne	CCR2	15	47
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853999015	GD	On-Demand	Anodyne	CHRNA7	42	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(N2CC[C@@H](O)C2)CC1	ZINC000853999015	GD	On-Demand	Anodyne	CCR2	15	47
CO[C@]1(CO)CCCN(C(=O)NC2CCC(O)(c3cccnc3)CC2)C1	ZINC000853999125	FD	On-Demand	Anodyne	EPHX2	16	46
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(n2cnnc2O)CC1	ZINC000853999128	GD	On-Demand	Anodyne	C3AR1	40	38
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853999342	EF	On-Demand	Anodyne	C3AR1	40	38
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC[C@@H](CCF)C1	ZINC000853999342	EF	On-Demand	Anodyne	CCR2	16	44
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853999343	EF	On-Demand	Anodyne	C3AR1	40	38
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC[C@H](CCF)C1	ZINC000853999343	EF	On-Demand	Anodyne	CCR2	16	44
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@H]2C[C@H]2C1	ZINC000853999346	DE	On-Demand	Anodyne	CHRNA7	43	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H]2C[C@@H]2C1	ZINC000853999347	DE	On-Demand	Anodyne	CHRNA7	43	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H]2C[C@H]2C1	ZINC000853999348	DE	On-Demand	Anodyne	CHRNA7	43	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@H]2C[C@@H]2C1	ZINC000853999349	DE	On-Demand	Anodyne	CHRNA7	43	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@H]2COC[C@H]2C1	ZINC000853999350	ED	On-Demand	Anodyne	CHRNA7	43	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@H]2COC[C@@H]2C1	ZINC000853999351	ED	On-Demand	Anodyne	CHRNA7	43	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H]2COC[C@H]2C1	ZINC000853999352	ED	On-Demand	Anodyne	CHRNA7	43	35
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H]2COC[C@@H]2C1	ZINC000853999353	ED	On-Demand	Anodyne	CHRNA7	43	35
CC1(C)CCN(C(=O)NC2CCC(O)(c3cccnc3)CC2)CC(C)(C)C1	ZINC000853999354	FI	On-Demand	Anodyne	C3AR1	37	40
Cc1ccc(CC2CN(C(=O)NC3CCC(O)(c4cccnc4)CC3)C2)cc1	ZINC000853999373	GG	On-Demand	Anodyne	CHRNA7	41	35
Cc1ccc(CC2CN(C(=O)NC3CCC(O)(c4cccnc4)CC3)C2)cc1	ZINC000853999373	GG	On-Demand	Anodyne	C3AR1	37	41
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@H](O)C(F)(F)C1	ZINC000853999385	FD	On-Demand	Anodyne	C3AR1	42	43
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H](O)C(F)(F)C1	ZINC000853999386	FD	On-Demand	Anodyne	C3AR1	42	43
C#CCCN(CCOC)C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000853999465	GH	On-Demand	Mild	GYS1	47	36
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853999528	FG	On-Demand	Anodyne	CHRNA7	44	36
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853999528	FG	On-Demand	Anodyne	C3AR1	43	41
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(C2CCC2)CC1	ZINC000853999528	FG	On-Demand	Anodyne	EPHX2	23	42
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC[C@@H](C2CCCCC2)C1	ZINC000853999541	GI	On-Demand	Anodyne	C3AR1	43	41
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC[C@H](C2CCCCC2)C1	ZINC000853999542	GI	On-Demand	Anodyne	C3AR1	43	41
CC(C)c1ccc2c(c1)CN(C(=O)NC1CCC(O)(c3cccnc3)CC1)CC2	ZINC000853999554	GI	On-Demand	Anodyne	CCR2	16	41
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H](C2CCCCC2)C1	ZINC000853999557	FH	On-Demand	Anodyne	CHRNA7	40	34
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H](C2CCCCC2)C1	ZINC000853999557	FH	On-Demand	Anodyne	C3AR1	46	43
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@H](C2CCCCC2)C1	ZINC000853999558	FH	On-Demand	Anodyne	CHRNA7	40	34
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@H](C2CCCCC2)C1	ZINC000853999558	FH	On-Demand	Anodyne	C3AR1	46	43
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC(c2ccon2)CC1	ZINC000853999562	FF	On-Demand	Anodyne	SMO	31	45
O=[N+]([O-])c1ccc(NC[C@H]2CCCN(CC3CC3)C2)c2nonc12	ZINC000853999604	EF	On-Demand	Bother	GSTM2	107	49
O=[N+]([O-])c1ccc(NC[C@H]2CCCN(CC3CC3)C2)c2nonc12	ZINC000853999604	EF	On-Demand	Bother	GSTP1	66	49
O=[N+]([O-])c1ccc(NC[C@H]2CCCN(CC3CC3)C2)c2nonc12	ZINC000853999604	EF	On-Demand	Bother	EPAS1	41	32
O=[N+]([O-])c1ccc(NC[C@@H]2CCCN(CC3CC3)C2)c2nonc12	ZINC000853999605	EF	On-Demand	Bother	GSTM2	107	49
O=[N+]([O-])c1ccc(NC[C@@H]2CCCN(CC3CC3)C2)c2nonc12	ZINC000853999605	EF	On-Demand	Bother	GSTP1	66	49
O=[N+]([O-])c1ccc(NC[C@@H]2CCCN(CC3CC3)C2)c2nonc12	ZINC000853999605	EF	On-Demand	Bother	EPAS1	41	32
c1cc(N2CCCC2)nc(NC[C@@H]2CCCN(CC3CC3)C2)n1	ZINC000853999622	DF	On-Demand	Anodyne	MRGPRX1	41	36
c1cc(N2CCCC2)nc(NC[C@H]2CCCN(CC3CC3)C2)n1	ZINC000853999623	DF	On-Demand	Anodyne	MRGPRX1	41	36
CCC1(CC)CCCN(C(=O)NC2CCC(O)(c3cccnc3)CC2)C1	ZINC000853999722	FH	On-Demand	Anodyne	EPHX2	19	46
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCCC[C@@H]1c1nc[nH]n1	ZINC000853999726	FE	On-Demand	Anodyne	CPT1A	90	38
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCCC[C@H]1c1nc[nH]n1	ZINC000853999727	FE	On-Demand	Anodyne	CPT1A	90	38
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC([C@@H]2CCCCO2)CC1	ZINC000853999730	GG	On-Demand	Anodyne	C3AR1	41	38
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CCC([C@H]2CCCCO2)CC1	ZINC000853999731	GG	On-Demand	Anodyne	C3AR1	41	38
Cc1nc(NC(=O)C(=O)N2CCO[C@@](C)(C(F)F)C2)sc1-c1ccccc1	ZINC000853999769	GF	On-Demand	Anodyne	PIK3CG	20	41
Cc1nc(NC(=O)C(=O)N2CCO[C@](C)(C(F)F)C2)sc1-c1ccccc1	ZINC000853999770	GF	On-Demand	Anodyne	PIK3CG	20	41
COCCN(CCF)C(=O)NCc1ccc(OCc2ccccc2F)cc1	ZINC000853999794	GH	On-Demand	Anodyne	GYS1	44	36
CON(C)CCNC(=O)NCCc1c(C)oc2ccccc12	ZINC000853999854	DE	On-Demand	Anodyne	MTNR1A	35	46
CON(C)CCNC(=O)NCCc1c(C)oc2ccccc12	ZINC000853999854	DE	On-Demand	Anodyne	MTNR1B	30	46
CCCn1cc(NC(=O)C(=O)NCc2ccnn2CC)cn1	ZINC000853999889	DC	On-Demand	Anodyne	PANC	50	32
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853999926	GG	On-Demand	Anodyne	C3AR1	41	41
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853999926	GG	On-Demand	Anodyne	CCR2	16	42
O=C(NC1CCC(O)(c2cccnc2)CC1)N1CC[C@@H](Oc2ccccc2)C1	ZINC000853999926	GG	On-Demand	Anodyne	EPHX2	34	54
C=CCN(C(=O)NC1CCC(O)(c2cccnc2)CC1)[C@@H](C)COC	ZINC000853999956	EE	On-Demand	Mild	KCNA3	15	40
C=CCN(C(=O)NC1CCC(O)(c2cccnc2)CC1)[C@H](C)COC	ZINC000853999957	EE	On-Demand	Mild	KCNA3	15	40
O=C(NCC1CCC(O)CC1)NC1CCC(O)(c2cccnc2)CC1	ZINC000853999961	EE	On-Demand	Anodyne	NAMPT	23	41